data_2lmv_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 2lmv _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.415 HD11 ' SD ' ' A' ' 76' ' ' MET . 0.6 OUTLIER . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.705 0.288 . . . . 2.0 110.35 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.48 ' HG1' ' HG2' ' A' ' 7' ' ' GLU . 74.0 p -70.01 -177.63 1.39 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.42 -0.355 . . . . 1.72 111.341 -179.766 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -63.41 -48.02 79.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.435 -0.348 . . . . 2.2 111.492 -179.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.48 ' HG2' ' HG1' ' A' ' 5' ' ' THR . 12.4 pt-20 -67.14 -41.54 85.91 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.976 0.417 . . . . 1.35 110.906 -179.425 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . 0.54 ' HA ' HE21 ' A' ' 8' ' ' GLN . 0.0 OUTLIER -64.28 -45.63 87.2 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.822 -0.627 . . . . 2.34 111.037 179.948 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . 0.52 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 56.5 mt -58.1 -51.16 74.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.432 -0.349 . . . . 1.27 110.543 179.526 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.87 -19.26 65.7 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.149 -0.478 . . . . 1.22 111.189 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -72.44 -56.57 5.21 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.275 -0.42 . . . . 2.27 111.777 -179.275 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.52 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 28.1 p90 -79.03 -24.41 43.67 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 120.532 -0.467 . . . . 0.46 110.625 -179.739 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 19.7 tptm -66.62 -37.13 84.23 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 109.174 -0.676 . . . . 1.85 109.174 178.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.513 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 27.4 t70 -66.97 -50.7 61.48 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 109.121 -0.696 . . . . 0.44 109.121 178.332 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.81 -14.51 59.43 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.679 -0.692 . . . . 1.08 110.612 179.042 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 75.5 t80 -80.08 -47.76 14.31 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.845 -0.616 . . . . 0.56 110.647 -179.677 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 26.8 m -69.65 -20.49 23.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.142 -0.481 . . . . 1.69 110.302 179.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.513 ' HG3' ' O ' ' A' ' 14' ' ' ASP . 74.5 mt-30 -58.97 -35.5 73.3 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.729 -0.669 . . . . 2.23 111.02 179.434 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 88.1 m-85 -105.91 44.16 1.07 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.276 -0.42 . . . . 0.69 111.509 -179.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -135.27 70.4 1.44 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.017 0.437 . . . . 0.46 110.72 179.463 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.423 ' HD2' ' N ' ' A' ' 21' ' ' LYS . 0.9 OUTLIER -78.24 -25.95 47.09 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.92 -0.582 . . . . 2.55 110.89 179.983 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -70.3 -11.75 61.12 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.011 -0.54 . . . . 1.8 111.213 -179.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.46 17.22 66.27 Favored Glycine 0 C--N 1.33 0.208 0 C-N-CA 120.857 -0.687 . . . . 0.54 112.898 179.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 60.0 p -90.39 8.24 34.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.751 0.31 . . . . 1.1 111.181 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 57.93 19.59 37.8 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.854 -0.688 . . . . 0.37 112.126 -179.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.508 ' HD3' ' OD1' ' A' ' 64' ' ' ASN . 20.7 mtmm -128.23 154.54 45.74 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.928 0.394 . . . . 1.75 111.205 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.413 ' O ' HG13 ' A' ' 27' ' ' ILE . 45.7 pt -120.64 129.27 75.79 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.111 -0.495 . . . . 1.2 110.823 179.567 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -53.24 134.88 39.17 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.803 0.335 . . . . 1.04 110.882 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 5.9 t -61.2 -17.19 51.89 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.096 -0.502 . . . . 1.71 110.869 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 59.1 mtt180 -78.79 -19.12 52.91 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.885 -0.598 . . . . 3.53 110.488 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 33.3 mm-40 -97.28 -2.05 43.42 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.656 -0.702 . . . . 2.26 110.9 179.813 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.475 HD23 HD23 ' A' ' 63' ' ' LEU . 0.4 OUTLIER -55.64 -54.79 39.84 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.908 -0.587 . . . . 1.95 110.956 -179.956 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -56.14 -39.4 80.57 Favored Glycine 0 C--N 1.331 0.274 0 C-N-CA 120.654 -0.784 . . . . 0.32 112.152 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 32.1 m -65.4 -35.96 82.51 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.995 0.426 . . . . 1.01 110.645 179.584 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 24.4 tp -68.52 -36.62 79.11 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.896 -0.593 . . . . 1.85 110.677 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.521 ' HG3' ' HG3' ' A' ' 43' ' ' PRO . 23.2 mmt -62.27 -42.0 98.96 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.273 -0.421 . . . . 1.43 109.925 179.098 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -63.92 -33.39 75.59 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.771 -0.65 . . . . 3.27 109.691 179.033 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.4 m -72.57 -16.92 61.75 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.315 -0.857 . . . . 1.54 110.385 179.352 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 95.1 mt -114.0 157.24 22.73 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.663 -0.698 . . . . 1.94 110.641 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -52.98 -9.88 0.93 Allowed Glycine 0 CA--C 1.521 0.434 0 C-N-CA 120.997 -0.62 . . . . 0.69 113.245 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 73.6 mm-40 -66.29 174.45 2.64 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.941 0.401 . . . . 1.97 111.314 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -173.01 67.91 0.37 Allowed Pre-proline 0 C--N 1.331 -0.231 0 CA-C-N 115.805 -0.634 . . . . 3.44 110.336 179.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . 0.521 ' HG3' ' HG3' ' A' ' 36' ' ' MET . 47.0 Cg_endo -67.87 148.09 75.97 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.595 2.197 . . . . 0.59 112.332 -179.8 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 12.4 m -64.68 154.26 37.13 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.09 -0.505 . . . . 1.28 110.543 179.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -49.62 -55.07 14.96 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.681 0.276 . . . . 2.7 111.22 -179.404 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.63 -46.03 70.34 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.227 -0.442 . . . . 1.15 111.507 -179.726 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -51.38 -54.52 25.71 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.335 -0.393 . . . . 2.23 111.146 -179.8 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 47.3 mt -56.9 -40.91 77.17 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.731 0.3 . . . . 2.01 111.019 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 79.5 mm-40 -66.16 -27.56 68.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.885 0.374 . . . . 1.68 111.0 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 30.2 m-20 -76.73 -52.8 8.93 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.106 -0.497 . . . . 0.62 111.85 -179.397 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.4 pp -69.37 -35.45 75.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.481 -0.327 . . . . 1.11 111.879 -179.033 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 72.8 mt -69.36 -48.59 66.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.64 0.257 . . . . 1.25 111.138 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.99 -37.37 82.25 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.882 0.372 . . . . 1.24 110.757 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -66.58 -51.65 54.09 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.081 -0.509 . . . . 2.54 110.52 179.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -67.25 -14.9 63.34 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.01 -0.541 . . . . 1.19 111.055 179.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -74.34 -27.29 60.62 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.283 -0.417 . . . . 1.95 110.932 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -118.28 7.83 12.13 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.173 -0.467 . . . . 3.19 110.813 179.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -122.97 -12.68 7.95 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.196 -0.456 . . . . 2.69 110.977 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -140.46 27.18 2.1 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.218 -0.446 . . . . 2.05 110.886 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . 0.54 ' N ' HD21 ' A' ' 60' ' ' ASN . 0.8 OUTLIER 62.01 -85.18 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.917 -0.583 . . . . 1.67 111.118 179.984 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -151.85 -3.05 0.19 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.755 -0.736 . . . . 0.86 112.409 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -115.05 154.9 28.01 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.07 0.462 . . . . 0.49 111.071 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.57 ' HG ' ' HB2' ' A' ' 67' ' ' GLU . 0.8 OUTLIER -119.6 156.17 30.89 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.691 -0.686 . . . . 2.05 109.96 -179.795 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . 0.557 ' HB2' ' HG2' ' A' ' 67' ' ' GLU . 52.7 m-80 -111.26 156.4 21.55 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 121.098 0.475 . . . . 1.52 111.719 -178.674 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 84.0 t80 -48.11 -41.64 26.98 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.348 -0.842 . . . . 0.46 109.96 178.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.68 -36.22 82.01 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.483 -0.781 . . . . 1.41 111.337 179.421 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.57 ' HB2' ' HG ' ' A' ' 63' ' ' LEU . 8.8 mm-40 -64.69 -55.04 22.51 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.192 -0.458 . . . . 1.36 110.004 179.524 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.415 ' HE2' ' HB2' ' A' ' 12' ' ' PHE . 43.4 t80 -59.2 -54.18 49.89 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.829 -0.623 . . . . 0.61 110.541 179.378 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 35.2 t -52.77 -49.31 65.81 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 116.119 -0.491 . . . . 1.41 110.276 179.526 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -43.84 -50.72 7.23 Favored Glycine 0 N--CA 1.451 -0.342 0 CA-C-N 115.613 -0.721 . . . . 0.41 112.23 179.225 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.598 HG22 ' HE2' ' A' ' 74' ' ' LYS . 13.5 mt -66.81 -51.4 55.98 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.261 0 CA-C-O 120.912 0.386 . . . . 1.13 110.78 179.41 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' MET . . . . . 0.437 ' O ' ' HG3' ' A' ' 76' ' ' MET . 83.8 mmm -45.91 -36.47 5.45 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.932 -0.576 . . . . 1.24 109.766 179.192 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -63.21 -55.03 28.4 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.253 -0.885 . . . . 1.17 110.622 179.312 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.598 ' HE2' HG22 ' A' ' 71' ' ' ILE . 58.6 pttt -61.0 -28.62 69.17 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.296 -0.411 . . . . 1.91 110.84 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -77.68 -42.17 35.49 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.233 -0.439 . . . . 2.03 111.266 179.438 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' MET . . . . . 0.437 ' HG3' ' O ' ' A' ' 72' ' ' MET . 2.8 mtt . . . . . 0 N--CA 1.446 -0.628 0 CA-C-N 116.258 -0.428 . . . . 1.52 110.919 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.561 ' O ' ' HG2' ' A' ' 85' ' ' MET . 9.7 t . . . . . 0 C--O 1.226 -0.144 0 N-CA-C 110.503 -0.184 . . . . 7.48 110.503 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -66.55 -23.43 66.22 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 112.558 0.577 . . . . 9.74 112.558 -178.741 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -64.45 -56.05 16.79 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-O 121.102 0.477 . . . . 12.11 111.809 -179.137 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -59.21 -19.31 44.42 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.865 -0.607 . . . . 10.87 111.118 -179.458 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' MET . . . . . 0.561 ' HG2' ' O ' ' A' ' 81' ' ' THR . 2.0 mmt -74.71 -49.85 19.66 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.137 -0.483 . . . . 11.09 110.609 -179.574 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 46.5 ttt180 -54.85 -43.17 72.81 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.036 -0.529 . . . . 16.05 110.075 179.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 25.3 mm-40 -60.37 -42.42 95.79 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.139 0.495 . . . . 14.85 109.973 178.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -69.85 -23.08 63.23 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.749 -0.66 . . . . 14.11 111.075 179.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 88.5 t80 -68.98 -41.56 77.75 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.389 -0.369 . . . . 16.42 110.419 179.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 50.0 mtmt -68.7 -39.13 80.64 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.92 -0.582 . . . . 17.66 110.646 179.552 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 81.7 mt -68.23 -44.48 84.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.038 -0.528 . . . . 18.15 111.441 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -67.69 -55.66 12.33 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.526 -0.306 . . . . 18.34 111.366 -179.646 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 41.8 t0 -55.32 99.08 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.823 0.344 . . . . 19.29 110.409 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.517 ' HG2' ' HB3' ' A' ' 104' ' ' GLU . 21.9 mmm180 -55.86 -33.08 64.21 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.125 -0.488 . . . . 22.47 110.955 -179.399 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . 0.419 ' HB2' ' OD1' ' A' ' 97' ' ' ASP . 6.2 m-20 -101.71 170.13 8.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.189 -0.46 . . . . 23.34 110.929 -179.793 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.45 5.38 57.15 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.794 -0.717 . . . . 22.77 112.384 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.419 ' OD1' ' HB2' ' A' ' 95' ' ' ASP . 5.0 p-10 -58.7 -39.06 79.66 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.706 0.289 . . . . 23.0 111.307 -179.755 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 114.06 17.12 7.45 Favored Glycine 0 C--N 1.331 0.279 0 C-N-CA 120.698 -0.763 . . . . 20.02 112.91 179.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 99.2 m-85 -145.12 152.56 40.26 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 120.74 0.305 . . . . 20.56 110.829 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 61.2 mt -114.33 138.22 45.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 116.299 -0.41 . . . . 19.37 111.069 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 41.7 m -114.61 156.13 45.15 Favored Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 115.988 -0.551 . . . . 22.65 110.939 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_exo -41.76 -39.56 5.13 Favored 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 122.49 2.127 . . . . 23.78 112.281 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.71 -50.2 73.38 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.971 -0.559 . . . . 25.0 110.613 179.465 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . 0.517 ' HB3' ' HG2' ' A' ' 94' ' ' ARG . 44.3 mt-10 -64.53 -28.37 69.6 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.442 -0.799 . . . . 22.31 111.188 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.482 HD22 ' HE2' ' A' ' 124' ' ' MET . 38.0 tp -64.97 -55.5 18.7 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.285 -0.416 . . . . 20.62 111.429 -179.076 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.461 ' HB3' HD12 ' A' ' 121' ' ' ILE . 14.6 ptt180 -64.32 -38.76 92.2 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.852 0.358 . . . . 27.9 110.531 179.893 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . 0.452 ' N ' ' HG3' ' A' ' 106' ' ' ARG . 1.7 t80 -54.55 -39.37 67.64 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.957 -0.565 . . . . 25.96 111.022 -179.544 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.463 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 76.8 t -80.15 -49.65 18.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.521 -0.308 . . . . 21.06 111.37 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -50.03 -35.54 25.29 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.389 -0.369 . . . . 20.93 111.08 -179.835 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 78.1 mt -75.92 -31.22 21.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.333 -0.394 . . . . 25.52 110.565 179.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 95.2 m-20 -67.8 -43.34 79.9 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.07 -0.514 . . . . 23.32 110.812 179.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.463 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 6.2 mt -66.25 -45.33 80.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.069 -0.514 . . . . 21.07 110.826 -179.841 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 137.95 -0.15 2.61 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.922 -0.656 . . . . 23.25 112.278 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -88.61 104.63 17.02 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.734 0.302 . . . . 22.59 111.201 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -74.04 113.71 11.54 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.298 -0.41 . . . . 28.21 110.506 179.526 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . 0.407 HG13 ' OE1' ' A' ' 120' ' ' GLU . 5.3 m -138.35 155.2 28.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 121.004 0.431 . . . . 24.75 111.789 -179.574 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' THR . . . . . 0.401 ' O ' HG12 ' A' ' 121' ' ' ILE . 64.0 p -99.18 156.76 16.8 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.702 -0.681 . . . . 27.5 110.448 179.24 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -58.68 -21.4 54.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.41 -0.359 . . . . 27.03 111.507 -179.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -76.31 -55.38 5.61 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 111.874 0.324 . . . . 29.14 111.874 -179.269 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . 0.407 ' OE1' HG13 ' A' ' 116' ' ' VAL . 15.2 pt-20 -61.71 -39.44 91.5 Favored 'General case' 0 C--O 1.234 0.237 0 N-CA-C 111.679 0.251 . . . . 24.7 111.679 -179.33 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.48 HG13 ' N ' ' A' ' 122' ' ' ASP . 18.7 pt -71.19 -34.88 56.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 C-N-CA 120.959 -0.297 . . . . 22.9 111.251 -179.709 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . 0.48 ' N ' HG13 ' A' ' 121' ' ' ILE . 15.0 t70 -59.01 -43.84 91.61 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.953 0.406 . . . . 24.29 110.292 179.583 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -63.85 -42.24 97.61 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.89 -0.596 . . . . 24.74 110.413 179.44 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' MET . . . . . 0.482 ' HE2' HD22 ' A' ' 105' ' ' LEU . 65.1 ttp -56.59 -34.04 66.79 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.15 -0.477 . . . . 20.15 110.825 179.663 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.485 HG22 HD11 ' A' ' 136' ' ' ILE . 87.0 mt -68.92 -46.09 79.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.237 -0.438 . . . . 20.23 110.371 179.592 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 27.9 tpt180 -59.57 -31.46 69.46 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.99 -0.55 . . . . 25.57 111.04 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -66.96 -40.58 87.52 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.17 -0.468 . . . . 19.18 111.302 -179.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.498 ' HB3' ' HB3' ' A' ' 144' ' ' MET . . . -91.19 -13.59 32.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.376 -0.374 . . . . 16.88 111.094 -179.865 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . 0.433 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 8.7 t70 -95.99 106.72 18.92 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.151 -0.477 . . . . 20.4 111.054 -179.697 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 87.3 m-85 -98.93 -32.91 11.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.033 -0.53 . . . . 21.43 111.533 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -69.3 -15.5 63.36 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.719 0.295 . . . . 23.37 110.981 -179.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . 0.418 ' HA2' ' OD2' ' A' ' 129' ' ' ASP . . . 58.45 84.95 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.835 -0.697 . . . . 24.32 112.874 179.615 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 12.3 p-10 -147.66 -9.64 0.41 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.768 0.318 . . . . 24.4 111.004 179.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 80.14 18.2 72.51 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.835 -0.698 . . . . 23.47 112.43 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 40.4 mtp -137.52 155.3 49.42 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.576 0.227 . . . . 22.91 110.454 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.491 HG21 ' N ' ' A' ' 137' ' ' ASN . 48.8 mm -114.79 142.8 26.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 121.404 0.621 . . . . 18.67 112.233 -179.242 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . 0.491 ' N ' HG21 ' A' ' 136' ' ' ILE . 1.6 p30 -115.45 157.76 23.51 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.006 -0.997 . . . . 16.97 109.108 178.129 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 29.0 t80 -39.12 -25.45 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 112.432 0.53 . . . . 15.28 112.432 -179.239 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . 0.42 ' N ' ' O ' ' A' ' 137' ' ' ASN . 43.5 mt-10 -80.18 -55.75 4.7 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.692 0.282 . . . . 14.82 111.529 -179.149 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . 0.491 ' HB2' HG22 ' A' ' 136' ' ' ILE . 53.3 mt-10 -61.12 -31.33 71.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.941 0.401 . . . . 17.46 110.519 -179.825 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.449 ' CZ ' HG22 ' A' ' 145' ' ' ILE . 88.9 t80 -67.67 -55.7 12.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.839 -0.619 . . . . 13.65 110.606 179.726 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . 0.411 HG13 ' HG3' ' A' ' 85' ' ' MET . 34.4 t -47.23 -43.39 7.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 115.833 -0.622 . . . . 11.12 111.964 179.523 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 82.8 t90 -65.29 -55.21 19.61 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.697 0.629 . . . . 14.4 112.697 -178.448 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 144' ' ' MET . . . . . 0.498 ' HB3' ' HB3' ' A' ' 128' ' ' ALA . 11.1 ptt? -61.78 -32.39 72.66 Favored 'General case' 0 N--CA 1.464 0.237 0 N-CA-C 112.55 0.574 . . . . 14.63 112.55 -177.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 145' ' ' ILE . . . . . 0.516 HD13 ' HB3' ' A' ' 85' ' ' MET . 25.3 pt -80.71 -20.87 11.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 C-N-CA 120.779 -0.368 . . . . 11.62 111.423 179.835 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 33.2 t -67.66 -32.8 73.73 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.104 0.478 . . . . 8.66 110.175 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 7.3 mm-40 -84.6 -23.65 29.49 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.595 -0.729 . . . . 11.87 111.1 180.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 63.9 mttm . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.289 -0.863 . . . . 13.97 110.989 179.503 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 21.4 mt . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.78 0.324 . . . . 2.0 110.919 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.44 -171.23 0.94 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.178 -0.465 . . . . 1.72 110.869 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -69.94 -46.25 65.72 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.134 0.492 . . . . 2.2 110.442 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -72.03 -41.9 66.96 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.578 -0.737 . . . . 1.35 110.664 179.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -60.55 -45.84 92.41 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.1 -0.5 . . . . 2.34 110.603 179.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . 0.521 ' HA ' ' CZ ' ' A' ' 12' ' ' PHE . 40.7 mt -57.92 -52.27 60.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.16 -0.473 . . . . 1.27 110.879 179.733 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.2 -21.4 65.09 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.068 -0.515 . . . . 1.22 111.716 -179.607 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -72.72 -56.78 4.76 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 111.991 0.367 . . . . 2.27 111.991 -178.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.521 ' CZ ' ' HA ' ' A' ' 9' ' ' ILE . 7.5 p90 -77.92 -26.18 48.83 Favored 'General case' 0 C--N 1.332 -0.178 0 C-N-CA 120.674 -0.41 . . . . 0.46 110.789 -179.764 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.47 ' HZ3' HG11 ' A' ' 17' ' ' VAL . 26.7 tptp -65.01 -38.47 91.04 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 109.383 -0.599 . . . . 1.85 109.383 178.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.469 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 20.1 t70 -66.65 -48.62 68.83 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 108.945 -0.761 . . . . 0.44 108.945 178.186 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.78 -14.59 59.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.411 -0.813 . . . . 1.08 110.723 179.184 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.419 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 88.3 t80 -77.14 -49.89 14.21 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.029 -0.532 . . . . 0.56 110.436 -179.579 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.47 HG11 ' HZ3' ' A' ' 13' ' ' LYS . 16.5 m -67.32 -22.6 29.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.215 -0.448 . . . . 1.69 110.26 179.67 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.469 ' HG2' ' O ' ' A' ' 14' ' ' ASP . 26.1 mm-40 -63.85 -20.82 66.1 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.829 -0.623 . . . . 2.23 111.379 179.444 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 45.2 m-85 -114.83 24.21 11.96 Favored 'General case' 0 C--N 1.332 -0.156 0 N-CA-C 111.903 0.335 . . . . 0.69 111.903 -179.36 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -112.26 81.45 1.47 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.965 0.412 . . . . 0.46 110.504 179.335 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -92.44 -25.52 18.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.832 -0.622 . . . . 2.55 111.286 -179.63 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -70.49 -15.33 62.79 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.102 -0.499 . . . . 1.8 111.355 -179.497 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.16 -0.08 68.84 Favored Glycine 0 CA--C 1.518 0.24 0 C-N-CA 120.749 -0.739 . . . . 0.54 112.708 179.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.41 ' HG1' ' HB2' ' A' ' 26' ' ' LYS . 40.4 p -82.48 11.9 5.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.632 0.253 . . . . 1.1 111.222 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 57.86 24.47 53.92 Favored Glycine 0 C--N 1.33 0.245 0 C-N-CA 120.676 -0.773 . . . . 0.37 111.724 -179.489 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.643 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 47.7 mtpt -129.61 155.49 45.75 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.725 0.298 . . . . 1.75 110.678 -179.516 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 36.3 pt -118.47 130.85 72.73 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.411 -0.359 . . . . 1.2 111.29 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -50.07 129.38 20.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.372 -0.376 . . . . 1.04 111.274 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.41 HG22 HD12 ' A' ' 63' ' ' LEU . 79.7 p -61.55 -21.37 64.22 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.118 -0.492 . . . . 1.71 110.722 179.819 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 51.8 mtp180 -80.91 4.08 20.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.742 -0.663 . . . . 3.53 110.201 179.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -119.05 -6.63 10.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.547 -0.751 . . . . 2.26 110.55 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.473 ' O ' ' HG2' ' A' ' 36' ' ' MET . 10.2 tt -55.2 -51.18 67.37 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.242 -0.436 . . . . 1.95 110.18 179.534 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -52.27 -48.88 52.77 Favored Glycine 0 C--N 1.331 0.288 0 C-N-CA 120.531 -0.842 . . . . 0.32 111.496 179.209 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 90.7 m -59.36 -34.44 72.39 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 121.319 0.58 . . . . 1.01 109.848 178.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 47.2 tp -70.36 -28.66 65.3 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.296 -0.865 . . . . 1.85 110.26 179.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.473 ' HG2' ' O ' ' A' ' 32' ' ' LEU . 23.9 mmm -76.12 -21.42 56.66 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.06 -0.518 . . . . 1.43 109.768 179.057 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -75.41 -44.74 42.98 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.651 -0.704 . . . . 3.27 110.326 179.071 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 7.9 t -71.51 -13.28 61.76 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.031 -0.531 . . . . 1.54 110.416 179.13 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.442 ' C ' ' H ' ' A' ' 41' ' ' GLN . 76.7 mt -112.83 157.4 21.43 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.727 -0.67 . . . . 1.94 110.187 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -71.84 34.85 0.61 Allowed Glycine 0 CA--C 1.521 0.449 0 C-N-CA 120.762 -0.733 . . . . 0.69 113.34 -179.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.442 ' H ' ' C ' ' A' ' 39' ' ' LEU . 12.8 mm-40 -93.58 -80.68 0.38 Allowed 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.791 0.329 . . . . 1.97 111.087 179.569 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 32.5 m-80 56.81 74.89 0.62 Allowed Pre-proline 0 C--N 1.332 -0.184 0 CA-C-N 115.943 -0.571 . . . . 3.44 111.05 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 92.1 Cg_endo -79.18 173.88 12.78 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.654 2.236 . . . . 0.59 112.446 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 19.9 m -69.07 152.71 44.86 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.172 -0.467 . . . . 1.28 110.778 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -55.09 -55.21 33.65 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.733 0.302 . . . . 2.7 111.128 -179.648 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -54.43 -47.92 72.26 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.092 -0.504 . . . . 1.15 111.804 -179.565 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.41 ' HG2' HD21 ' A' ' 51' ' ' LEU . 39.5 tt0 -57.99 -48.24 80.61 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.87 0.367 . . . . 2.23 110.456 -179.629 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.405 ' HA ' HD22 ' A' ' 51' ' ' LEU . 31.8 tp -57.07 -38.61 73.54 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.78 -0.645 . . . . 2.01 110.977 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 83.3 mm-40 -72.82 -31.04 64.52 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.303 -0.408 . . . . 1.68 111.551 -179.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 28.1 m-20 -73.78 -54.99 6.79 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.547 -0.297 . . . . 0.62 111.8 -179.44 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.427 HD12 HD23 ' A' ' 32' ' ' LEU . 2.2 pp -60.75 -38.57 85.64 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.611 -0.268 . . . . 1.11 111.516 -179.226 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 82.4 mt -68.81 -36.75 75.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.934 0.397 . . . . 1.25 110.744 179.595 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.96 -50.76 61.29 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.096 -0.502 . . . . 1.24 111.073 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -62.08 -38.53 89.17 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.283 -0.417 . . . . 2.54 110.603 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -73.58 -18.21 61.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.285 -0.416 . . . . 1.19 111.04 179.747 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -70.8 -55.02 9.48 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.272 -0.422 . . . . 1.95 110.612 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 7.9 p30 -89.65 43.68 1.16 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.183 -0.462 . . . . 3.19 110.988 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -155.16 -15.66 0.11 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.705 -0.68 . . . . 2.69 110.61 179.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -144.21 21.39 1.73 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.911 -0.586 . . . . 2.05 110.613 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 9.8 m120 64.49 -83.24 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.126 0 CA-C-N 115.861 -0.609 . . . . 1.67 111.314 179.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -154.69 19.54 0.59 Allowed Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.793 -0.718 . . . . 0.86 112.336 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.643 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -128.49 155.31 45.03 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.981 0.419 . . . . 0.49 111.156 -179.847 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.534 ' HG ' ' HB2' ' A' ' 67' ' ' GLU . 9.5 tp -124.45 154.09 41.0 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.901 -0.59 . . . . 2.05 110.482 -179.604 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . 0.414 ' CG ' ' HE3' ' A' ' 26' ' ' LYS . 7.6 m-80 -113.41 157.63 21.67 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-O 121.111 0.481 . . . . 1.52 111.548 -179.708 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 88.1 t80 -46.88 -43.52 18.85 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.281 -0.872 . . . . 0.46 111.02 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -67.62 -34.43 76.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 1.41 111.877 -179.82 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.534 ' HB2' ' HG ' ' A' ' 63' ' ' LEU . 22.4 mm-40 -64.39 -53.41 48.95 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.958 0.409 . . . . 1.36 110.245 179.682 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.447 ' O ' ' HG3' ' A' ' 72' ' ' MET . 28.0 t80 -59.91 -51.11 71.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.825 -0.625 . . . . 0.61 110.336 179.261 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 1.5 m -55.25 -49.67 71.45 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.821 -0.627 . . . . 1.41 111.085 179.727 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -47.51 -49.73 20.14 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.982 -0.627 . . . . 0.41 112.212 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.453 ' HA ' ' HG2' ' A' ' 74' ' ' LYS . 12.7 mt -64.19 -45.56 95.98 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.308 0 CA-C-O 121.015 0.436 . . . . 1.13 110.743 179.541 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' MET . . . . . 0.447 ' HG3' ' O ' ' A' ' 68' ' ' PHE . 38.0 mtp -54.84 -25.01 25.68 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.9 -0.591 . . . . 1.24 110.135 179.556 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -76.04 -49.27 18.01 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.36 -0.382 . . . . 1.17 110.748 179.69 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.453 ' HG2' ' HA ' ' A' ' 71' ' ' ILE . 19.2 pttp -65.35 -35.4 80.86 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.516 -0.311 . . . . 1.91 111.081 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -81.41 -55.67 4.55 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.728 0.64 . . . . 2.03 112.728 -179.033 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 24.7 mtm . . . . . 0 N--CA 1.453 -0.285 0 N-CA-C 113.066 0.765 . . . . 1.52 113.066 -178.321 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.445 HG22 ' O ' ' A' ' 81' ' ' THR . 3.9 t . . . . . 0 CA--C 1.529 0.138 0 CA-C-O 121.252 0.548 . . . . 7.48 111.605 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.416 ' HB2' ' OH ' ' A' ' 138' ' ' TYR . 11.2 pt-20 -50.25 -20.77 1.13 Allowed 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 112.793 0.664 . . . . 9.74 112.793 -178.876 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 25.9 mm-40 -68.78 -57.01 6.21 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.758 0.313 . . . . 12.11 111.644 -179.312 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -71.86 -27.34 62.81 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.106 0.479 . . . . 10.87 110.513 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' MET . . . . . 0.534 ' HB3' HD13 ' A' ' 145' ' ' ILE . 27.7 mtp -70.88 -36.09 72.63 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.629 -0.714 . . . . 11.09 110.47 -179.73 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 70.0 ttt180 -68.22 -43.56 77.72 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.973 -0.558 . . . . 16.05 110.2 179.575 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -55.21 -42.91 73.94 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.74 -0.467 . . . . 14.85 109.74 178.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -61.1 -38.44 86.29 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.776 -0.647 . . . . 14.11 110.688 179.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -58.17 -40.89 82.63 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.237 -0.438 . . . . 16.42 110.554 179.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 26.3 mtpp -63.96 -37.9 89.11 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.829 -0.623 . . . . 17.66 110.584 179.611 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 66.0 mt -62.32 -44.03 98.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.875 -0.602 . . . . 18.15 111.598 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.458 ' HA ' HG23 ' A' ' 108' ' ' VAL . 18.5 m-85 -80.31 -20.52 44.14 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 111.791 0.293 . . . . 18.34 111.791 -179.614 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -96.88 108.65 21.39 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.892 0.377 . . . . 19.29 111.047 -179.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.82 -58.9 3.33 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.941 -0.572 . . . . 22.47 111.295 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -74.82 158.86 32.72 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.151 -0.477 . . . . 23.34 111.347 -179.466 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -80.88 5.19 66.52 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.796 -0.716 . . . . 22.77 111.429 178.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 27.8 p-10 -55.52 -35.06 65.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.904 0.383 . . . . 23.0 111.384 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 89.86 30.95 11.78 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.867 -0.682 . . . . 20.02 112.167 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -146.78 146.79 30.39 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.639 0.257 . . . . 20.56 110.902 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 40.4 mt -114.17 125.3 71.44 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-O 120.846 0.355 . . . . 19.37 111.097 179.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' SER . . . . . 0.481 ' OG ' ' HD2' ' A' ' 102' ' ' PRO . 47.3 t -114.61 152.67 46.46 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.055 -0.52 . . . . 22.65 110.421 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . 0.481 ' HD2' ' OG ' ' A' ' 101' ' ' SER . 55.6 Cg_exo -40.05 -34.71 1.01 Allowed 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.564 2.176 . . . . 23.78 112.848 179.669 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.86 -46.57 81.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.292 -0.413 . . . . 25.0 111.132 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -74.37 -39.2 62.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.936 -0.574 . . . . 22.31 110.75 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.421 HD21 ' HB ' ' A' ' 121' ' ' ILE . 8.7 tp -54.86 -49.68 70.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.93 -0.577 . . . . 20.62 110.407 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.426 ' HG3' HD12 ' A' ' 110' ' ' ILE . 10.4 ttt180 -63.89 -47.85 78.96 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.899 -0.591 . . . . 27.9 110.582 179.424 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 68.4 t80 -49.91 -43.43 49.63 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.881 -0.6 . . . . 25.96 111.492 -179.387 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.498 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 53.9 t -72.16 -49.94 40.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.585 -0.28 . . . . 21.06 111.268 -179.785 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 18.6 mmt -49.13 -49.54 41.69 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.302 -0.408 . . . . 20.93 111.352 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.426 HD12 ' HG3' ' A' ' 106' ' ' ARG . 63.4 mt -59.84 -28.13 40.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.232 -0.44 . . . . 25.52 110.937 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -77.9 -29.49 50.18 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.122 -0.49 . . . . 23.32 110.937 179.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.498 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 14.8 mt -74.47 -41.35 60.92 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.387 -0.37 . . . . 21.07 110.836 -179.892 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 131.28 -0.04 5.12 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.879 -0.677 . . . . 23.25 112.422 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -101.55 109.27 21.05 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.882 0.372 . . . . 22.59 111.021 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -74.77 113.68 12.33 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.128 -0.487 . . . . 28.21 111.013 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . 0.437 HG13 ' OE1' ' A' ' 120' ' ' GLU . 4.9 m -131.21 146.39 33.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 121.006 0.432 . . . . 24.75 111.437 179.634 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 55.3 p -92.88 152.39 19.43 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.883 -0.599 . . . . 27.5 110.128 179.306 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -55.79 -19.05 9.97 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.328 -0.396 . . . . 27.03 111.118 -179.69 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -76.11 -55.48 5.55 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.356 -0.384 . . . . 29.14 111.709 -179.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . 0.437 ' OE1' HG13 ' A' ' 116' ' ' VAL . 14.5 pt-20 -62.59 -40.82 98.13 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 111.873 0.323 . . . . 24.7 111.873 -179.152 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.421 ' HB ' HD21 ' A' ' 105' ' ' LEU . 43.9 pt -70.09 -35.14 62.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 C-N-CA 120.853 -0.339 . . . . 22.9 111.242 -179.671 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -61.14 -38.83 87.8 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.833 0.349 . . . . 24.29 110.305 179.437 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -64.52 -46.35 83.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.055 -0.521 . . . . 24.74 110.446 179.461 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 53.0 ttp -56.58 -39.04 72.82 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 116.09 -0.505 . . . . 20.15 110.537 179.457 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 82.1 mt -65.36 -41.3 90.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.914 -0.585 . . . . 20.23 110.513 179.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 69.1 ttt180 -60.52 -32.17 71.2 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.664 -0.698 . . . . 25.57 110.821 179.666 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -67.79 -36.19 79.99 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.125 -0.489 . . . . 19.18 111.062 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.642 ' HB3' ' HB3' ' A' ' 144' ' ' MET . . . -90.93 -15.48 29.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.262 -0.426 . . . . 16.88 110.964 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . 0.425 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 19.1 t70 -98.39 106.67 18.98 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.978 -0.556 . . . . 20.4 110.902 -179.662 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -94.19 -33.34 13.33 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.805 -0.634 . . . . 21.43 111.448 -179.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -67.81 -15.97 63.88 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.87 0.367 . . . . 23.37 110.649 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 60.41 85.63 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.962 -0.637 . . . . 24.32 112.85 179.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -143.05 -35.4 0.4 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.753 0.311 . . . . 24.4 110.851 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 110.91 6.06 26.66 Favored Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.832 -0.699 . . . . 23.47 112.729 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 78.3 mtp -131.43 155.26 47.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.631 0.253 . . . . 22.91 110.627 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.519 HG23 ' HB2' ' A' ' 140' ' ' GLU . 48.1 mm -117.33 144.79 24.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 121.203 0.525 . . . . 18.67 111.851 -179.477 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . 0.451 ' O ' ' N ' ' A' ' 139' ' ' GLU . 29.8 p-10 -116.92 158.13 24.56 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.354 -0.839 . . . . 16.97 109.194 178.44 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . 0.416 ' OH ' ' HB2' ' A' ' 82' ' ' GLU . 26.8 t80 -39.21 -23.72 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.368 0.507 . . . . 15.28 112.368 -179.534 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . 0.451 ' N ' ' O ' ' A' ' 137' ' ' ASN . 45.4 mt-10 -80.45 -56.01 4.48 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 120.744 0.307 . . . . 14.82 111.401 -179.486 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . 0.519 ' HB2' HG23 ' A' ' 136' ' ' ILE . 34.7 mt-10 -62.82 -31.02 71.93 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.908 0.385 . . . . 17.46 110.38 -179.961 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.553 ' HA ' ' HE1' ' A' ' 144' ' ' MET . 78.0 t80 -66.89 -54.51 21.44 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.976 -0.556 . . . . 13.65 109.689 178.892 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . 0.497 ' HA ' HD13 ' A' ' 145' ' ' ILE . 1.7 t -47.84 -35.44 4.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.306 -0.861 . . . . 11.12 111.286 179.101 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 79.8 t90 -69.71 -55.32 10.26 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.278 0.473 . . . . 14.4 112.278 -179.42 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 144' ' ' MET . . . . . 0.642 ' HB3' ' HB3' ' A' ' 128' ' ' ALA . 21.4 ptt? -65.32 -21.71 66.74 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 113.323 0.861 . . . . 14.63 113.323 -177.627 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 145' ' ' ILE . . . . . 0.598 ' HA ' ' HB2' ' A' ' 148' ' ' LYS . 44.0 pt -80.61 -43.77 21.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 C-N-CA 120.806 -0.357 . . . . 11.62 111.861 -179.821 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 146' ' ' SER . . . . . 0.515 ' N ' HG13 ' A' ' 145' ' ' ILE . 46.9 t -63.67 -13.89 46.98 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 121.472 0.653 . . . . 8.66 109.473 179.574 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 6.2 mm-40 -126.19 21.73 7.32 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 114.781 -1.099 . . . . 11.87 110.025 -179.272 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . 0.598 ' HB2' ' HA ' ' A' ' 145' ' ' ILE . 27.2 ttpp . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.203 -0.904 . . . . 13.97 110.931 -179.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 11.0 mp . . . . . 0 C--O 1.231 0.092 0 CA-C-O 120.932 0.396 . . . . 2.0 111.014 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.408 ' O ' HG13 ' A' ' 9' ' ' ILE . 0.2 OUTLIER -59.1 177.32 0.17 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.917 -0.583 . . . . 1.72 111.181 -179.857 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -62.88 -42.87 99.93 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.294 0.568 . . . . 2.2 109.909 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -71.27 -39.0 71.83 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.309 -0.859 . . . . 1.35 110.521 179.488 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 18.3 mm-40 -62.9 -43.12 99.67 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.894 -0.593 . . . . 2.34 110.47 179.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . 0.538 ' HA ' ' CZ ' ' A' ' 12' ' ' PHE . 83.6 mt -58.66 -54.35 34.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.139 -0.482 . . . . 1.27 110.362 179.572 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.26 -22.38 65.94 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.042 -0.527 . . . . 1.22 111.074 179.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -73.38 -56.31 5.22 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.228 -0.442 . . . . 2.27 112.186 -178.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.538 ' CZ ' ' HA ' ' A' ' 9' ' ' ILE . 4.7 p90 -78.69 -26.51 44.92 Favored 'General case' 0 C--N 1.332 -0.157 0 C-N-CA 120.542 -0.463 . . . . 0.46 111.255 -179.374 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.418 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 27.8 tptp -67.03 -38.38 85.79 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.649 -0.5 . . . . 1.85 109.649 179.116 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.422 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 16.8 t70 -66.62 -52.42 45.35 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 109.246 -0.65 . . . . 0.44 109.246 178.34 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.44 -13.66 52.71 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.603 -0.726 . . . . 1.08 110.726 179.198 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.418 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 83.0 t80 -76.96 -48.51 17.89 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.083 -0.508 . . . . 0.56 110.443 -179.741 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 30.8 m -68.73 -22.7 26.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.205 -0.452 . . . . 1.69 110.353 179.54 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.422 ' HG2' ' O ' ' A' ' 14' ' ' ASP . 26.3 mm-40 -59.48 -48.28 82.26 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.844 -0.616 . . . . 2.23 111.461 179.444 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -88.14 37.34 0.81 Allowed 'General case' 0 N--CA 1.462 0.14 0 CA-C-O 120.771 0.32 . . . . 0.69 111.622 -179.541 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -125.11 74.66 1.39 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.065 0.459 . . . . 0.46 110.397 179.328 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -84.72 -21.91 29.92 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.727 -0.67 . . . . 2.55 111.309 -179.653 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -75.97 -22.25 56.09 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.978 -0.555 . . . . 1.8 111.398 -179.404 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 82.12 4.53 90.21 Favored Glycine 0 C--N 1.33 0.229 0 C-N-CA 120.678 -0.773 . . . . 0.54 112.418 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 60.6 p -82.12 14.74 2.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.652 0.263 . . . . 1.1 111.177 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 53.92 22.86 20.91 Favored Glycine 0 C--N 1.332 0.339 0 C-N-CA 120.714 -0.755 . . . . 0.37 111.895 -179.498 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.623 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 46.2 mtpt -129.98 155.11 46.63 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.681 -0.259 . . . . 1.75 110.692 -179.374 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.649 HG13 ' HB2' ' A' ' 63' ' ' LEU . 15.4 pt -114.89 122.12 68.36 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.203 0 CA-C-O 120.915 0.388 . . . . 1.2 112.021 -179.43 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -52.81 134.71 36.71 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.087 -0.506 . . . . 1.04 111.114 179.693 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.438 ' HG1' ' HB2' ' A' ' 55' ' ' ALA . 7.0 t -65.53 -13.19 58.38 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.016 -0.538 . . . . 1.71 111.152 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 32.1 mtt180 -80.94 -10.09 59.76 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.012 -0.54 . . . . 3.53 110.632 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -116.61 1.12 12.82 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.819 -0.628 . . . . 2.26 110.619 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.466 HD13 HD21 ' A' ' 35' ' ' LEU . 16.0 tp -64.13 -47.75 78.75 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.382 -0.372 . . . . 1.95 110.685 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.429 ' O ' ' HG3' ' A' ' 37' ' ' ARG . . . -51.86 -41.41 51.46 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.246 -0.978 . . . . 0.32 110.927 179.115 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.43 ' O ' HG23 ' A' ' 38' ' ' THR . 95.2 m -68.14 -30.63 69.81 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.985 0.421 . . . . 1.01 110.359 179.112 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.466 HD21 HD13 ' A' ' 32' ' ' LEU . 60.6 tp -71.73 -41.52 68.39 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.761 -0.654 . . . . 1.85 111.246 -179.816 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.413 ' SD ' ' HG3' ' A' ' 43' ' ' PRO . 48.2 mtp -72.31 -23.9 61.24 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.301 -0.409 . . . . 1.43 110.849 179.807 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.429 ' HG3' ' O ' ' A' ' 33' ' ' GLY . 81.9 mtt180 -72.62 -46.14 55.59 Favored 'General case' 0 N--CA 1.461 0.125 0 CA-C-O 120.958 0.408 . . . . 3.27 110.297 179.179 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.564 HG22 HD13 ' A' ' 39' ' ' LEU . 1.8 t -68.16 -11.16 58.73 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.958 -0.564 . . . . 1.54 110.412 179.023 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.564 HD13 HG22 ' A' ' 38' ' ' THR . 8.4 mp -111.47 156.82 21.09 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.603 -0.726 . . . . 1.94 110.304 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -45.79 -24.42 1.26 Allowed Glycine 0 CA--C 1.519 0.323 0 C-N-CA 121.224 -0.512 . . . . 0.69 113.439 -179.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.416 ' OE1' ' HB3' ' A' ' 39' ' ' LEU . 19.7 mp0 -57.07 152.94 12.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.893 0.377 . . . . 1.97 111.174 179.811 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 -155.28 71.87 5.61 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.067 -0.515 . . . . 3.44 110.952 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . 0.413 ' HG3' ' SD ' ' A' ' 36' ' ' MET . 60.0 Cg_endo -69.24 152.5 72.01 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.789 2.326 . . . . 0.59 112.35 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 27.2 m -76.13 151.21 37.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.174 -0.466 . . . . 1.28 110.321 179.397 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.432 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 1.3 mp0 -44.55 -55.08 5.43 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.678 0.275 . . . . 2.7 111.191 -179.714 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -54.5 -45.01 73.17 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.234 -0.439 . . . . 1.15 111.392 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -56.2 -49.83 72.96 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.234 -0.439 . . . . 2.23 111.216 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 17.5 mt -59.74 -41.78 91.73 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.683 0.278 . . . . 2.01 110.934 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.432 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 78.0 mm-40 -66.64 -30.28 70.52 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.523 -0.308 . . . . 1.68 111.274 -179.702 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 -75.83 -54.99 6.06 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.424 -0.353 . . . . 0.62 111.431 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 3.1 pp -64.09 -38.14 89.99 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.437 -0.347 . . . . 1.11 111.361 -179.469 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 44.9 mt -65.79 -43.92 93.19 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 C-N-CA 121.066 -0.253 . . . . 1.25 110.741 179.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.8 -29.55 70.8 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.929 0.395 . . . . 1.24 110.739 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -74.59 -52.96 10.34 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.963 -0.562 . . . . 2.54 110.075 179.625 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . 0.438 ' HB2' ' HG1' ' A' ' 29' ' ' THR . . . -69.86 -14.44 62.75 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.014 -0.539 . . . . 1.19 111.508 179.786 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -73.6 -37.04 65.56 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.851 0.358 . . . . 1.95 110.965 -179.647 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 18.0 m120 -89.6 16.67 7.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.235 -0.439 . . . . 3.19 110.656 179.683 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.413 ' ND2' ' H ' ' A' ' 59' ' ' ASN . 3.1 t-20 -142.39 151.55 41.97 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.905 -0.589 . . . . 2.69 110.627 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . 0.477 ' HB3' ' HZ2' ' A' ' 26' ' ' LYS . 2.5 m120 62.86 9.92 3.98 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.221 -0.445 . . . . 2.05 111.17 179.704 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 14.2 m120 63.03 11.52 5.22 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.329 -0.396 . . . . 1.67 111.827 179.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 110.44 44.03 1.02 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.61 -0.805 . . . . 0.86 112.822 179.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.623 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -147.62 154.83 41.14 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.066 0.46 . . . . 0.49 111.11 179.856 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.649 ' HB2' HG13 ' A' ' 27' ' ' ILE . 66.4 mt -124.47 155.88 38.18 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.809 -0.632 . . . . 2.05 109.982 179.531 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . 0.453 ' OD1' ' HE3' ' A' ' 26' ' ' LYS . 0.6 OUTLIER -113.15 156.74 22.66 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.924 -0.31 . . . . 1.52 110.505 -179.66 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -43.06 -50.23 6.07 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.117 -0.492 . . . . 0.46 110.913 179.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.7 -29.59 69.62 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.285 -0.416 . . . . 1.41 111.35 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.411 ' HG2' ' HB2' ' A' ' 64' ' ' ASN . 14.3 mm-40 -65.1 -55.45 18.7 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.831 0.348 . . . . 1.36 110.203 179.317 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 32.8 t80 -63.98 -45.98 86.65 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.077 -0.511 . . . . 0.61 109.993 179.255 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 62.7 m -57.34 -35.46 69.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.809 -0.632 . . . . 1.41 110.251 179.477 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -59.51 -54.4 38.07 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.788 -0.72 . . . . 0.41 111.431 179.436 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.466 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 12.6 mt -60.16 -43.38 92.96 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.347 0 CA-C-O 121.108 0.48 . . . . 1.13 110.173 179.099 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' MET . . . . . 0.409 ' O ' ' HB2' ' A' ' 76' ' ' MET . 40.1 mtp -53.76 -32.52 52.64 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.859 -0.61 . . . . 1.24 110.051 179.317 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -67.17 -47.71 70.15 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.186 -0.461 . . . . 1.17 110.853 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.466 ' HG2' ' O ' ' A' ' 71' ' ' ILE . 65.7 pttt -70.44 -28.9 65.39 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.412 -0.358 . . . . 1.91 111.747 -179.591 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 6.9 mm100 -82.1 -35.06 28.98 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.186 0.517 . . . . 2.03 111.155 -179.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' MET . . . . . 0.409 ' HB2' ' O ' ' A' ' 72' ' ' MET . 50.7 mtp . . . . . 0 C--N 1.326 -0.451 0 CA-C-N 115.525 -0.762 . . . . 1.52 111.969 -179.024 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.546 ' O ' ' HG2' ' A' ' 85' ' ' MET . 6.6 t . . . . . 0 N--CA 1.47 0.571 0 CA-C-O 120.98 0.419 . . . . 7.48 111.836 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -42.71 -30.91 0.41 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 115.57 -0.741 . . . . 9.74 112.977 -179.152 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -60.56 -55.94 27.37 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 120.879 0.371 . . . . 12.11 111.52 -179.332 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -63.99 -21.93 66.71 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.169 -0.468 . . . . 10.87 111.167 -179.582 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' MET . . . . . 0.546 ' HG2' ' O ' ' A' ' 81' ' ' THR . 11.3 mmm -74.41 -41.13 61.42 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.895 0.379 . . . . 11.09 110.578 -179.558 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 50.8 ttp180 -62.46 -46.57 87.92 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.969 -0.559 . . . . 16.05 110.404 179.729 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.424 ' O ' HG12 ' A' ' 91' ' ' ILE . 40.7 tt0 -55.73 -47.05 77.56 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.029 0.442 . . . . 14.85 109.867 179.015 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.84 -32.89 74.79 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.796 -0.638 . . . . 14.11 111.034 179.616 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 81.7 t80 -61.5 -37.12 82.52 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-O 120.978 0.418 . . . . 16.42 110.494 179.777 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 89.0 mttt -69.21 -40.1 78.21 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.871 -0.604 . . . . 17.66 110.501 179.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.424 HG12 ' O ' ' A' ' 87' ' ' GLU . 37.4 mm -60.51 -50.5 80.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.897 -0.592 . . . . 18.15 111.567 -179.799 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -66.79 -48.08 70.11 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.306 -0.406 . . . . 18.34 111.635 -179.347 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 53.6 t0 -60.83 93.82 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.984 0.421 . . . . 19.29 110.557 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.666 ' HE ' ' HG2' ' A' ' 104' ' ' GLU . 34.8 mtm180 -63.01 -11.55 19.83 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.9 -0.591 . . . . 22.47 111.49 -179.497 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . 0.418 ' HB2' ' OD1' ' A' ' 97' ' ' ASP . 8.9 m-20 -119.82 170.23 9.42 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.965 0.412 . . . . 23.34 111.09 -179.78 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.49 5.21 57.02 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.925 -0.655 . . . . 22.77 112.256 179.602 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.418 ' OD1' ' HB2' ' A' ' 95' ' ' ASP . 5.0 p-10 -60.0 -38.6 83.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.66 0.267 . . . . 23.0 111.119 -179.657 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 113.05 15.04 9.42 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.804 -0.712 . . . . 20.02 112.955 179.648 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -142.34 154.13 44.41 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.613 0.244 . . . . 20.56 110.758 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 76.8 mt -114.11 140.7 33.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 121.023 0.44 . . . . 19.37 111.337 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' SER . . . . . 0.431 ' OG ' ' HD2' ' A' ' 102' ' ' PRO . 31.1 t -114.51 154.22 46.6 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 115.589 -0.732 . . . . 22.65 109.956 179.785 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . 0.431 ' HD2' ' OG ' ' A' ' 101' ' ' SER . 57.7 Cg_exo -50.53 -36.19 48.55 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 121.941 1.76 . . . . 23.78 111.442 -179.892 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.73 -48.84 79.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.765 -0.652 . . . . 25.0 109.911 178.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . 0.666 ' HG2' ' HE ' ' A' ' 94' ' ' ARG . 45.4 mt-10 -59.47 -45.62 91.12 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.303 -0.862 . . . . 22.31 110.332 179.245 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.566 HD23 ' HB ' ' A' ' 121' ' ' ILE . 2.6 tt -63.29 -29.7 70.97 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.585 -0.734 . . . . 20.62 110.615 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.424 ' CZ ' HD11 ' A' ' 110' ' ' ILE . 12.1 tpt180 -72.81 -40.41 65.88 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.709 -0.678 . . . . 27.9 111.5 -179.645 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 53.3 t80 -76.87 -35.18 57.63 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 111.98 0.363 . . . . 25.96 111.98 -178.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 90.4 t -72.34 -47.45 52.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 111.692 0.256 . . . . 21.06 111.692 -179.455 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 12.9 mmt -50.98 -36.32 38.44 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.712 0.291 . . . . 20.93 111.283 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.424 HD11 ' CZ ' ' A' ' 106' ' ' ARG . 72.4 mt -67.94 -35.58 72.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.894 0.378 . . . . 25.52 110.636 179.801 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 -66.06 -37.94 87.08 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.025 -0.534 . . . . 23.32 110.744 179.594 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 14.6 mt -67.59 -28.89 68.14 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.999 -0.546 . . . . 21.07 110.954 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 116.28 0.14 20.65 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.9 -0.667 . . . . 23.25 112.305 -179.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -103.42 110.06 21.93 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.768 0.318 . . . . 22.59 110.978 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 17.6 tppt? -80.58 116.2 20.49 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.2 -0.455 . . . . 28.21 110.743 179.708 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 3.7 m -125.33 154.59 33.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.035 0.445 . . . . 24.75 111.569 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' THR . . . . . 0.4 ' HG1' ' H ' ' A' ' 120' ' ' GLU . 80.6 p -95.68 146.27 24.63 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.735 -0.666 . . . . 27.5 110.085 179.173 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -53.55 -18.94 3.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.279 -0.418 . . . . 27.03 111.367 -179.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -79.22 -52.13 8.56 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.38 -0.373 . . . . 29.14 111.697 -179.49 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . 0.4 ' H ' ' HG1' ' A' ' 117' ' ' THR . 13.2 pt-20 -63.09 -37.12 85.92 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.627 -0.261 . . . . 24.7 111.567 -179.269 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.566 ' HB ' HD23 ' A' ' 105' ' ' LEU . 48.3 pt -74.67 -35.46 37.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 C-N-CA 120.995 -0.282 . . . . 22.9 111.031 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -61.2 -38.59 87.1 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.961 0.41 . . . . 24.29 110.309 179.185 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -67.81 -43.48 79.54 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.897 -0.592 . . . . 24.74 110.52 179.488 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 50.2 ttp -58.11 -39.5 78.83 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.044 -0.525 . . . . 20.15 110.573 179.62 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 76.2 mt -66.94 -36.4 77.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.16 -0.473 . . . . 20.23 110.608 179.585 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 37.6 ttm180 -66.04 -29.92 70.35 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.173 -0.467 . . . . 25.57 110.806 179.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -75.88 -26.89 57.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.14 -0.482 . . . . 19.18 111.239 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.619 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -97.81 -16.23 19.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.245 -0.434 . . . . 16.88 111.173 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -94.57 105.19 17.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.135 -0.484 . . . . 20.4 111.009 -179.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -100.33 -33.34 10.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.865 -0.607 . . . . 21.43 111.294 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -64.06 -27.95 69.45 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.375 -0.375 . . . . 23.37 110.715 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 75.98 81.88 0.52 Allowed Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.921 -0.657 . . . . 24.32 112.952 179.51 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 16.5 p-10 -155.66 6.66 0.22 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.745 0.307 . . . . 24.4 110.919 179.605 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 59.94 25.64 62.04 Favored Glycine 0 C--N 1.331 0.251 0 C-N-CA 120.891 -0.671 . . . . 23.47 112.551 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 96.8 mmm -135.96 152.5 51.02 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.596 0.236 . . . . 22.91 110.43 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.502 HG22 ' HB2' ' A' ' 140' ' ' GLU . 41.4 mm -115.86 138.71 45.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 121.341 0.591 . . . . 18.67 112.126 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . 0.454 ' O ' ' N ' ' A' ' 139' ' ' GLU . 26.4 p30 -115.38 158.85 21.87 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.267 -0.879 . . . . 16.97 109.036 178.035 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 28.6 t80 -38.49 -24.21 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 112.589 0.589 . . . . 15.28 112.589 -179.029 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . 0.454 ' N ' ' O ' ' A' ' 137' ' ' ASN . 44.4 mt-10 -80.25 -55.78 4.67 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.822 0.344 . . . . 14.82 111.213 -179.437 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . 0.502 ' HB2' HG22 ' A' ' 136' ' ' ILE . 24.8 mt-10 -60.22 -27.17 66.98 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.174 -0.466 . . . . 17.46 110.266 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.57 ' HA ' ' HE3' ' A' ' 144' ' ' MET . 69.0 t80 -71.14 -56.34 6.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.877 -0.601 . . . . 13.65 110.415 179.54 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . 0.415 HG23 ' HB2' ' A' ' 85' ' ' MET . 43.1 t -44.73 -48.05 2.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.774 -0.648 . . . . 11.12 111.794 179.432 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 78.8 t90 -64.65 -55.43 20.25 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.513 0.56 . . . . 14.4 112.513 -178.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 144' ' ' MET . . . . . 0.619 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 16.7 ptt? -60.37 -35.41 75.64 Favored 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 112.451 0.538 . . . . 14.63 112.451 -178.004 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 145' ' ' ILE . . . . . 0.481 HD13 ' HB3' ' A' ' 85' ' ' MET . 3.2 pt -80.93 -17.27 12.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 C-N-CA 120.591 -0.444 . . . . 11.62 111.275 -179.883 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 42.2 t -69.25 -36.46 77.17 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.399 -0.593 . . . . 8.66 109.399 179.231 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 31.8 mm-40 -93.56 -16.48 24.36 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.138 -0.937 . . . . 11.87 110.229 179.382 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . 0.436 ' CB ' ' HA ' ' A' ' 145' ' ' ILE . 37.6 ttpt . . . . . 0 C--O 1.25 1.112 0 CA-C-O 118.231 -0.89 . . . . 13.97 110.961 179.474 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 9.8 mp . . . . . 0 C--O 1.233 0.21 0 CA-C-O 120.651 0.262 . . . . 2.0 111.491 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -62.88 167.0 5.02 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.422 -0.354 . . . . 1.72 110.68 179.616 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -49.37 -39.8 33.51 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.707 0.289 . . . . 2.2 111.436 179.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.95 -33.72 59.83 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.432 -0.349 . . . . 1.35 110.699 -179.593 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 -67.02 -44.73 79.5 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.001 -0.545 . . . . 2.34 110.583 179.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . 0.514 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 80.4 mt -61.29 -51.77 69.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.992 -0.549 . . . . 1.27 110.755 179.804 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.48 -21.0 66.53 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.044 -0.526 . . . . 1.22 111.193 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -72.09 -56.42 5.64 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 116.405 -0.361 . . . . 2.27 111.696 -179.405 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.514 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 8.6 p90 -77.85 -24.67 48.52 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.703 -0.399 . . . . 0.46 110.823 -179.636 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.412 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 20.1 tptm -66.81 -36.93 83.51 Favored 'General case' 0 C--O 1.233 0.201 0 N-CA-C 109.355 -0.609 . . . . 1.85 109.355 178.738 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.432 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 23.5 t70 -68.05 -48.18 66.32 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 109.224 -0.658 . . . . 0.44 109.224 178.347 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.72 -14.31 61.04 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.666 -0.697 . . . . 1.08 110.528 178.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.412 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 81.2 t80 -77.48 -49.94 13.7 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-N 115.929 -0.578 . . . . 0.56 110.18 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 34.0 m -66.91 -21.4 28.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.075 -0.511 . . . . 1.69 110.141 179.395 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.432 ' HG3' ' O ' ' A' ' 14' ' ' ASP . 70.5 mt-30 -59.99 -46.17 90.34 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.625 -0.716 . . . . 2.23 111.212 179.2 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 25.8 m-85 -84.36 22.33 1.27 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.304 -0.407 . . . . 0.69 111.565 -179.471 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -120.45 66.15 0.84 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.146 0.498 . . . . 0.46 110.441 179.385 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 11.2 mmmm -73.32 -26.19 60.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.77 -0.65 . . . . 2.55 111.269 -179.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -68.89 -42.64 76.66 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.111 -0.495 . . . . 1.8 111.306 -179.629 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 107.73 11.77 24.09 Favored Glycine 0 C--N 1.331 0.272 0 C-N-CA 120.723 -0.751 . . . . 0.54 112.791 179.683 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 38.5 p -86.18 10.35 14.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.71 0.29 . . . . 1.1 111.199 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 55.68 20.12 23.35 Favored Glycine 0 C--N 1.332 0.333 0 C-N-CA 120.803 -0.713 . . . . 0.37 112.126 -179.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.473 ' C ' HE22 ' A' ' 62' ' ' GLN . 32.5 mtpt -130.35 155.93 45.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.727 0.299 . . . . 1.75 111.081 -179.669 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.423 HG13 ' HB2' ' A' ' 63' ' ' LEU . 39.5 pt -115.5 133.7 61.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.408 -0.36 . . . . 1.2 111.494 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -48.8 143.21 5.51 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.116 -0.493 . . . . 1.04 111.696 -179.672 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 58.5 p -68.86 -29.87 68.27 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.662 -0.699 . . . . 1.71 111.724 -179.704 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.522 ' H ' ' HD3' ' A' ' 30' ' ' ARG . 0.2 OUTLIER -86.11 0.47 53.43 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.392 -0.367 . . . . 3.53 111.109 -179.536 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -109.29 -3.57 17.08 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.105 -0.498 . . . . 2.26 110.845 179.824 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -61.03 -52.33 65.43 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.232 -0.44 . . . . 1.95 110.616 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.421 ' HA2' HD21 ' A' ' 48' ' ' LEU . . . -52.41 -41.25 55.12 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.638 -0.791 . . . . 0.32 111.633 179.441 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 89.4 m -64.5 -34.67 78.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.018 0.437 . . . . 1.01 110.218 179.103 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 28.9 tp -66.82 -23.72 66.08 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.711 -0.677 . . . . 1.85 110.525 179.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 23.3 mmt -78.92 -39.23 35.34 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.221 -0.445 . . . . 1.43 110.039 178.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 70.3 mtt180 -59.19 -43.12 92.2 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.691 -0.686 . . . . 3.27 111.068 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.437 HG23 HD13 ' A' ' 39' ' ' LEU . 2.0 t -70.4 -13.29 62.07 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.38 -0.373 . . . . 1.54 111.42 179.886 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.437 HD13 HG23 ' A' ' 38' ' ' THR . 10.6 mp -113.14 157.14 22.03 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.193 -0.458 . . . . 1.94 110.59 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -48.29 -19.23 1.07 Allowed Glycine 0 CA--C 1.519 0.314 0 CA-C-N 116.013 -0.54 . . . . 0.69 113.441 -179.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 61.9 mm-40 -59.03 168.57 1.28 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.885 0.374 . . . . 1.97 110.894 179.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 6.0 t30 -170.27 64.35 0.47 Allowed Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.068 -0.515 . . . . 3.44 110.777 179.605 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . 0.533 ' HB3' ' NE2' ' A' ' 75' ' ' GLN . 32.1 Cg_endo -64.8 154.96 70.07 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.633 2.222 . . . . 0.59 112.449 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 20.8 m -80.43 157.01 26.37 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.027 -0.533 . . . . 1.28 110.69 179.765 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -46.77 -49.05 20.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.549 -0.296 . . . . 2.7 111.343 -179.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.09 -55.27 25.2 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.199 -0.455 . . . . 1.15 111.516 -179.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -50.7 -50.84 54.09 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.289 -0.414 . . . . 2.23 111.045 -179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.5 HD11 HD13 ' A' ' 52' ' ' ILE . 0.2 OUTLIER -58.25 -40.66 82.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.295 -0.411 . . . . 2.01 110.866 -179.844 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 85.0 mm-40 -67.42 -29.64 69.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.421 -0.354 . . . . 1.68 110.976 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -70.68 -49.37 47.94 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.22 -0.446 . . . . 0.62 111.529 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.401 HD12 HD12 ' A' ' 48' ' ' LEU . 0.9 OUTLIER -72.78 -28.32 62.52 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.49 -0.323 . . . . 1.11 111.614 -179.375 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.5 HD13 HD11 ' A' ' 48' ' ' LEU . 28.2 mt -70.21 -46.03 73.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 120.771 0.319 . . . . 1.25 110.389 179.467 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.94 -25.53 62.78 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.079 -0.51 . . . . 1.24 111.083 -179.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -77.98 -46.57 20.73 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.194 -0.457 . . . . 2.54 110.731 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -74.39 -27.13 60.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.188 -0.46 . . . . 1.19 111.378 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -64.76 -34.38 78.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.796 0.331 . . . . 1.95 110.985 -179.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -111.53 59.64 0.62 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.229 -0.441 . . . . 3.19 111.079 -179.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -170.81 -55.17 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.051 -0.522 . . . . 2.69 110.684 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 1.5 p30 -110.96 27.16 9.95 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.867 -0.606 . . . . 2.05 110.818 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . 0.529 ' N ' HD21 ' A' ' 60' ' ' ASN . 0.8 OUTLIER 62.66 -81.75 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.945 -0.57 . . . . 1.67 111.331 179.877 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -158.49 34.83 0.51 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.752 -0.737 . . . . 0.86 112.546 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.483 ' HA ' HE21 ' A' ' 62' ' ' GLN . 0.0 OUTLIER -140.47 150.22 43.52 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.031 0.443 . . . . 0.49 111.379 179.893 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.423 ' HB2' HG13 ' A' ' 27' ' ' ILE . 13.5 mt -121.99 155.48 35.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.804 -0.634 . . . . 2.05 110.566 -179.905 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -113.4 157.03 22.42 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.482 -0.326 . . . . 1.52 110.847 -179.657 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 59.7 t80 -43.16 -35.16 1.27 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.427 -0.351 . . . . 0.46 111.228 179.571 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.35 -38.8 59.89 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.143 0.423 . . . . 1.41 112.143 -179.579 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -63.99 -53.19 54.01 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.216 0.531 . . . . 1.36 110.28 179.636 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.433 ' CE2' ' HB2' ' A' ' 12' ' ' PHE . 18.4 t80 -59.22 -52.41 65.82 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.495 -0.775 . . . . 0.61 110.789 179.459 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 35.8 t -56.54 -49.0 76.09 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 116.28 -0.418 . . . . 1.41 110.51 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -43.67 -50.94 6.96 Favored Glycine 0 N--CA 1.45 -0.391 0 CA-C-N 115.503 -0.771 . . . . 0.41 112.313 179.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.473 ' HA ' ' HG2' ' A' ' 74' ' ' LYS . 11.0 mt -67.1 -42.69 88.62 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.373 0 CA-C-O 120.823 0.344 . . . . 1.13 111.064 179.752 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 87.8 mmm -53.26 -41.05 65.1 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.28 0.562 . . . . 1.24 110.003 179.344 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.8 -53.24 60.28 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.297 -0.865 . . . . 1.17 111.087 179.481 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.473 ' HG2' ' HA ' ' A' ' 71' ' ' ILE . 18.8 pttp -67.94 -27.09 66.32 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 120.858 0.361 . . . . 1.91 111.327 -179.81 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . 0.533 ' NE2' ' HB3' ' A' ' 43' ' ' PRO . 35.2 tt0 -80.35 -28.05 38.13 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.104 -0.498 . . . . 2.03 111.826 -179.352 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 38.6 mtt . . . . . 0 N--CA 1.45 -0.454 0 CA-C-N 116.448 -0.342 . . . . 1.52 111.541 -179.483 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.479 ' O ' ' HG3' ' A' ' 85' ' ' MET . 2.7 t . . . . . 0 N--CA 1.466 0.358 0 CA-C-O 120.592 0.235 . . . . 7.48 111.289 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -79.86 -28.73 39.98 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 112.776 0.658 . . . . 9.74 112.776 -178.3 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -59.91 -49.14 78.84 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.907 -0.317 . . . . 12.11 111.461 -179.393 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -69.72 -21.94 63.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.982 0.42 . . . . 10.87 110.628 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' MET . . . . . 0.479 ' HG3' ' O ' ' A' ' 81' ' ' THR . 23.9 mtt -72.75 -47.75 44.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.827 -0.624 . . . . 11.09 111.103 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 64.7 ttt180 -62.17 -38.21 88.17 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.396 -0.365 . . . . 16.05 110.195 179.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -59.01 -45.11 91.49 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.165 -0.68 . . . . 14.85 109.165 178.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -69.15 -27.92 65.97 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.476 -0.784 . . . . 14.11 110.557 179.259 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 62.0 t80 -63.4 -41.93 98.76 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.158 -0.474 . . . . 16.42 110.27 179.437 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 53.8 mttp -66.74 -41.82 87.2 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.765 -0.652 . . . . 17.66 110.435 179.481 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 78.3 mt -64.49 -39.61 86.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.102 -0.499 . . . . 18.15 111.076 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -73.79 -33.75 64.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.345 -0.389 . . . . 18.34 111.103 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 51.1 t0 -81.27 114.87 20.36 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.364 -0.38 . . . . 19.29 110.507 179.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.514 ' HG2' ' HB3' ' A' ' 104' ' ' GLU . 22.0 mmm180 -65.47 -57.48 8.17 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.004 -0.544 . . . . 22.47 110.992 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.99 160.3 22.04 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.093 -0.503 . . . . 23.34 110.975 -179.693 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -84.18 5.49 79.88 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.857 -0.687 . . . . 22.77 112.175 179.641 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 16.8 p-10 -57.81 -33.36 68.5 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.747 0.308 . . . . 23.0 111.185 -179.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 96.04 26.97 10.63 Favored Glycine 0 C--N 1.331 0.274 0 C-N-CA 120.833 -0.699 . . . . 20.02 112.619 179.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 68.0 m-85 -142.57 142.69 32.21 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.599 0.238 . . . . 20.56 110.853 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 65.5 mt -114.38 127.27 71.92 Favored 'Isoleucine or valine' 0 C--O 1.231 0.126 0 CA-C-O 121.0 0.429 . . . . 19.37 111.17 179.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 75.6 m -114.44 156.5 44.44 Favored Pre-proline 0 C--N 1.332 -0.182 0 CA-C-N 115.879 -0.6 . . . . 22.65 110.783 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_exo -44.13 -35.86 8.16 Favored 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 122.41 2.073 . . . . 23.78 112.284 -179.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.415 ' O ' ' HG3' ' A' ' 106' ' ' ARG . . . -63.83 -48.11 78.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.169 -0.468 . . . . 25.0 110.734 179.709 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . 0.514 ' HB3' ' HG2' ' A' ' 94' ' ' ARG . 45.4 mt-10 -72.9 -19.89 61.19 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.837 -0.619 . . . . 22.31 110.842 179.703 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.61 HD22 ' HB ' ' A' ' 121' ' ' ILE . 14.7 tp -80.16 -39.98 28.26 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.062 -0.517 . . . . 20.62 111.691 -179.22 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.433 ' HB3' HD13 ' A' ' 121' ' ' ILE . 7.4 ppt_? -73.76 -35.79 65.04 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.852 0.358 . . . . 27.9 110.517 -179.834 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 60.4 t80 -69.41 -44.7 70.85 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.963 -0.562 . . . . 25.96 111.306 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.419 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 7.3 p -63.75 -43.74 98.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.529 -0.305 . . . . 21.06 111.571 -179.536 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 20.6 mmt -55.43 -45.63 76.75 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.519 -0.309 . . . . 20.93 111.29 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 81.2 mt -59.35 -25.05 29.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.963 0.411 . . . . 25.52 110.619 179.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 80.1 m-20 -77.67 -39.41 44.96 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.963 -0.562 . . . . 23.32 110.533 179.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.419 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 10.5 mt -69.68 -28.68 66.07 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.93 -0.577 . . . . 21.07 110.668 179.859 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 113.18 17.08 7.94 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.921 -0.657 . . . . 23.25 112.523 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -113.88 108.8 17.55 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.804 0.335 . . . . 22.59 111.087 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -77.04 113.83 15.18 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.163 -0.471 . . . . 28.21 110.989 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . 0.467 ' HB ' HG21 ' A' ' 121' ' ' ILE . 1.2 m -127.39 155.01 38.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.026 0.441 . . . . 24.75 111.6 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' THR . . . . . 0.416 ' O ' HG12 ' A' ' 121' ' ' ILE . 72.2 p -99.34 144.26 28.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.793 -0.639 . . . . 27.5 110.227 179.275 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -51.77 -20.94 2.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.274 -0.421 . . . . 27.03 111.551 -179.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 12.9 mm-40 -77.43 -55.33 5.48 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.502 -0.317 . . . . 29.14 111.694 -179.618 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -61.63 -40.92 96.59 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 111.825 0.306 . . . . 24.7 111.825 -179.204 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.61 ' HB ' HD22 ' A' ' 105' ' ' LEU . 4.9 pt -68.59 -42.67 83.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 C-N-CA 121.062 -0.255 . . . . 22.9 111.584 -179.442 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . 0.517 ' N ' HG13 ' A' ' 121' ' ' ILE . 24.0 t70 -59.76 -33.16 71.32 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.825 0.345 . . . . 24.29 110.649 179.842 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 -66.06 -49.19 68.5 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.034 -0.53 . . . . 24.74 110.434 179.562 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' MET . . . . . 0.423 ' HE1' HD23 ' A' ' 105' ' ' LEU . 3.1 tmm? -56.96 -37.94 72.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.032 -0.531 . . . . 20.15 111.054 179.547 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.519 HG23 HD11 ' A' ' 136' ' ' ILE . 66.4 mt -65.55 -43.52 94.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.291 -0.413 . . . . 20.23 110.516 179.793 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 23.9 ttm180 -57.43 -35.43 70.08 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.892 -0.595 . . . . 25.57 110.984 179.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -69.47 -43.5 73.11 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.166 -0.47 . . . . 19.18 110.969 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.554 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -80.4 -12.22 59.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.217 -0.447 . . . . 16.88 111.283 -179.911 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -101.31 106.14 17.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.161 -0.472 . . . . 20.4 110.942 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 82.1 m-85 -98.16 -33.64 11.05 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.911 -0.586 . . . . 21.43 111.032 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -65.1 -16.41 63.44 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.213 -0.449 . . . . 23.37 110.772 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 61.16 82.75 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.871 -0.68 . . . . 24.32 112.55 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -151.68 -6.68 0.24 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.65 0.262 . . . . 24.4 111.393 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 74.66 20.47 79.51 Favored Glycine 0 C--N 1.331 0.253 0 C-N-CA 120.785 -0.721 . . . . 23.47 112.815 179.647 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 47.9 mtp -136.01 155.64 49.93 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.623 0.249 . . . . 22.91 110.385 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.519 HD11 HG23 ' A' ' 125' ' ' ILE . 48.6 mm -114.84 140.17 37.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 121.309 0.576 . . . . 18.67 112.092 -179.416 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . 0.449 ' O ' ' N ' ' A' ' 139' ' ' GLU . 1.9 m-20 -115.07 157.84 22.96 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.919 -1.037 . . . . 16.97 108.996 178.594 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 31.2 t80 -40.0 -23.84 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 120.762 0.315 . . . . 15.28 111.605 179.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . 0.449 ' N ' ' O ' ' A' ' 137' ' ' ASN . 19.4 mm-40 -80.53 -55.77 4.63 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-O 120.958 0.408 . . . . 14.82 110.871 -179.586 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . 0.497 ' HB2' HG22 ' A' ' 136' ' ' ILE . 25.8 mt-10 -61.27 -33.42 73.52 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.958 -0.565 . . . . 17.46 110.693 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.56 ' HA ' ' HE3' ' A' ' 144' ' ' MET . 76.9 t80 -66.91 -56.06 11.93 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.914 -0.585 . . . . 13.65 110.194 179.796 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . 0.464 HG12 ' SD ' ' A' ' 85' ' ' MET . 2.5 t -45.75 -44.86 4.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.554 -0.748 . . . . 11.12 112.138 179.83 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 79.8 t90 -65.13 -55.58 17.89 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.439 0.533 . . . . 14.4 112.439 -178.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 144' ' ' MET . . . . . 0.56 ' HE3' ' HA ' ' A' ' 141' ' ' PHE . 17.3 ptt? -60.28 -36.71 78.48 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 112.099 0.407 . . . . 14.63 112.099 -178.185 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 145' ' ' ILE . . . . . 0.438 HG23 ' CZ ' ' A' ' 141' ' ' PHE . 2.8 pt -80.73 -15.39 12.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 C-N-CA 120.803 -0.359 . . . . 11.62 111.327 179.817 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 45.0 t -69.42 -38.9 78.09 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.385 -0.598 . . . . 8.66 109.385 179.589 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 10.0 mm-40 -87.03 -21.07 26.33 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.313 -0.858 . . . . 11.87 109.945 178.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 24.5 ttpp . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.258 -0.877 . . . . 13.97 111.11 179.7 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.501 HD11 ' SG ' ' A' ' 69' ' ' CYS . 78.7 mt . . . . . 0 C--O 1.232 0.178 0 CA-C-O 120.805 0.336 . . . . 2.0 111.165 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 50.5 p -73.19 -176.37 2.15 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.434 -0.348 . . . . 1.72 111.525 -179.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.4 ' HG2' ' N ' ' A' ' 7' ' ' GLU . 0.1 OUTLIER -64.7 -38.08 89.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.475 -0.329 . . . . 2.2 111.518 -179.586 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.4 ' N ' ' HG2' ' A' ' 6' ' ' GLU . 11.9 pt-20 -75.06 -44.26 48.67 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.963 0.411 . . . . 1.35 111.009 -179.549 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 27.6 mt-30 -61.92 -46.2 90.4 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.892 -0.595 . . . . 2.34 110.885 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . 0.528 ' HA ' ' CZ ' ' A' ' 12' ' ' PHE . 62.9 mt -58.56 -52.64 57.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.135 -0.484 . . . . 1.27 111.006 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.85 -20.8 65.44 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.417 -0.356 . . . . 1.22 111.584 -179.722 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -70.82 -56.82 5.47 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 111.78 0.289 . . . . 2.27 111.78 -179.273 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.528 ' CZ ' ' HA ' ' A' ' 9' ' ' ILE . 19.3 p90 -79.57 -26.9 41.22 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 120.591 -0.444 . . . . 0.46 110.922 -179.692 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.418 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 45.8 tptt -65.51 -34.2 77.72 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 109.387 -0.598 . . . . 1.85 109.387 178.889 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.462 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 14.4 t70 -69.98 -50.09 45.13 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 108.998 -0.742 . . . . 0.44 108.998 178.187 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.89 -14.8 50.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.663 -0.699 . . . . 1.08 110.277 178.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.418 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 44.9 t80 -80.32 -45.47 17.78 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.636 -0.711 . . . . 0.56 110.733 -179.616 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.446 HG21 ' O ' ' A' ' 14' ' ' ASP . 24.6 m -69.62 -20.46 23.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 121.003 0.43 . . . . 1.69 110.288 179.749 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.462 ' HG3' ' O ' ' A' ' 14' ' ' ASP . 78.3 mt-30 -60.38 -29.43 68.94 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.784 -0.643 . . . . 2.23 111.175 179.471 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 56.8 m-85 -104.34 13.64 31.69 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.558 -0.292 . . . . 0.69 111.7 -179.409 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -114.12 81.96 1.62 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.981 0.419 . . . . 0.46 110.921 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 43.8 mmtm -85.42 -34.59 21.67 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.969 -0.56 . . . . 2.55 111.291 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -62.26 -28.53 69.77 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.127 -0.488 . . . . 1.8 111.296 -179.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 89.69 7.25 69.1 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.697 -0.763 . . . . 0.54 112.72 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 21.9 p -76.76 7.87 4.25 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.583 0.23 . . . . 1.1 111.231 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 55.88 27.23 49.9 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.609 -0.805 . . . . 0.37 111.745 -179.436 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.658 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 37.8 mtpt -136.68 155.56 49.71 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.858 0.361 . . . . 1.75 111.095 -179.402 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 46.5 pt -125.51 143.51 38.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.11 -0.496 . . . . 1.2 111.252 -179.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -56.92 124.98 20.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.365 -0.38 . . . . 1.04 111.04 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.1 t -62.03 -13.36 25.31 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.116 -0.493 . . . . 1.71 111.268 -179.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 68.1 mtp180 -79.75 -29.07 40.41 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.125 -0.488 . . . . 3.53 110.565 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -93.54 3.89 54.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.959 -0.564 . . . . 2.26 110.341 179.678 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.415 ' O ' ' HG3' ' A' ' 36' ' ' MET . 0.8 OUTLIER -56.91 -55.29 36.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.794 -0.639 . . . . 1.95 110.636 -179.932 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.443 ' HA3' HD21 ' A' ' 48' ' ' LEU . . . -53.91 -42.63 70.39 Favored Glycine 0 C--N 1.331 0.282 0 C-N-CA 120.556 -0.831 . . . . 0.32 111.892 179.551 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 57.8 m -62.69 -36.35 82.64 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.094 0.473 . . . . 1.01 110.573 179.278 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 62.9 tp -65.28 -31.65 72.91 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.799 -0.637 . . . . 1.85 110.822 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.415 ' HG3' ' O ' ' A' ' 32' ' ' LEU . 19.3 mtp -80.48 -28.59 37.51 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.129 -0.487 . . . . 1.43 110.851 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 24.9 mtp180 -65.23 -44.12 89.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.49 -0.323 . . . . 3.27 110.731 179.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.3 t -65.59 -13.67 59.53 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.956 0.408 . . . . 1.54 110.991 179.579 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 8.8 mp -113.86 156.87 23.16 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.996 -0.547 . . . . 1.94 110.65 179.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -46.51 -27.95 3.22 Favored Glycine 0 CA--C 1.52 0.372 0 C-N-CA 120.886 -0.673 . . . . 0.69 113.161 -179.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -60.66 154.64 20.87 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.712 0.292 . . . . 1.97 111.157 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 48.5 t-20 -172.13 82.61 0.46 Allowed Pre-proline 0 C--N 1.33 -0.242 0 CA-C-N 116.222 -0.444 . . . . 3.44 110.747 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . 0.405 ' HB3' ' NE2' ' A' ' 75' ' ' GLN . 56.1 Cg_endo -70.27 159.26 53.63 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.512 2.141 . . . . 0.59 112.367 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 37.7 m -65.17 146.83 54.46 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.107 -0.497 . . . . 1.28 110.584 179.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.489 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 16.8 mm-40 -48.38 -55.68 10.14 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.843 -0.162 . . . . 2.7 111.377 -179.47 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -49.15 -42.66 40.32 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.784 0.326 . . . . 1.15 111.248 -179.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.508 ' HG3' HD23 ' A' ' 51' ' ' LEU . 7.9 tp10 -64.52 -50.76 66.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.16 -0.473 . . . . 2.23 110.288 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.446 ' HA ' HD21 ' A' ' 51' ' ' LEU . 33.0 tp -57.32 -33.83 68.11 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.957 -0.565 . . . . 2.01 110.9 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.489 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 77.4 mm-40 -73.55 -34.67 65.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.314 -0.403 . . . . 1.68 110.511 179.71 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 56.4 m-20 -72.26 -55.27 7.46 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.099 -0.501 . . . . 0.62 111.649 -179.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.508 HD23 ' HG3' ' A' ' 47' ' ' GLU . 1.9 pp -61.2 -34.64 75.41 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 111.823 0.305 . . . . 1.11 111.823 -179.207 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 49.4 mt -72.01 -53.62 19.45 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 120.692 0.282 . . . . 1.25 110.857 179.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.85 -26.23 65.66 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.341 -0.39 . . . . 1.24 111.036 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -77.33 -51.86 10.14 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.191 -0.459 . . . . 2.54 110.697 179.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -69.53 -16.6 63.46 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.197 -0.456 . . . . 1.19 111.294 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -80.08 -36.66 35.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.361 -0.382 . . . . 1.95 110.964 -179.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 18.9 m120 -98.5 36.57 1.61 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.201 -0.454 . . . . 3.19 110.991 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -159.54 -27.39 0.07 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.172 -0.467 . . . . 2.69 110.937 179.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 10.4 m120 -120.19 20.44 12.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.273 -0.421 . . . . 2.05 110.825 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 24.5 m-80 64.13 -81.34 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 115.901 -0.591 . . . . 1.67 111.453 179.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -154.84 5.21 0.26 Allowed Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.547 -0.835 . . . . 0.86 113.001 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.658 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -117.23 153.91 32.08 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.984 0.421 . . . . 0.49 111.619 -179.945 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.516 ' HG ' ' HB2' ' A' ' 67' ' ' GLU . 1.7 tp -128.62 153.62 47.07 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.699 -0.682 . . . . 2.05 110.201 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 10.9 m-80 -110.61 157.0 20.16 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-O 121.343 0.592 . . . . 1.52 111.472 -179.363 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.415 ' O ' ' HB2' ' A' ' 69' ' ' CYS . 88.1 t80 -46.39 -38.91 9.58 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.91 -1.041 . . . . 0.46 111.736 -179.439 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -67.49 -37.54 83.01 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.606 0.595 . . . . 1.41 112.606 -179.087 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.516 ' HB2' ' HG ' ' A' ' 63' ' ' LEU . 7.7 mt-10 -63.92 -52.91 57.65 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.126 0.489 . . . . 1.36 109.842 179.611 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.436 ' O ' ' HG3' ' A' ' 72' ' ' MET . 28.2 t80 -59.53 -54.39 47.14 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.551 -0.75 . . . . 0.61 110.608 179.175 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.501 ' SG ' HD11 ' A' ' 4' ' ' LEU . 0.5 OUTLIER -53.78 -46.63 71.08 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.2 -0.455 . . . . 1.41 110.729 -179.986 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -48.28 -54.27 13.19 Favored Glycine 0 C--N 1.331 0.291 0 CA-C-N 115.857 -0.61 . . . . 0.41 112.564 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.444 ' HA ' ' HG2' ' A' ' 74' ' ' LYS . 11.5 mt -61.79 -43.09 96.77 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.297 0 CA-C-O 120.861 0.363 . . . . 1.13 110.751 179.755 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' MET . . . . . 0.436 ' HG3' ' O ' ' A' ' 68' ' ' PHE . 61.8 mtp -54.9 -28.93 54.39 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.965 -0.561 . . . . 1.24 110.05 179.582 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.89 -50.3 36.49 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.964 -0.562 . . . . 1.17 110.754 179.63 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.444 ' HG2' ' HA ' ' A' ' 71' ' ' ILE . 63.8 pttt -68.84 -28.49 66.77 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.357 -0.383 . . . . 1.91 111.655 -179.616 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . 0.405 ' NE2' ' HB3' ' A' ' 43' ' ' PRO . 7.5 tt0 -81.0 -55.05 5.04 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.123 0.416 . . . . 2.03 112.123 -179.319 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 71.3 mtp . . . . . 0 N--CA 1.454 -0.256 0 N-CA-C 112.282 0.475 . . . . 1.52 112.282 -178.883 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.579 ' O ' ' HG3' ' A' ' 85' ' ' MET . 65.7 m . . . . . 0 CA--C 1.528 0.104 0 N-CA-C 111.707 0.262 . . . . 7.48 111.707 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.424 ' HB3' ' OH ' ' A' ' 138' ' ' TYR . 44.9 mt-10 -55.55 -16.34 3.83 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 112.873 0.694 . . . . 9.74 112.873 -178.772 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -61.38 -55.99 25.38 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.863 0.364 . . . . 12.11 111.693 -179.329 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -71.59 -21.76 61.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.338 -0.392 . . . . 10.87 111.148 -179.522 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' MET . . . . . 0.579 ' HG3' ' O ' ' A' ' 81' ' ' THR . 10.8 mtp -74.38 -39.58 62.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.353 -0.385 . . . . 11.09 110.908 -179.473 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 61.4 ttt180 -69.76 -41.41 75.24 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.064 -0.517 . . . . 16.05 110.327 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -59.35 -40.93 87.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.219 0.533 . . . . 14.85 109.596 178.857 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -69.62 -29.51 67.02 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.652 -0.704 . . . . 14.11 110.425 179.277 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 64.0 t80 -66.91 -41.18 87.51 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.053 -0.521 . . . . 16.42 110.483 179.466 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 49.0 mttm -64.07 -42.93 96.82 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.882 -0.599 . . . . 17.66 110.789 179.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 84.0 mt -64.8 -46.95 90.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.892 -0.595 . . . . 18.15 111.066 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -60.02 -48.03 83.41 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.256 -0.429 . . . . 18.34 110.867 179.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 42.9 t0 -64.68 109.49 2.04 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.074 -0.512 . . . . 19.29 110.608 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.459 ' HG2' ' HB3' ' A' ' 104' ' ' GLU . 19.1 mmm180 -64.84 -42.2 95.1 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.114 -0.494 . . . . 22.47 111.141 -179.441 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -94.39 178.46 5.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.277 -0.42 . . . . 23.34 110.969 -179.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.14 5.24 57.57 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.962 -0.637 . . . . 22.77 112.033 179.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 18.5 p-10 -63.54 -31.66 72.89 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.783 0.325 . . . . 23.0 111.079 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 93.41 27.28 13.5 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.784 -0.722 . . . . 20.02 112.606 179.704 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 67.9 m-85 -138.88 143.52 38.78 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.594 0.235 . . . . 20.56 110.879 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.471 ' HB ' ' HB ' ' A' ' 136' ' ' ILE . 56.1 mt -114.33 128.74 71.22 Favored 'Isoleucine or valine' 0 C--O 1.232 0.144 0 CA-C-O 120.94 0.4 . . . . 19.37 111.061 179.638 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 49.5 m -114.84 156.65 44.74 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 115.818 -0.628 . . . . 22.65 110.506 -179.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . 0.413 ' HG3' HD12 ' A' ' 125' ' ' ILE . 83.2 Cg_exo -44.29 -35.11 7.84 Favored 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 122.174 1.916 . . . . 23.78 112.012 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.456 ' O ' ' HG3' ' A' ' 106' ' ' ARG . . . -65.35 -49.59 68.78 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.099 -0.501 . . . . 25.0 110.509 179.377 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . 0.459 ' HB3' ' HG2' ' A' ' 94' ' ' ARG . 45.5 mt-10 -69.71 -20.37 63.54 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.862 -0.608 . . . . 22.31 110.641 179.506 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.534 HD23 ' HB ' ' A' ' 121' ' ' ILE . 42.1 tp -80.29 -39.55 28.59 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.061 -0.518 . . . . 20.62 111.51 -179.346 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.456 ' HG3' ' O ' ' A' ' 103' ' ' ALA . 3.3 ppt_? -72.03 -32.16 66.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.186 0.517 . . . . 27.9 110.39 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 81.0 t80 -73.49 -43.33 60.38 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.581 -0.736 . . . . 25.96 111.482 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 7.5 p -66.86 -48.17 80.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 N-CA-C 111.879 0.325 . . . . 21.06 111.879 -179.184 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.503 ' HE2' ' HZ1' ' A' ' 148' ' ' LYS . 22.7 mmt -50.84 -41.89 58.1 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 111.625 0.232 . . . . 20.93 111.625 -179.174 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 79.7 mt -61.78 -30.44 48.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 120.951 0.405 . . . . 25.52 110.528 179.401 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -70.77 -35.85 72.79 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.007 -0.542 . . . . 23.32 110.427 179.619 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.413 HD11 ' N ' ' A' ' 112' ' ' LEU . 9.0 mp -72.84 -42.14 64.08 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.946 -0.57 . . . . 21.07 110.634 179.783 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 115.53 41.11 0.82 Allowed Glycine 0 N--CA 1.452 -0.272 0 CA-C-N 115.875 -0.602 . . . . 23.25 112.392 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -110.03 -31.75 7.26 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 111.577 0.214 . . . . 22.59 111.577 -179.558 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 36.6 mtmm 52.7 90.0 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.966 0.413 . . . . 28.21 110.606 -179.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 2.4 m -123.38 155.78 29.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.906 -0.588 . . . . 24.75 112.12 -178.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 70.5 p -92.23 145.06 24.79 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.57 -0.741 . . . . 27.5 110.216 179.187 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . 0.46 ' HA ' HD13 ' A' ' 121' ' ' ILE . 8.8 m-20 -51.62 -18.38 1.14 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.041 -0.527 . . . . 27.03 111.98 -179.361 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -77.51 -55.62 5.22 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.078 0.399 . . . . 29.14 112.078 -179.008 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -61.87 -40.57 95.83 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 111.967 0.358 . . . . 24.7 111.967 -179.044 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.534 ' HB ' HD23 ' A' ' 105' ' ' LEU . 5.1 pt -69.63 -40.15 79.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 C-N-CA 120.897 -0.321 . . . . 22.9 111.522 -179.568 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . 0.419 ' N ' HG13 ' A' ' 121' ' ' ILE . 15.4 t70 -56.49 -41.52 76.78 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.858 0.361 . . . . 24.29 110.42 179.552 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -62.83 -45.37 92.91 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.059 -0.519 . . . . 24.74 110.475 179.52 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 59.9 ttp -56.98 -38.2 72.69 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.034 -0.53 . . . . 20.15 110.868 179.49 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.54 HG21 HD11 ' A' ' 136' ' ' ILE . 58.6 mt -64.43 -38.39 82.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.147 -0.479 . . . . 20.23 110.525 179.691 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 6.7 ttp85 -62.21 -42.7 99.53 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.957 -0.565 . . . . 25.57 110.632 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -65.6 -26.46 67.85 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.876 -0.602 . . . . 19.18 110.962 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.543 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -95.65 -13.07 24.6 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.104 -0.498 . . . . 16.88 111.21 179.912 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -100.16 105.79 17.43 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.094 -0.503 . . . . 20.4 110.837 -179.77 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 91.2 m-85 -97.4 -30.91 12.65 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.878 -0.601 . . . . 21.43 111.387 -179.498 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -69.72 -15.04 63.08 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.301 -0.409 . . . . 23.37 110.715 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 60.5 87.4 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.977 -0.63 . . . . 24.32 113.059 179.581 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -155.7 -23.84 0.11 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.755 0.312 . . . . 24.4 111.099 179.511 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 93.87 23.51 22.85 Favored Glycine 0 C--N 1.331 0.293 0 C-N-CA 120.817 -0.706 . . . . 23.47 112.617 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 82.1 mmm -135.8 155.22 50.68 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 110.423 -0.214 . . . . 22.91 110.423 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.54 HD11 HG21 ' A' ' 125' ' ' ILE . 46.9 mm -114.57 139.53 40.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 121.306 0.574 . . . . 18.67 111.599 179.759 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . 0.451 ' O ' ' N ' ' A' ' 139' ' ' GLU . 16.2 m-20 -115.09 157.4 23.61 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.095 -0.957 . . . . 16.97 108.887 178.662 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . 0.424 ' OH ' ' HB3' ' A' ' 82' ' ' GLU . 19.5 t80 -41.13 -22.86 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 120.893 0.378 . . . . 15.28 111.024 179.483 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . 0.451 ' N ' ' O ' ' A' ' 137' ' ' ASN . 9.6 mm-40 -81.16 -55.25 4.87 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.24 -0.436 . . . . 14.82 111.019 -179.662 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . 0.503 ' HB2' HG22 ' A' ' 136' ' ' ILE . 31.9 mt-10 -60.11 -34.1 73.04 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.195 -0.457 . . . . 17.46 110.74 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.558 ' HA ' ' HE1' ' A' ' 144' ' ' MET . 82.2 t80 -68.29 -55.28 12.68 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.034 -0.53 . . . . 13.65 110.326 179.503 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . 0.52 ' HA ' HD11 ' A' ' 145' ' ' ILE . 2.3 t -47.04 -39.67 4.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.485 -0.78 . . . . 11.12 111.684 179.427 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 143' ' ' TRP . . . . . 0.435 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 84.8 t90 -71.06 -55.43 8.26 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.182 0.438 . . . . 14.4 112.182 -178.856 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 144' ' ' MET . . . . . 0.558 ' HE1' ' HA ' ' A' ' 141' ' ' PHE . 17.3 ptt? -61.3 -23.79 65.95 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 113.156 0.799 . . . . 14.63 113.156 -177.801 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 145' ' ' ILE . . . . . 0.55 HG13 ' N ' ' A' ' 146' ' ' SER . 48.5 pt -80.7 -46.15 21.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 N-CA-C 112.488 0.551 . . . . 11.62 112.488 -179.287 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 146' ' ' SER . . . . . 0.55 ' N ' HG13 ' A' ' 145' ' ' ILE . 12.6 p -63.29 -13.94 44.09 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-O 121.201 0.524 . . . . 8.66 110.469 -179.839 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 147' ' ' GLN . . . . . 0.435 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 17.0 mm-40 -117.57 13.77 14.39 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.35 -0.841 . . . . 11.87 111.326 -178.563 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . 0.532 ' HG3' ' O ' ' A' ' 144' ' ' MET . 35.5 mttm . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.19 -0.91 . . . . 13.97 110.84 179.548 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.456 HD12 ' SG ' ' A' ' 69' ' ' CYS . 49.3 mt . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.955 0.407 . . . . 2.0 110.71 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.41 169.32 17.41 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.875 -0.602 . . . . 1.72 111.073 -179.833 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -52.05 -46.64 65.18 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.407 -0.36 . . . . 2.2 111.501 179.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -70.82 -46.13 63.33 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.216 -0.447 . . . . 1.35 111.08 -179.27 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -58.16 -42.99 87.14 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.975 -0.557 . . . . 2.34 110.872 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . 0.492 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 72.5 mt -59.47 -51.04 77.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.302 -0.408 . . . . 1.27 110.376 179.596 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.08 -22.54 66.97 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.024 -0.535 . . . . 1.22 111.315 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -70.05 -56.87 5.81 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 116.34 -0.391 . . . . 2.27 111.835 -179.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.497 ' HB2' ' HE2' ' A' ' 68' ' ' PHE . 13.3 p90 -78.91 -24.85 43.85 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.733 -0.387 . . . . 0.46 110.692 -179.684 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.401 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 24.0 tptp -64.01 -35.58 81.17 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 108.923 -0.769 . . . . 1.85 108.923 178.382 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.427 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 20.4 t70 -70.14 -49.78 47.18 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 115.621 -0.718 . . . . 0.44 109.302 178.37 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.43 -14.62 42.81 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.769 -0.65 . . . . 1.08 110.506 178.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.401 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 36.3 t80 -79.93 -50.58 10.24 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.742 -0.663 . . . . 0.56 110.686 -179.708 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 31.2 m -65.93 -19.31 25.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 121.01 0.433 . . . . 1.69 110.336 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.427 ' HG2' ' O ' ' A' ' 14' ' ' ASP . 75.3 mm-40 -58.64 -37.18 75.39 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.656 -0.702 . . . . 2.23 111.331 179.294 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 62.0 m-85 -91.26 9.87 29.57 Favored 'General case' 0 N--CA 1.464 0.248 0 N-CA-C 111.767 0.284 . . . . 0.69 111.767 -179.684 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -106.85 83.94 1.92 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.886 0.374 . . . . 0.46 110.808 179.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 29.9 mmmt -92.77 -10.61 36.34 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.061 -0.518 . . . . 2.55 111.242 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -84.95 -14.32 47.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.147 -0.479 . . . . 1.8 111.281 -179.488 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.14 6.73 88.79 Favored Glycine 0 N--CA 1.453 -0.21 0 C-N-CA 120.688 -0.768 . . . . 0.54 112.605 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 40.2 p -82.4 8.09 12.39 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.688 0.28 . . . . 1.1 111.071 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 56.94 18.01 24.49 Favored Glycine 0 C--N 1.332 0.34 0 C-N-CA 120.824 -0.703 . . . . 0.37 112.165 -179.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.441 ' C ' HE22 ' A' ' 62' ' ' GLN . 32.6 mtpt -129.31 155.69 45.21 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.773 0.32 . . . . 1.75 111.161 -179.406 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.412 ' N ' HE22 ' A' ' 62' ' ' GLN . 39.8 pt -118.19 133.02 66.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 120.895 0.379 . . . . 1.2 111.455 -179.791 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -52.52 138.77 27.03 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.079 -0.509 . . . . 1.04 111.247 -179.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 8.9 t -71.27 -2.51 16.41 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.194 -0.457 . . . . 1.71 111.323 -179.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.433 ' HD2' ' N ' ' A' ' 30' ' ' ARG . 0.9 OUTLIER -98.48 2.49 47.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.029 0.443 . . . . 3.53 110.25 179.592 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -124.43 -5.41 7.7 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.782 -0.645 . . . . 2.26 110.886 -179.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.463 ' O ' ' HG2' ' A' ' 36' ' ' MET . 2.1 tm? -55.57 -51.28 67.64 Favored 'General case' 0 C--O 1.233 0.198 0 N-CA-C 109.954 -0.387 . . . . 1.95 109.954 179.694 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -53.71 -37.31 56.72 Favored Glycine 0 C--N 1.333 0.366 0 C-N-CA 120.629 -0.796 . . . . 0.32 111.4 179.122 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 59.7 m -67.49 -31.48 71.65 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.279 0.561 . . . . 1.01 110.112 178.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 56.3 tp -72.83 -19.72 61.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.544 -0.753 . . . . 1.85 110.369 179.554 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.463 ' HG2' ' O ' ' A' ' 32' ' ' LEU . 75.8 mmm -80.02 -47.11 15.43 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.062 -0.517 . . . . 1.43 110.786 179.593 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 13.4 ptm180 -61.85 -39.87 93.38 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.365 -0.38 . . . . 3.27 111.399 -179.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.476 HG21 HD11 ' A' ' 39' ' ' LEU . 5.3 t -62.84 -14.42 45.64 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 121.179 0.514 . . . . 1.54 110.413 179.491 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.476 HD11 HG21 ' A' ' 38' ' ' THR . 6.8 mp -114.46 157.21 23.23 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.464 -0.789 . . . . 1.94 109.31 178.385 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -74.02 34.54 0.91 Allowed Glycine 0 CA--C 1.521 0.43 0 C-N-CA 120.612 -0.804 . . . . 0.69 113.298 -179.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.462 ' OE1' ' HB3' ' A' ' 39' ' ' LEU . 3.5 mm100 -91.65 -68.12 0.81 Allowed 'General case' 0 C--O 1.232 0.14 0 CA-C-O 120.829 0.347 . . . . 1.97 110.547 179.517 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 31.0 m-80 54.42 78.32 0.39 Allowed Pre-proline 0 CA--C 1.53 0.183 0 CA-C-N 115.961 -0.563 . . . . 3.44 111.16 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -75.04 175.51 11.15 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.456 2.104 . . . . 0.59 112.319 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 34.4 m -74.16 149.01 41.19 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.173 -0.467 . . . . 1.28 110.734 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.466 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 38.1 mt-10 -53.6 -55.84 22.31 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.546 -0.297 . . . . 2.7 111.484 -179.664 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.85 -47.08 71.32 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.339 -0.391 . . . . 1.15 111.698 -179.405 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -57.9 -49.95 74.99 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.926 0.393 . . . . 2.23 110.582 -179.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 21.4 tp -57.48 -37.13 72.42 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.832 -0.622 . . . . 2.01 111.068 -179.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.466 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 78.4 mm-40 -75.2 -28.01 59.82 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.42 -0.355 . . . . 1.68 111.264 -179.818 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 45.7 m-20 -75.35 -46.05 35.6 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.402 -0.363 . . . . 0.62 111.681 -179.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.9 pp -71.92 -40.12 69.01 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.552 -0.295 . . . . 1.11 111.66 -179.314 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 71.8 mt -64.97 -45.02 95.94 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-O 120.746 0.308 . . . . 1.25 110.736 179.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -69.08 -35.12 76.15 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.308 -0.405 . . . . 1.24 110.667 179.767 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -64.93 -46.63 80.83 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.18 -0.464 . . . . 2.54 109.87 179.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -70.92 -21.5 62.35 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.844 -0.616 . . . . 1.19 110.909 179.295 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -65.65 -54.39 28.17 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.344 -0.389 . . . . 1.95 110.865 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 87.1 m-20 -93.81 52.76 1.71 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.279 -0.419 . . . . 3.19 110.932 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.419 ' C ' HD21 ' A' ' 58' ' ' ASN . 0.2 OUTLIER -162.33 -63.24 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.188 -0.46 . . . . 2.69 110.628 179.987 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 29.4 m-80 -93.0 27.1 2.54 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.204 -0.453 . . . . 2.05 110.869 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 10.9 m120 65.21 -78.98 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 115.998 -0.546 . . . . 1.67 111.172 179.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -163.79 22.06 0.16 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.901 -0.666 . . . . 0.86 112.297 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.441 HE22 ' C ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -131.92 153.1 50.61 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.976 0.417 . . . . 0.49 111.38 -179.782 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 33.6 mt -120.63 151.9 38.86 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.768 -0.651 . . . . 2.05 110.276 179.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 19.9 m-80 -113.18 157.69 21.37 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.765 0.317 . . . . 1.52 110.879 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -42.61 -39.75 2.46 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.751 -0.659 . . . . 0.46 111.415 -179.499 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -68.98 -35.63 76.94 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.105 0.409 . . . . 1.41 112.105 -179.575 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -61.1 -52.87 63.08 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.01 0.433 . . . . 1.36 110.457 179.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.497 ' HE2' ' HB2' ' A' ' 12' ' ' PHE . 36.6 t80 -65.63 -46.24 80.01 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.698 -0.683 . . . . 0.61 111.02 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.456 ' SG ' HD12 ' A' ' 4' ' ' LEU . 2.7 t -58.38 -46.99 85.28 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.233 -0.44 . . . . 1.41 110.723 -179.932 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -53.32 -50.27 53.12 Favored Glycine 0 N--CA 1.451 -0.347 0 CA-C-N 115.837 -0.619 . . . . 0.41 112.136 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.528 HG23 ' HE2' ' A' ' 74' ' ' LYS . 12.6 mt -62.57 -38.04 80.46 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.386 0 CA-C-O 120.924 0.392 . . . . 1.13 110.787 179.695 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -58.6 -28.57 65.71 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.899 -0.591 . . . . 1.24 110.26 179.421 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -73.09 -49.45 28.4 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.06 -0.518 . . . . 1.17 110.778 179.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.528 ' HE2' HG23 ' A' ' 71' ' ' ILE . 61.9 pttt -69.56 -26.7 64.62 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.245 -0.434 . . . . 1.91 110.838 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 58.2 tt0 -78.69 -50.06 12.07 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.074 -0.512 . . . . 2.03 110.99 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 34.8 mtt . . . . . 0 N--CA 1.447 -0.612 0 CA-C-N 116.175 -0.466 . . . . 1.52 110.908 179.779 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.5 ' O ' ' HG2' ' A' ' 85' ' ' MET . 6.1 t . . . . . 0 N--CA 1.47 0.532 0 CA-C-O 121.079 0.466 . . . . 7.48 111.388 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -46.08 -32.38 2.84 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 113.064 0.764 . . . . 9.74 113.064 -178.479 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -53.74 -56.06 20.77 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.002 0.43 . . . . 12.11 111.733 -179.152 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -65.99 -17.51 64.72 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.227 -0.442 . . . . 10.87 110.85 -179.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' MET . . . . . 0.5 ' HG2' ' O ' ' A' ' 81' ' ' THR . 0.8 OUTLIER -83.0 -25.02 32.63 Favored 'General case' 0 CA--C 1.509 -0.63 0 CA-C-O 121.912 0.863 . . . . 11.09 109.081 -179.089 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.522 ' HB2' ' HH ' ' A' ' 138' ' ' TYR . 31.1 tpt180 -71.04 -45.23 64.22 Favored 'General case' 0 N--CA 1.442 -0.835 0 CA-C-N 113.902 -1.499 . . . . 16.05 110.151 179.693 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -69.26 -37.26 77.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.844 -0.616 . . . . 14.85 110.06 178.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -69.69 -39.58 76.86 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.008 -0.542 . . . . 14.11 111.046 179.635 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -64.25 -34.84 79.04 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.995 0.426 . . . . 16.42 110.276 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 59.8 mttt -62.45 -55.23 29.65 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.726 -0.67 . . . . 17.66 110.882 179.493 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 55.1 mt -64.15 -29.68 48.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.655 -0.702 . . . . 18.15 111.652 -179.409 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -79.6 -29.97 41.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.584 -0.28 . . . . 18.34 111.657 -179.403 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 24.1 t0 -83.84 101.83 11.91 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.009 0.433 . . . . 19.29 110.617 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.86 -14.17 58.65 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.874 -0.603 . . . . 22.47 111.719 -179.567 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . 0.448 ' HB2' ' OD1' ' A' ' 97' ' ' ASP . 4.7 m-20 -125.66 160.07 30.62 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.932 0.396 . . . . 23.34 111.148 -179.876 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -87.68 5.34 85.11 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.899 -0.667 . . . . 22.77 112.051 179.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.448 ' OD1' ' HB2' ' A' ' 95' ' ' ASP . 10.4 p-10 -61.54 -33.12 73.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.784 0.326 . . . . 23.0 110.962 -179.844 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 99.84 17.85 24.43 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.758 -0.734 . . . . 20.02 112.845 179.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . 0.423 ' HB2' ' OD2' ' A' ' 97' ' ' ASP . 98.0 m-85 -141.09 147.1 38.01 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.815 0.34 . . . . 20.56 111.313 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 71.3 mt -114.96 136.2 52.41 Favored 'Isoleucine or valine' 0 C--O 1.232 0.157 0 CA-C-N 116.141 -0.482 . . . . 19.37 110.828 179.368 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 70.8 m -114.64 156.13 45.18 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 116.076 -0.511 . . . . 22.65 110.647 -179.819 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -40.1 -36.14 1.39 Allowed 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 122.458 2.105 . . . . 23.78 112.524 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.83 -51.66 60.89 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.105 -0.498 . . . . 25.0 110.839 179.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -63.42 -45.03 92.87 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.808 -0.633 . . . . 22.31 110.739 179.768 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.588 HD21 ' HB ' ' A' ' 121' ' ' ILE . 21.7 tp -52.27 -42.71 63.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.862 -0.608 . . . . 20.62 110.999 -179.665 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.53 HH21 ' HA ' ' A' ' 117' ' ' THR . 4.4 ttm180 -72.13 -45.24 61.33 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.896 -0.593 . . . . 27.9 111.14 -179.907 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -53.14 -34.2 55.76 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.272 -0.422 . . . . 25.96 111.42 -179.468 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.453 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 43.3 t -80.17 -51.15 16.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.636 -0.256 . . . . 21.06 111.292 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 18.1 mmt -49.61 -46.18 49.01 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.372 -0.376 . . . . 20.93 111.406 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 68.4 mt -62.31 -30.16 48.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.92 0.39 . . . . 25.52 110.589 179.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 -74.94 -28.02 60.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.029 -0.532 . . . . 23.32 110.913 179.494 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.453 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 27.8 mt -77.16 -41.79 40.31 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.108 -0.496 . . . . 21.07 110.732 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 131.18 -5.2 5.65 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.996 -0.621 . . . . 23.25 111.965 -179.611 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -91.13 97.69 11.3 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.696 0.284 . . . . 22.59 110.875 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -68.71 102.1 1.45 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.291 -0.413 . . . . 28.21 110.82 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . 0.43 ' HB ' HG23 ' A' ' 121' ' ' ILE . 2.3 m -115.86 154.74 17.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.212 -0.449 . . . . 24.75 111.428 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' THR . . . . . 0.53 ' HA ' HH21 ' A' ' 106' ' ' ARG . 81.5 p -98.88 145.77 26.65 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.854 -0.612 . . . . 27.5 110.53 179.487 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -51.88 -20.84 2.49 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.227 -0.442 . . . . 27.03 111.612 -179.549 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -78.26 -53.2 7.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.427 -0.351 . . . . 29.14 111.676 -179.527 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -63.83 -37.91 89.13 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.04 0.385 . . . . 24.7 112.04 -179.115 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.588 ' HB ' HD21 ' A' ' 105' ' ' LEU . 38.7 pt -72.83 -42.19 61.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 C-N-CA 120.83 -0.348 . . . . 22.9 111.702 -179.518 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . 0.457 ' N ' HG13 ' A' ' 121' ' ' ILE . 18.1 t70 -58.74 -44.77 90.59 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.842 0.353 . . . . 24.29 110.671 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -60.08 -44.99 94.38 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.082 -0.508 . . . . 24.74 110.457 179.475 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 43.2 ttp -57.46 -33.66 68.19 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.905 -0.588 . . . . 20.15 110.63 179.386 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 66.5 mt -65.82 -43.96 93.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.048 -0.524 . . . . 20.23 110.554 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 33.8 ttm180 -58.23 -40.66 82.28 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.924 -0.58 . . . . 25.57 111.048 179.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -56.45 -43.65 79.7 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.254 -0.43 . . . . 19.18 111.08 -179.892 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.605 ' HB3' ' HB3' ' A' ' 144' ' ' MET . . . -87.39 -14.25 41.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.148 -0.478 . . . . 16.88 111.28 -179.776 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . 0.421 ' HA ' ' OE1' ' A' ' 140' ' ' GLU . 27.5 t70 -93.61 99.23 11.71 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.015 0.436 . . . . 20.4 110.728 -179.739 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -89.74 -37.1 14.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.8 -0.636 . . . . 21.43 111.278 -179.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -63.7 -18.04 63.59 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.324 -0.398 . . . . 23.37 110.583 -179.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 60.74 83.45 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.977 -0.63 . . . . 24.32 112.831 179.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . 0.418 ' OD2' ' HB2' ' A' ' 135' ' ' MET . 12.6 p-10 -146.44 -5.62 0.56 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.791 0.329 . . . . 24.4 111.086 179.586 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 77.09 11.71 85.31 Favored Glycine 0 C--N 1.331 0.254 0 C-N-CA 120.866 -0.683 . . . . 23.47 112.699 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' MET . . . . . 0.418 ' HB2' ' OD2' ' A' ' 133' ' ' ASP . 88.9 mtp -133.38 154.27 50.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.646 0.26 . . . . 22.91 110.389 179.653 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.539 HG22 ' HB2' ' A' ' 140' ' ' GLU . 40.4 mm -115.3 144.89 21.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 121.254 0.55 . . . . 18.67 112.155 -179.246 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . 0.429 ' O ' ' N ' ' A' ' 139' ' ' GLU . 30.0 p-10 -114.81 157.86 22.68 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.304 -0.862 . . . . 16.97 108.779 178.058 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . 0.522 ' HH ' ' HB2' ' A' ' 86' ' ' ARG . 27.8 t80 -39.27 -25.19 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 112.377 0.51 . . . . 15.28 112.377 -179.152 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . 0.429 ' N ' ' O ' ' A' ' 137' ' ' ASN . 44.9 mt-10 -80.05 -55.92 4.61 Favored 'General case' 0 C--O 1.234 0.275 0 O-C-N 122.226 -0.296 . . . . 14.82 111.401 -179.563 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . 0.539 ' HB2' HG22 ' A' ' 136' ' ' ILE . 30.7 mt-10 -60.82 -27.33 67.97 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.986 0.422 . . . . 17.46 110.36 179.895 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.483 ' HA ' ' HE1' ' A' ' 144' ' ' MET . 91.6 t80 -69.33 -56.01 8.77 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.905 -0.588 . . . . 13.65 109.787 179.333 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . 0.444 HG13 ' HG3' ' A' ' 85' ' ' MET . 38.9 t -45.41 -40.84 2.84 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 CA-C-N 115.55 -0.75 . . . . 11.12 111.643 178.917 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 75.5 t90 -67.68 -55.61 12.58 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.744 0.646 . . . . 14.4 112.744 -178.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 144' ' ' MET . . . . . 0.605 ' HB3' ' HB3' ' A' ' 128' ' ' ALA . 19.9 ptt? -67.07 -20.25 65.79 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 113.257 0.836 . . . . 14.63 113.257 -177.433 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 145' ' ' ILE . . . . . 0.533 HG13 ' N ' ' A' ' 146' ' ' SER . 43.4 pt -80.52 -46.09 21.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 N-CA-C 112.236 0.458 . . . . 11.62 112.236 -179.121 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 146' ' ' SER . . . . . 0.533 ' N ' HG13 ' A' ' 145' ' ' ILE . 28.8 t -63.58 -13.93 46.55 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.193 0.521 . . . . 8.66 110.356 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -118.35 45.33 2.04 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.385 -0.825 . . . . 11.87 111.651 -178.245 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . 0.648 ' HB2' ' HZ3' ' A' ' 148' ' ' LYS . 10.4 mtmp? . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.242 -0.885 . . . . 13.97 110.919 179.51 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.9 mt . . . . . 0 CA--C 1.529 0.143 0 CA-C-O 120.618 0.247 . . . . 2.0 111.007 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 72.3 p -76.68 -177.45 4.27 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.456 -0.338 . . . . 1.72 111.294 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -60.25 -51.26 70.32 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.376 -0.375 . . . . 2.2 111.562 -179.512 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -67.74 -45.63 74.44 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.983 0.42 . . . . 1.35 111.018 -179.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -59.23 -42.41 90.95 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.812 -0.631 . . . . 2.34 111.245 -179.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . 0.523 ' HA ' ' CZ ' ' A' ' 12' ' ' PHE . 55.0 mt -60.62 -49.79 83.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.884 0.373 . . . . 1.27 110.652 179.744 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.2 -19.07 64.73 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.995 -0.548 . . . . 1.22 111.099 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -73.94 -55.83 5.69 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.259 -0.428 . . . . 2.27 111.767 -179.238 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.523 ' CZ ' ' HA ' ' A' ' 9' ' ' ILE . 4.2 p90 -77.53 -24.51 49.95 Favored 'General case' 0 C--N 1.332 -0.196 0 C-N-CA 120.673 -0.411 . . . . 0.46 111.012 -179.582 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 23.9 tptp -66.92 -41.44 87.05 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 109.397 -0.594 . . . . 1.85 109.397 178.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -65.26 -47.67 75.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.898 -0.592 . . . . 0.44 109.477 178.498 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.87 -30.65 70.27 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 115.643 -0.708 . . . . 1.08 110.415 179.127 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 24.9 t80 -66.95 -38.89 86.96 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.572 -0.74 . . . . 0.56 110.623 179.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -70.88 -28.39 33.5 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.774 0 CA-C-N 115.966 -0.561 . . . . 1.69 111.153 -179.724 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -60.54 -27.86 67.98 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.791 -0.641 . . . . 2.23 111.486 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 54.9 m-85 -94.01 -12.63 28.22 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.63 -0.259 . . . . 0.69 111.672 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -84.93 91.25 8.0 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.894 0.378 . . . . 0.46 110.732 179.621 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 71.8 mmtt -100.03 -26.03 14.11 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.965 -0.561 . . . . 2.55 111.243 -179.659 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -70.96 -20.14 62.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.168 -0.469 . . . . 1.8 111.281 -179.549 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 86.45 0.2 86.64 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.786 -0.721 . . . . 0.54 112.707 179.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 22.7 p -79.39 10.74 3.48 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.738 0.304 . . . . 1.1 111.212 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 55.54 30.01 54.97 Favored Glycine 0 C--N 1.331 0.293 0 C-N-CA 120.82 -0.705 . . . . 0.37 112.066 -179.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.45 ' C ' HE22 ' A' ' 62' ' ' GLN . 33.0 mtmm -138.33 155.85 48.18 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.744 0.307 . . . . 1.75 111.238 -179.466 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.539 HG13 ' HB2' ' A' ' 63' ' ' LEU . 33.8 pt -116.12 126.41 73.61 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 116.358 -0.383 . . . . 1.2 111.199 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -50.74 142.02 11.99 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.181 -0.463 . . . . 1.04 111.501 -179.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 9.8 t -67.44 -16.09 64.03 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.886 -0.597 . . . . 1.71 111.745 -179.542 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -89.46 5.08 46.95 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.473 -0.33 . . . . 3.53 110.679 179.728 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -123.18 -4.26 8.45 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.091 -0.504 . . . . 2.26 110.942 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.439 HD11 ' HE3' ' A' ' 36' ' ' MET . 1.6 tm? -58.81 -48.6 80.75 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.35 -0.386 . . . . 1.95 110.373 179.617 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -55.64 -35.77 63.18 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.533 -0.841 . . . . 0.32 111.306 179.341 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 88.5 m -69.74 -39.92 76.5 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.062 0.458 . . . . 1.01 110.21 179.272 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 56.1 tp -65.15 -24.07 67.3 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.731 -0.668 . . . . 1.85 110.322 179.439 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.482 ' HG3' ' HG3' ' A' ' 43' ' ' PRO . 21.5 mmt -75.46 -43.32 50.15 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.94 -0.573 . . . . 1.43 110.13 179.139 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -55.87 -50.14 71.43 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.645 -0.707 . . . . 3.27 111.102 179.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.443 HG21 ' HG ' ' A' ' 39' ' ' LEU . 10.1 t -61.68 -13.49 23.17 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.294 -0.412 . . . . 1.54 111.135 179.84 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.443 ' HG ' HG21 ' A' ' 38' ' ' THR . 75.0 mt -113.57 157.16 22.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.096 -0.502 . . . . 1.94 110.613 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -75.85 40.36 1.4 Allowed Glycine 0 CA--C 1.521 0.426 0 C-N-CA 120.883 -0.675 . . . . 0.69 114.027 -178.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 9.9 mp0 -97.15 -66.72 0.88 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 117.103 0.451 . . . . 1.97 111.109 179.029 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 59.0 m-20 60.82 67.21 1.55 Allowed Pre-proline 0 CA--C 1.53 0.199 0 CA-C-N 116.149 -0.478 . . . . 3.44 111.098 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . 0.514 ' HA ' HE22 ' A' ' 75' ' ' GLN . 60.1 Cg_endo -71.47 160.39 48.65 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.72 2.28 . . . . 0.59 112.124 179.655 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 33.4 m -74.5 146.76 42.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.153 -0.476 . . . . 1.28 110.604 179.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.423 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 41.9 tt0 -46.4 -50.34 16.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.61 -0.268 . . . . 2.7 111.137 -179.522 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -51.32 -53.07 39.66 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.274 -0.421 . . . . 1.15 111.315 -179.748 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.443 ' HG2' HD22 ' A' ' 51' ' ' LEU . 36.8 tt0 -52.08 -49.5 63.43 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.357 -0.383 . . . . 2.23 110.618 179.888 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 51.6 mt -57.87 -40.24 79.73 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.38 -0.373 . . . . 2.01 110.584 179.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.423 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 31.7 mm-40 -65.66 -32.74 74.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.411 -0.359 . . . . 1.68 111.026 179.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -75.13 -54.64 6.79 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.222 -0.444 . . . . 0.62 112.103 -179.349 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.443 HD22 ' HG2' ' A' ' 47' ' ' GLU . 2.2 pp -66.33 -39.71 89.42 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 111.995 0.368 . . . . 1.11 111.995 -178.871 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 86.1 mt -68.48 -43.31 83.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 C-N-CA 121.147 -0.221 . . . . 1.25 111.054 -179.647 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.86 -38.86 89.95 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.809 0.338 . . . . 1.24 110.811 179.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -64.02 -43.54 95.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.13 -0.486 . . . . 2.54 110.309 179.607 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -77.19 -16.36 59.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.983 -0.553 . . . . 1.19 110.996 179.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -65.74 -23.9 66.84 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.148 -0.478 . . . . 1.95 110.799 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -103.92 29.61 5.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.035 -0.53 . . . . 3.19 110.621 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -158.51 150.26 21.23 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.007 -0.542 . . . . 2.69 110.754 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 74.4 m-20 59.76 15.1 4.54 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.042 -0.526 . . . . 2.05 111.021 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 18.3 m-80 60.71 12.9 3.96 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.905 -0.589 . . . . 1.67 111.917 179.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 113.62 30.47 2.6 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.636 -0.792 . . . . 0.86 112.389 179.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.45 HE22 ' C ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -127.32 154.52 44.84 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.095 0.474 . . . . 0.49 111.3 -179.832 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.539 ' HB2' HG13 ' A' ' 27' ' ' ILE . 17.4 mt -121.08 152.42 38.68 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.608 -0.724 . . . . 2.05 109.753 179.366 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -113.07 156.76 22.55 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 110.19 -0.3 . . . . 1.52 110.19 -179.483 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.513 ' O ' ' HB2' ' A' ' 69' ' ' CYS . 82.8 t80 -42.41 -41.56 2.93 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.483 -0.326 . . . . 0.46 110.959 179.889 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 3.8 m -71.45 -33.85 69.73 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.352 -0.386 . . . . 1.41 111.397 -179.766 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -62.51 -51.28 68.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.871 0.367 . . . . 1.36 110.287 179.393 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.423 ' HE2' ' HB2' ' A' ' 12' ' ' PHE . 32.8 t80 -67.65 -47.43 69.56 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.021 -0.536 . . . . 0.61 110.649 179.534 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.513 ' HB2' ' O ' ' A' ' 65' ' ' PHE . 0.1 OUTLIER -57.27 -38.9 74.62 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-O 120.959 0.409 . . . . 1.41 110.059 179.599 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -57.51 -50.95 60.87 Favored Glycine 0 CA--C 1.507 -0.466 0 N-CA-C 111.119 -0.792 . . . . 0.41 111.119 179.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.58 HG23 ' HE2' ' A' ' 74' ' ' LYS . 70.6 mt -59.5 -50.12 81.09 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.656 0 CA-C-O 121.032 0.444 . . . . 1.13 110.365 178.466 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 15.2 mtp -49.68 -28.94 6.58 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.613 -0.721 . . . . 1.24 110.51 179.524 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -71.87 -45.28 61.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.328 -0.396 . . . . 1.17 110.231 179.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.58 ' HE2' HG23 ' A' ' 71' ' ' ILE . 49.0 pttt -70.56 -28.87 65.23 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.125 -0.489 . . . . 1.91 111.041 179.823 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . 0.514 HE22 ' HA ' ' A' ' 43' ' ' PRO . 4.8 tp-100 -80.58 -55.42 4.87 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.001 -0.545 . . . . 2.03 111.623 -179.784 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 68.3 mtp . . . . . 0 N--CA 1.449 -0.496 0 CA-C-N 116.169 -0.469 . . . . 1.52 111.793 -179.275 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.619 ' O ' ' HG2' ' A' ' 85' ' ' MET . 58.8 m . . . . . 0 CA--C 1.529 0.137 0 N-CA-C 109.925 -0.398 . . . . 7.48 109.925 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -58.12 -16.03 11.72 Favored 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 113.39 0.885 . . . . 9.74 113.39 -178.169 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -64.26 -56.5 14.17 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.001 0.429 . . . . 12.11 111.683 -179.286 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -68.19 -14.08 62.71 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.045 -0.525 . . . . 10.87 110.919 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' MET . . . . . 0.619 ' HG2' ' O ' ' A' ' 81' ' ' THR . 4.5 mmm -80.35 -38.77 29.83 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.119 -0.491 . . . . 11.09 110.42 -179.441 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 10.4 ttm180 -67.73 -42.55 81.72 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.975 -0.557 . . . . 16.05 109.595 179.303 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.481 ' O ' HG12 ' A' ' 91' ' ' ILE . 36.9 tt0 -59.55 -48.77 80.34 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.879 -0.6 . . . . 14.85 109.811 179.011 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.56 -29.87 70.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.938 -0.574 . . . . 14.11 110.778 179.583 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 46.7 t80 -59.28 -52.04 67.37 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 109.846 -0.427 . . . . 16.42 109.846 179.492 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -59.06 -37.77 77.82 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.797 -0.638 . . . . 17.66 110.021 178.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.481 HG12 ' O ' ' A' ' 87' ' ' GLU . 40.0 mm -59.92 -40.98 84.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.431 -0.804 . . . . 18.15 110.83 179.469 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.517 ' O ' ' HD3' ' A' ' 94' ' ' ARG . 7.0 m-85 -74.06 -56.64 4.68 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.311 -0.404 . . . . 18.34 111.332 -179.636 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . 0.481 ' HA ' ' CZ ' ' A' ' 94' ' ' ARG . 43.2 t0 -49.96 124.97 10.97 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 120.947 0.403 . . . . 19.29 110.566 -179.739 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.65 ' CZ ' ' HB3' ' A' ' 104' ' ' GLU . 0.0 OUTLIER -76.78 -31.97 57.38 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.904 -0.589 . . . . 22.47 111.662 -178.694 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -113.76 177.97 4.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.978 0.418 . . . . 23.34 111.368 -179.036 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -88.38 3.9 85.32 Favored Glycine 0 N--CA 1.449 -0.472 0 N-CA-C 110.919 -0.872 . . . . 22.77 110.919 178.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 22.3 p-10 -56.02 -39.18 71.55 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.227 -0.487 . . . . 23.0 111.167 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 89.48 21.57 40.3 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.846 -0.693 . . . . 20.02 111.922 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . 0.49 ' HA ' ' O ' ' A' ' 136' ' ' ILE . 97.5 m-85 -136.93 143.83 43.12 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.858 0.361 . . . . 20.56 111.328 -179.709 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.519 ' HB ' ' HB ' ' A' ' 136' ' ' ILE . 59.6 mt -114.35 132.3 63.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-N 115.904 -0.589 . . . . 19.37 110.832 179.629 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 26.7 p -114.42 156.18 44.86 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.037 -0.529 . . . . 22.65 110.693 -179.705 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_exo -42.78 -48.71 7.18 Favored 'Trans proline' 0 C--N 1.348 0.538 0 C-N-CA 122.686 2.257 . . . . 23.78 112.965 -179.78 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.81 -51.29 68.86 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.093 0.473 . . . . 25.0 111.068 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . 0.65 ' HB3' ' CZ ' ' A' ' 94' ' ' ARG . 38.6 mt-10 -59.15 -41.34 88.1 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.716 -0.674 . . . . 22.31 111.04 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.56 HD22 ' HB ' ' A' ' 121' ' ' ILE . 47.7 tp -54.38 -46.72 73.13 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.67 -0.695 . . . . 20.62 111.037 -179.476 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 5.4 ttt180 -60.47 -48.16 82.98 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.104 -0.498 . . . . 27.9 110.854 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 72.5 t80 -52.19 -35.02 47.92 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.223 -0.444 . . . . 25.96 111.513 -179.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.611 HG22 HH11 ' A' ' 94' ' ' ARG . 30.2 t -77.18 -54.12 13.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 N-CA-C 111.748 0.277 . . . . 21.06 111.748 -179.611 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -49.54 -39.63 35.27 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.834 0.349 . . . . 20.93 110.955 -179.715 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 84.7 mt -66.84 -28.68 43.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.17 -0.468 . . . . 25.52 110.936 179.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 89.1 m-20 -72.84 -46.18 54.37 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.235 -0.439 . . . . 23.32 110.336 179.639 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 9.6 mp -60.32 -45.11 94.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.626 -0.715 . . . . 21.07 110.976 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 128.95 11.81 2.79 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.8 -0.714 . . . . 23.25 112.474 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -106.51 94.64 5.24 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.789 0.328 . . . . 22.59 111.07 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -60.99 126.2 26.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.159 -0.473 . . . . 28.21 110.704 179.588 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 3.0 m -144.41 150.71 16.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.231 -0.44 . . . . 24.75 111.444 -179.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 68.3 p -94.5 149.36 21.32 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.826 -0.625 . . . . 27.5 110.218 179.231 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -54.78 -17.24 3.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.155 -0.475 . . . . 27.03 111.601 -179.597 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -77.8 -55.18 5.54 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.479 -0.328 . . . . 29.14 111.511 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -63.36 -38.84 92.71 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 111.996 0.369 . . . . 24.7 111.996 -179.151 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.56 ' HB ' HD22 ' A' ' 105' ' ' LEU . 42.0 pt -71.68 -41.61 71.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 N-CA-C 111.787 0.292 . . . . 22.9 111.787 -179.408 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . 0.492 ' N ' HG13 ' A' ' 121' ' ' ILE . 19.7 t70 -59.89 -39.76 86.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.741 0.305 . . . . 24.29 110.702 179.873 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -65.06 -43.9 90.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.11 -0.496 . . . . 24.74 110.605 179.682 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 52.6 ttp -56.76 -37.78 71.54 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.114 -0.494 . . . . 20.15 110.585 179.459 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.495 HG22 HD13 ' A' ' 136' ' ' ILE . 72.3 mt -65.85 -43.23 93.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.99 -0.55 . . . . 20.23 110.448 179.595 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 75.0 ttt180 -60.82 -30.66 70.22 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.701 -0.682 . . . . 25.57 111.115 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -75.88 -27.62 57.81 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.132 -0.485 . . . . 19.18 111.362 -179.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.539 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -101.06 -8.73 22.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.355 -0.384 . . . . 16.88 111.181 -179.805 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 30.2 t0 -100.7 87.48 3.35 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.179 -0.464 . . . . 20.4 110.825 -179.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 71.7 m-85 -67.4 -49.81 62.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.895 -0.593 . . . . 21.43 111.147 -179.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -57.39 -29.12 63.81 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.239 -0.437 . . . . 23.37 110.776 179.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 67.17 63.62 3.7 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.973 -0.632 . . . . 24.32 112.909 179.419 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -122.95 7.26 9.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.851 0.358 . . . . 24.4 110.586 179.533 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 69.07 18.83 73.27 Favored Glycine 0 C--N 1.33 0.246 0 C-N-CA 120.99 -0.624 . . . . 23.47 112.629 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 85.6 mmm -134.57 153.66 51.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.701 0.286 . . . . 22.91 110.545 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.519 ' HB ' ' HB ' ' A' ' 100' ' ' ILE . 43.4 mm -114.79 141.81 29.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 121.091 0.472 . . . . 18.67 111.563 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . 0.495 ' ND2' ' H ' ' A' ' 138' ' ' TYR . 3.5 t-20 -114.89 156.42 25.02 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.258 -0.883 . . . . 16.97 108.801 178.345 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . 0.495 ' H ' ' ND2' ' A' ' 137' ' ' ASN . 6.8 t80 -40.08 -24.8 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 120.706 0.288 . . . . 15.28 111.487 179.698 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . 0.435 ' N ' ' O ' ' A' ' 137' ' ' ASN . 14.3 mm-40 -80.28 -55.78 4.67 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.876 0.37 . . . . 14.82 111.01 -179.353 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . 0.51 ' HB2' HG21 ' A' ' 136' ' ' ILE . 35.5 mt-10 -57.74 -31.17 66.19 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.005 -0.543 . . . . 17.46 110.401 179.742 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.551 ' HA ' ' HE2' ' A' ' 144' ' ' MET . 90.0 t80 -69.58 -56.04 8.44 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.599 -0.728 . . . . 13.65 110.708 -179.922 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . 0.553 ' HA ' HD13 ' A' ' 145' ' ' ILE . 52.0 t -46.58 -38.22 3.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.002 -0.545 . . . . 11.12 111.958 179.626 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 143' ' ' TRP . . . . . 0.418 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 91.0 t90 -71.08 -55.87 7.32 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.469 0.544 . . . . 14.4 112.469 -178.809 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 144' ' ' MET . . . . . 0.551 ' HE2' ' HA ' ' A' ' 141' ' ' PHE . 18.4 ptt? -62.47 -25.0 67.76 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 112.971 0.73 . . . . 14.63 112.971 -177.75 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 145' ' ' ILE . . . . . 0.553 HD13 ' HA ' ' A' ' 142' ' ' VAL . 45.1 pt -80.93 -40.47 18.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 N-CA-C 112.168 0.433 . . . . 11.62 112.168 -179.83 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 146' ' ' SER . . . . . 0.522 ' N ' HG13 ' A' ' 145' ' ' ILE . 88.1 p -61.31 -14.82 29.72 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-O 121.494 0.664 . . . . 8.66 109.557 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 147' ' ' GLN . . . . . 0.418 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 2.7 mm-40 -113.6 -11.51 12.99 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 114.899 -1.046 . . . . 11.87 109.897 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . 0.537 ' HB2' ' HA ' ' A' ' 145' ' ' ILE . 28.0 ttpp . . . . . 0 C--O 1.25 1.085 0 CA-C-O 118.247 -0.882 . . . . 13.97 110.92 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.582 HD12 ' SG ' ' A' ' 69' ' ' CYS . 33.2 mt . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.827 0.346 . . . . 2.0 110.614 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 56.5 p -70.99 -165.4 0.12 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.132 -0.486 . . . . 1.72 111.194 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -75.48 -42.79 52.16 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.995 0.426 . . . . 2.2 110.472 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -73.06 -35.13 66.63 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.834 -0.621 . . . . 1.35 110.536 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -70.85 -47.21 60.59 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.922 -0.581 . . . . 2.34 110.817 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . 0.501 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 35.4 mt -58.46 -41.26 81.18 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 116.271 -0.422 . . . . 1.27 110.912 179.828 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -76.06 -22.05 56.08 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.438 -0.347 . . . . 1.22 111.043 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -68.47 -57.1 6.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.199 -0.455 . . . . 2.27 111.736 -179.425 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.501 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 11.5 p90 -76.76 -25.29 53.27 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.678 -0.409 . . . . 0.46 110.489 -179.721 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.9 tptm -63.33 -34.01 76.77 Favored 'General case' 0 CA--C 1.519 -0.242 0 N-CA-C 108.87 -0.789 . . . . 1.85 108.87 178.227 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.533 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 14.0 t70 -69.74 -53.02 20.39 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 109.013 -0.736 . . . . 0.44 109.013 178.418 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.05 -15.23 21.26 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.821 -0.627 . . . . 1.08 110.508 178.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 66.1 t80 -80.69 -44.76 18.24 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.746 -0.661 . . . . 0.56 111.001 -179.729 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.433 HG23 ' O ' ' A' ' 14' ' ' ASP . 25.7 m -69.33 -21.14 24.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.983 0.42 . . . . 1.69 110.675 -179.664 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.533 ' HG3' ' O ' ' A' ' 14' ' ' ASP . 83.8 mt-30 -63.69 -25.29 68.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.83 -0.623 . . . . 2.23 111.3 179.814 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -104.9 25.06 10.93 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.57 -0.286 . . . . 0.69 111.617 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -116.74 80.64 1.5 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.059 0.457 . . . . 0.46 110.723 179.336 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt -93.83 5.14 52.63 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.85 -0.614 . . . . 2.55 111.176 -179.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -103.89 -1.26 27.99 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.316 -0.402 . . . . 1.8 111.35 -179.371 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 63.48 10.39 36.03 Favored Glycine 0 CA--C 1.517 0.201 0 C-N-CA 120.921 -0.657 . . . . 0.54 113.144 179.578 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 30.4 p -90.15 10.85 22.84 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.699 0.285 . . . . 1.1 111.122 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 56.26 18.13 20.12 Favored Glycine 0 C--N 1.332 0.306 0 C-N-CA 120.766 -0.73 . . . . 0.37 111.912 -179.653 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.502 ' C ' HE22 ' A' ' 62' ' ' GLN . 32.1 mtpt -129.58 155.95 44.97 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.594 -0.303 . . . . 1.75 110.819 -179.339 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.443 ' N ' HE22 ' A' ' 62' ' ' GLN . 35.7 pt -120.87 129.96 75.13 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 120.934 0.397 . . . . 1.2 111.359 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.406 ' C ' ' H ' ' A' ' 30' ' ' ARG . . . -47.78 137.46 9.6 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.144 -0.48 . . . . 1.04 111.336 179.84 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.463 HG23 ' HA ' ' A' ' 56' ' ' GLU . 5.5 t -67.31 -0.27 3.41 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.926 -0.579 . . . . 1.71 110.873 179.804 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.442 ' HD2' HG21 ' A' ' 29' ' ' THR . 3.6 mmm180 -94.28 -17.8 22.27 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.98 -0.554 . . . . 3.53 110.28 179.839 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -102.07 -3.0 28.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.56 -0.745 . . . . 2.26 110.503 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -58.08 -50.66 72.68 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.009 -0.542 . . . . 1.95 110.311 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -54.34 -38.56 62.5 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.49 -0.862 . . . . 0.32 111.524 179.301 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 92.8 m -65.95 -34.53 78.33 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.006 0.432 . . . . 1.01 110.429 179.145 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 48.3 tp -68.3 -36.68 79.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.789 -0.641 . . . . 1.85 110.909 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.436 ' HG3' ' HG3' ' A' ' 43' ' ' PRO . 40.0 mmm -65.46 -40.19 92.91 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.88 -0.415 . . . . 1.43 109.88 179.549 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 74.9 mtp180 -67.9 -30.39 69.71 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.266 -0.642 . . . . 3.27 109.266 178.705 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 96.2 m -65.97 -21.29 66.41 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 115.286 -0.87 . . . . 1.54 110.415 179.245 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.414 ' C ' ' H ' ' A' ' 41' ' ' GLN . 10.3 mp -114.49 156.96 23.62 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.493 -0.776 . . . . 1.94 110.413 179.757 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -53.16 -8.12 0.64 Allowed Glycine 0 CA--C 1.52 0.402 0 C-N-CA 121.109 -0.567 . . . . 0.69 113.339 -179.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.414 ' H ' ' C ' ' A' ' 39' ' ' LEU . 82.9 mm-40 -60.43 176.14 0.38 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.089 0.471 . . . . 1.97 111.343 179.752 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 16.8 p-10 -169.81 72.27 0.66 Allowed Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 115.782 -0.645 . . . . 3.44 110.85 179.8 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . 0.436 ' HG3' ' HG3' ' A' ' 36' ' ' MET . 56.9 Cg_endo -68.84 142.29 51.68 Favored 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.595 2.196 . . . . 0.59 112.316 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 26.9 m -64.22 148.46 50.05 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.243 -0.435 . . . . 1.28 110.168 179.346 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.469 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 6.7 tp10 -48.15 -55.69 9.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.595 0.236 . . . . 2.7 110.999 -179.356 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -51.13 -52.13 46.9 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.144 -0.48 . . . . 1.15 111.42 -179.837 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -50.01 -50.45 47.29 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.375 -0.375 . . . . 2.23 110.702 179.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 12.8 mt -57.07 -45.48 83.26 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.229 -0.441 . . . . 2.01 110.676 179.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.469 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 30.4 mm-40 -60.73 -32.31 71.59 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.811 0.339 . . . . 1.68 110.911 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -73.71 -55.52 6.16 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.204 -0.453 . . . . 0.62 112.185 -179.086 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.8 pp -66.59 -36.72 83.3 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 111.613 0.227 . . . . 1.11 111.613 -179.13 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 78.9 mt -64.81 -43.25 96.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.702 0.287 . . . . 1.25 110.483 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.54 -28.84 68.14 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.2 -0.454 . . . . 1.24 110.372 179.328 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -66.05 -51.36 58.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.93 -0.577 . . . . 2.54 110.228 179.452 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -78.51 -14.72 59.22 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.055 -0.52 . . . . 1.19 111.429 179.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.463 ' HA ' HG23 ' A' ' 29' ' ' THR . 40.7 tt0 -59.97 -44.09 94.68 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.504 -0.316 . . . . 1.95 111.051 -179.807 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -122.45 57.64 1.08 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.306 -0.406 . . . . 3.19 110.984 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -149.26 -30.53 0.24 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.157 -0.474 . . . . 2.69 110.782 179.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 27.7 m-80 -128.7 25.69 5.65 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.139 -0.482 . . . . 2.05 110.784 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . 0.558 ' N ' HD21 ' A' ' 60' ' ' ASN . 0.8 OUTLIER 62.69 11.37 4.8 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.96 -0.564 . . . . 1.67 111.667 179.846 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 104.18 37.95 2.78 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.687 -0.768 . . . . 0.86 112.647 179.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.502 HE22 ' C ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -140.56 154.31 46.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.139 0.495 . . . . 0.49 111.438 179.921 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 81.3 mt -122.02 147.76 45.67 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.742 -0.663 . . . . 2.05 110.146 179.607 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -112.9 156.76 22.4 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.61 -0.268 . . . . 1.52 110.507 -179.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.415 ' O ' ' HB2' ' A' ' 69' ' ' CYS . 78.3 t80 -43.69 -42.6 5.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.206 -0.452 . . . . 0.46 111.287 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' THR . . . . . 0.411 ' H ' ' HG1' ' A' ' 66' ' ' THR . 0.2 OUTLIER -69.27 -34.11 74.27 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 111.874 0.324 . . . . 1.41 111.874 -179.713 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -63.09 -54.02 44.56 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.097 0.475 . . . . 1.36 110.239 179.501 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.472 ' HE2' ' HB2' ' A' ' 12' ' ' PHE . 28.7 t80 -64.14 -45.01 90.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.752 -0.658 . . . . 0.61 110.752 179.676 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.582 ' SG ' HD12 ' A' ' 4' ' ' LEU . 3.9 t -58.15 -44.19 87.74 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.079 -0.509 . . . . 1.41 110.156 179.62 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -53.26 -48.16 60.02 Favored Glycine 0 N--CA 1.45 -0.432 0 CA-C-N 115.622 -0.717 . . . . 0.41 111.674 179.536 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.464 ' HA ' ' HG2' ' A' ' 74' ' ' LYS . 14.4 mt -62.75 -44.7 99.7 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.363 0 CA-C-O 121.091 0.472 . . . . 1.13 110.426 179.257 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -53.33 -27.12 21.66 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.555 -0.748 . . . . 1.24 110.035 179.472 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -74.48 -47.29 34.13 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.907 -0.588 . . . . 1.17 111.034 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.464 ' HG2' ' HA ' ' A' ' 71' ' ' ILE . 63.1 pttt -68.74 -27.5 65.98 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 116.551 -0.295 . . . . 1.91 111.247 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 22.3 mt-30 -81.24 -50.41 9.59 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.796 0.332 . . . . 2.03 111.497 179.061 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 33.1 mtt . . . . . 0 N--CA 1.454 -0.265 0 N-CA-C 112.373 0.509 . . . . 1.52 112.373 -178.963 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.502 ' O ' ' HG2' ' A' ' 85' ' ' MET . 13.0 t . . . . . 0 N--CA 1.458 -0.046 0 CA-C-O 120.751 0.31 . . . . 7.48 111.163 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -75.61 -14.4 60.37 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.21 -0.45 . . . . 9.74 111.495 -179.273 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -60.78 -55.29 34.92 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.384 -0.371 . . . . 12.11 111.614 -179.716 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -65.74 -20.52 66.3 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.303 -0.408 . . . . 10.87 111.23 -179.503 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' MET . . . . . 0.51 ' HB3' HD13 ' A' ' 145' ' ' ILE . 1.5 mmm -80.46 -36.01 34.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.991 0.424 . . . . 11.09 110.78 -179.353 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 29.4 ttt180 -67.96 -42.44 80.88 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.821 -0.627 . . . . 16.05 110.487 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -68.06 -37.93 81.86 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.078 -0.51 . . . . 14.85 110.002 179.161 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.16 -31.15 67.33 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.972 -0.558 . . . . 14.11 110.854 179.499 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -67.71 -40.45 84.27 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.118 -0.492 . . . . 16.42 110.456 179.766 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -66.5 -39.91 88.97 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.914 -0.585 . . . . 17.66 110.559 179.493 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 96.9 mt -64.47 -47.93 87.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.845 -0.616 . . . . 18.15 110.795 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.44 ' O ' ' CZ ' ' A' ' 94' ' ' ARG . 4.4 m-85 -63.85 -57.14 10.77 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.114 -0.494 . . . . 18.34 110.695 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . 0.59 ' HA ' HH21 ' A' ' 94' ' ' ARG . 27.4 t0 -53.51 127.3 24.67 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 120.787 0.327 . . . . 19.29 110.228 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.719 ' H ' ' HE ' ' A' ' 94' ' ' ARG . 0.0 OUTLIER -98.19 -24.18 15.38 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.28 -0.418 . . . . 22.47 111.788 -178.665 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -101.84 -179.93 4.15 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.969 0.414 . . . . 23.34 111.026 -179.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.26 3.3 56.67 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.886 -0.673 . . . . 22.77 112.024 179.628 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -71.63 -36.14 70.66 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.869 0.366 . . . . 23.0 111.24 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 90.38 27.15 21.31 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.737 -0.744 . . . . 20.02 112.494 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . 0.41 ' HA ' ' O ' ' A' ' 136' ' ' ILE . 86.3 m-85 -132.32 142.81 49.49 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.569 0.223 . . . . 20.56 110.764 179.839 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.552 ' HB ' ' HB ' ' A' ' 136' ' ' ILE . 41.5 mt -114.47 126.28 71.97 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-O 120.923 0.392 . . . . 19.37 111.268 179.893 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 26.8 p -116.05 156.12 47.19 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 115.94 -0.573 . . . . 22.65 110.555 179.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_exo -41.63 -36.33 3.1 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 122.448 2.099 . . . . 23.78 112.464 -179.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.89 -49.98 68.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.08 0.467 . . . . 25.0 110.591 179.554 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . 0.568 ' HB3' ' CZ ' ' A' ' 94' ' ' ARG . 38.1 mt-10 -63.24 -50.25 70.94 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.935 -0.575 . . . . 22.31 110.677 179.337 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.486 HD22 ' HB ' ' A' ' 121' ' ' ILE . 48.0 tp -51.55 -35.43 40.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.642 -0.708 . . . . 20.62 111.799 -179.081 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.461 ' HG3' ' N ' ' A' ' 107' ' ' PHE . 0.1 OUTLIER -76.28 -32.15 58.65 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.91 0.386 . . . . 27.9 110.551 -179.677 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . 0.461 ' N ' ' HG3' ' A' ' 106' ' ' ARG . 85.5 t80 -72.62 -34.75 67.57 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.901 -0.591 . . . . 25.96 111.732 -179.883 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.411 HG21 ' HA ' ' A' ' 92' ' ' PHE . 7.3 p -77.86 -47.0 26.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 N-CA-C 112.011 0.374 . . . . 21.06 112.011 -179.203 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -51.6 -36.99 47.89 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.724 0.297 . . . . 20.93 111.533 -179.321 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.441 HG13 ' O ' ' A' ' 106' ' ' ARG . 75.7 mt -69.47 -26.8 32.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.349 -0.387 . . . . 25.52 111.082 -179.827 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -73.29 -41.14 63.94 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.195 -0.457 . . . . 23.32 110.619 179.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 9.2 mp -63.5 -44.37 94.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.914 -0.585 . . . . 21.07 110.945 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 133.6 1.88 3.72 Favored Glycine 0 C--N 1.331 0.286 0 C-N-CA 120.688 -0.768 . . . . 23.25 112.753 179.562 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -103.16 115.38 30.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.784 0.326 . . . . 22.59 111.291 -179.637 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -76.09 128.52 35.15 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.196 -0.456 . . . . 28.21 110.256 179.434 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . 0.453 ' HB ' HG23 ' A' ' 121' ' ' ILE . 3.1 m -142.36 155.6 18.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 121.18 0.514 . . . . 24.75 111.802 -179.474 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' THR . . . . . 0.436 ' O ' HG12 ' A' ' 121' ' ' ILE . 43.0 p -103.44 147.49 27.07 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.472 -0.785 . . . . 27.5 110.208 179.646 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -51.95 -19.69 1.94 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.241 -0.436 . . . . 27.03 111.519 -179.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -77.9 -54.92 5.76 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.523 -0.308 . . . . 29.14 111.704 -179.535 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -63.17 -39.57 95.03 Favored 'General case' 0 C--N 1.332 -0.196 0 N-CA-C 112.034 0.383 . . . . 24.7 112.034 -179.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.518 HG13 ' N ' ' A' ' 122' ' ' ASP . 15.2 pt -71.63 -40.28 70.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 C-N-CA 121.022 -0.271 . . . . 22.9 111.63 -179.485 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . 0.518 ' N ' HG13 ' A' ' 121' ' ' ILE . 15.4 t70 -57.79 -43.13 85.43 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.741 0.305 . . . . 24.29 110.538 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -63.0 -43.7 98.07 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.07 -0.514 . . . . 24.74 110.171 179.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 56.0 ttp -57.15 -33.89 67.87 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.002 -0.545 . . . . 20.15 110.362 179.148 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.51 HG22 HD13 ' A' ' 136' ' ' ILE . 97.3 mt -67.36 -43.72 87.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.815 -0.629 . . . . 20.23 110.533 179.638 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 32.3 ttm180 -60.3 -32.6 71.37 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.937 -0.574 . . . . 25.57 110.801 179.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -63.67 -29.73 70.93 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.13 -0.487 . . . . 19.18 111.278 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.67 ' HB1' ' HB3' ' A' ' 144' ' ' MET . . . -104.28 -15.37 15.49 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.3 -0.409 . . . . 16.88 111.329 -179.86 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -93.98 103.53 15.61 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.108 -0.496 . . . . 20.4 110.771 -179.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -96.52 -31.09 12.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.883 -0.599 . . . . 21.43 111.32 -179.427 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -70.69 -15.85 62.75 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.389 -0.369 . . . . 23.37 110.74 179.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 58.88 85.29 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 121.024 -0.607 . . . . 24.32 112.946 179.557 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -152.21 1.98 0.34 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.684 0.278 . . . . 24.4 111.073 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 69.28 20.85 75.5 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.81 -0.709 . . . . 23.47 112.753 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 82.1 mmm -135.12 155.04 51.4 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.591 0.234 . . . . 22.91 110.523 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.552 ' HB ' ' HB ' ' A' ' 100' ' ' ILE . 46.4 mm -116.79 143.81 26.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 121.093 0.473 . . . . 18.67 111.491 179.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . 0.418 ' N ' HG23 ' A' ' 136' ' ' ILE . 30.2 m-20 -114.41 156.67 24.07 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.267 -0.878 . . . . 16.97 108.711 178.465 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 16.9 t80 -42.65 -23.47 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.673 0.273 . . . . 15.28 111.151 179.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . 0.404 ' N ' ' C ' ' A' ' 137' ' ' ASN . 12.0 mm-40 -80.52 -56.03 4.46 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 120.904 0.383 . . . . 14.82 110.831 -179.799 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . 0.516 ' HB2' HG21 ' A' ' 136' ' ' ILE . 29.6 mt-10 -57.96 -27.26 63.26 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.139 -0.482 . . . . 17.46 110.121 179.616 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.471 ' HA ' ' HE2' ' A' ' 144' ' ' MET . 90.3 t80 -70.4 -55.71 8.41 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.746 -0.661 . . . . 13.65 110.035 179.435 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . 0.443 HG12 ' HG3' ' A' ' 85' ' ' MET . 55.1 t -46.03 -36.91 2.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 115.781 -0.645 . . . . 11.12 111.507 178.964 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 79.5 t90 -71.81 -55.5 7.47 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 112.563 0.579 . . . . 14.4 112.563 -178.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 144' ' ' MET . . . . . 0.67 ' HB3' ' HB1' ' A' ' 128' ' ' ALA . 20.8 ptt? -64.28 -22.63 67.02 Favored 'General case' 0 N--CA 1.463 0.203 0 N-CA-C 112.921 0.711 . . . . 14.63 112.921 -177.637 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 145' ' ' ILE . . . . . 0.656 ' HA ' ' HB2' ' A' ' 148' ' ' LYS . 28.3 pt -80.55 -42.58 21.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 C-N-CA 120.702 -0.399 . . . . 11.62 111.416 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 146' ' ' SER . . . . . 0.446 ' N ' HG13 ' A' ' 145' ' ' ILE . 82.3 p -65.04 -14.15 59.7 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.519 0.676 . . . . 8.66 109.421 179.235 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 -125.94 19.5 7.76 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 114.839 -1.073 . . . . 11.87 110.066 -179.589 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . 0.656 ' HB2' ' HA ' ' A' ' 145' ' ' ILE . 24.1 ttpp . . . . . 0 C--O 1.25 1.107 0 CA-C-O 118.296 -0.859 . . . . 13.97 110.898 -179.618 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.441 HD12 ' SG ' ' A' ' 69' ' ' CYS . 51.3 mt . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.77 0.319 . . . . 2.0 111.105 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -98.07 165.16 12.03 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.205 -0.452 . . . . 1.72 110.838 179.822 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -51.59 -39.05 57.21 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.797 0.332 . . . . 2.2 111.51 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.43 ' HG3' ' N ' ' A' ' 8' ' ' GLN . 11.6 pt-20 -72.08 -46.7 55.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.278 -0.419 . . . . 1.35 111.075 -179.406 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . 0.43 ' N ' ' HG3' ' A' ' 7' ' ' GLU . 96.7 mt-30 -61.04 -42.55 98.69 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.885 -0.598 . . . . 2.34 110.945 -179.812 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . 0.465 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 77.1 mt -59.29 -51.94 66.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.951 -0.568 . . . . 1.27 110.893 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.0 -26.8 67.86 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.12 -0.491 . . . . 1.22 111.654 -179.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -69.45 -56.72 6.61 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 112.155 0.428 . . . . 2.27 112.155 -178.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.465 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 8.5 p90 -77.89 -25.03 48.29 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 120.466 -0.494 . . . . 0.46 110.908 -179.544 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.446 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 41.6 tptt -64.45 -34.12 77.47 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 108.969 -0.752 . . . . 1.85 108.969 178.707 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -70.12 -48.95 55.35 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 108.697 -0.853 . . . . 0.44 108.697 177.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.84 -14.06 41.26 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.268 -0.878 . . . . 1.08 110.355 178.697 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.446 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 31.2 t80 -80.04 -54.04 6.16 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.809 -0.632 . . . . 0.56 111.0 -179.501 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 15.6 m -62.25 -22.73 30.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 121.105 0.479 . . . . 1.69 110.334 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 75.6 mm-40 -61.09 -32.41 72.07 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.624 -0.716 . . . . 2.23 111.543 179.597 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 99.7 m-85 -101.97 33.89 2.88 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.741 0.305 . . . . 0.69 111.631 -179.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -125.64 75.5 1.49 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.042 0.449 . . . . 0.46 110.425 179.32 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 41.1 tptt -87.01 -33.85 19.43 Favored 'General case' 0 N--CA 1.436 -1.129 0 CA-C-N 115.824 -0.625 . . . . 2.55 110.925 -179.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -63.24 -15.68 57.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.102 -0.499 . . . . 1.8 111.384 -179.52 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.48 10.7 84.6 Favored Glycine 0 C--N 1.331 0.264 0 C-N-CA 120.832 -0.699 . . . . 0.54 112.833 179.553 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 20.3 p -86.9 15.35 5.98 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.637 0.256 . . . . 1.1 111.213 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 53.35 26.39 29.57 Favored Glycine 0 C--N 1.333 0.388 0 C-N-CA 120.851 -0.69 . . . . 0.37 112.234 -179.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.441 ' C ' HE22 ' A' ' 62' ' ' GLN . 31.5 mtmm -135.0 156.57 48.82 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.822 0.344 . . . . 1.75 111.054 -179.646 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.591 HG13 ' HB2' ' A' ' 63' ' ' LEU . 23.8 pt -114.11 126.02 71.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 121.115 0.483 . . . . 1.2 111.468 -179.649 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -54.49 138.17 41.07 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.861 -0.609 . . . . 1.04 111.213 179.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 9.4 t -68.31 -9.44 47.75 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.061 -0.518 . . . . 1.71 111.382 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.431 ' HD3' ' N ' ' A' ' 30' ' ' ARG . 0.0 OUTLIER -87.13 -14.14 42.15 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.256 -0.429 . . . . 3.53 110.681 179.902 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -108.19 -0.28 21.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.093 -0.503 . . . . 2.26 110.632 179.768 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -60.08 -46.08 90.77 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.072 -0.513 . . . . 1.95 109.972 179.665 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.477 ' HA2' HD12 ' A' ' 48' ' ' LEU . . . -56.89 -36.8 74.8 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.507 -0.854 . . . . 0.32 111.277 179.051 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 87.6 m -70.54 -32.5 69.98 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.007 0.432 . . . . 1.01 110.027 179.047 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.453 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 1.2 tt -65.48 -35.47 80.98 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.679 -0.691 . . . . 1.85 110.165 179.68 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.567 ' HG3' ' HG3' ' A' ' 43' ' ' PRO . 21.7 mmt -69.52 -42.17 75.03 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.215 -0.448 . . . . 1.43 110.482 179.301 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 62.7 mtp180 -53.19 -51.65 61.39 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.617 -0.719 . . . . 3.27 111.403 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 10.2 t -62.99 -12.78 28.1 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.433 -0.349 . . . . 1.54 111.538 -179.785 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.453 ' HG ' ' O ' ' A' ' 35' ' ' LEU . 47.1 mt -113.06 156.65 22.75 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.364 -0.38 . . . . 1.94 110.708 -179.827 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -76.88 39.89 1.6 Allowed Glycine 0 CA--C 1.52 0.357 0 C-N-CA 120.88 -0.676 . . . . 0.69 113.912 -178.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 67.2 mm-40 -94.3 -59.98 1.83 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 117.148 0.474 . . . . 1.97 110.745 179.034 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.564 ' N ' HD21 ' A' ' 42' ' ' ASN . 0.8 OUTLIER 57.15 66.28 3.17 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.132 -0.486 . . . . 3.44 111.088 179.965 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . 0.567 ' HG3' ' HG3' ' A' ' 36' ' ' MET . 43.5 Cg_endo -67.42 167.95 19.26 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.593 2.195 . . . . 0.59 112.117 179.723 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 20.6 m -74.43 150.09 40.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.184 -0.462 . . . . 1.28 110.511 179.654 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -54.76 -48.01 73.17 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.654 0.264 . . . . 2.7 111.434 -179.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.81 -47.19 81.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.375 -0.375 . . . . 1.15 111.498 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.402 ' O ' HD22 ' A' ' 51' ' ' LEU . 10.0 tp10 -56.46 -48.79 76.33 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.03 0.443 . . . . 2.23 110.48 -179.554 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.477 HD12 ' HA2' ' A' ' 33' ' ' GLY . 33.4 tp -57.45 -41.24 80.16 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.555 -0.748 . . . . 2.01 110.938 -179.759 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 67.8 mt-30 -72.17 -25.95 61.88 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.058 -0.519 . . . . 1.68 111.212 -179.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -71.12 -55.05 9.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.483 -0.326 . . . . 0.62 111.565 -179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.423 HD23 ' HA ' ' A' ' 48' ' ' LEU . 0.9 OUTLIER -64.9 -38.8 92.16 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.459 -0.337 . . . . 1.11 111.844 -179.226 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 94.5 mt -65.5 -48.37 83.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.841 0.353 . . . . 1.25 110.837 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.92 -26.33 66.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.192 -0.458 . . . . 1.24 110.745 179.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -69.79 -53.98 15.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.991 -0.549 . . . . 2.54 110.416 179.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -72.7 -14.3 61.54 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.996 -0.547 . . . . 1.19 111.176 179.735 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -55.53 -30.61 61.02 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.097 -0.501 . . . . 1.95 111.406 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -118.57 -33.23 4.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.506 -0.316 . . . . 3.19 111.337 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -69.58 -34.64 74.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.412 -0.358 . . . . 2.69 111.133 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . 0.46 ' O ' ' HB2' ' A' ' 60' ' ' ASN . 13.5 m120 -114.7 6.25 15.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.315 -0.402 . . . . 2.05 111.246 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . 0.46 ' HB2' ' O ' ' A' ' 59' ' ' ASN . 39.6 m-80 74.0 -49.66 0.68 Allowed 'General case' 0 N--CA 1.466 0.375 0 O-C-N 123.607 0.567 . . . . 1.67 111.527 -179.867 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 169.43 7.52 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.598 -0.81 . . . . 0.86 112.992 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.454 ' HA ' HE21 ' A' ' 62' ' ' GLN . 0.0 OUTLIER -124.66 155.03 39.85 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.995 0.426 . . . . 0.49 111.284 179.837 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.591 ' HB2' HG13 ' A' ' 27' ' ' ILE . 27.3 mt -129.28 156.56 43.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.867 -0.606 . . . . 2.05 110.854 -179.79 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . 0.412 ' OD1' ' HD3' ' A' ' 26' ' ' LYS . 44.3 m-80 -112.34 157.26 21.21 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.526 -0.307 . . . . 1.52 110.493 179.902 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.45 ' O ' ' HB2' ' A' ' 69' ' ' CYS . 87.8 t80 -43.06 -38.46 2.34 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.986 -0.552 . . . . 0.46 110.654 179.589 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -72.81 -37.71 67.44 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.063 -0.517 . . . . 1.41 111.922 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -59.65 -49.97 75.69 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.179 0.514 . . . . 1.36 109.918 179.562 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.459 ' HE2' ' HB2' ' A' ' 12' ' ' PHE . 34.2 t80 -68.5 -53.7 21.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.525 -0.761 . . . . 0.61 110.839 179.763 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.45 ' HB2' ' O ' ' A' ' 65' ' ' PHE . 1.8 t -51.52 -41.02 60.74 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-O 120.971 0.415 . . . . 1.41 110.267 179.667 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -56.94 -50.38 64.45 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.864 -0.684 . . . . 0.41 111.526 179.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.454 ' HA ' ' HE2' ' A' ' 74' ' ' LYS . 11.4 mt -62.38 -36.69 76.02 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.407 0 CA-C-O 120.88 0.372 . . . . 1.13 110.852 179.344 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 95.0 mmm -59.2 -41.34 88.32 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.153 0.501 . . . . 1.24 109.679 179.104 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -55.93 -52.7 63.19 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.463 -0.79 . . . . 1.17 110.659 178.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.454 ' HE2' ' HA ' ' A' ' 71' ' ' ILE . 55.3 pttt -68.7 -30.52 69.2 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.287 -0.415 . . . . 1.91 111.15 -179.923 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . 0.499 ' NE2' ' HB3' ' A' ' 43' ' ' PRO . 5.1 tp-100 -68.64 -45.61 71.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.92 0.39 . . . . 2.03 110.884 179.624 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 45.1 mtt . . . . . 0 N--CA 1.445 -0.719 0 CA-C-N 115.861 -0.609 . . . . 1.52 111.022 -179.744 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.519 ' O ' ' HG2' ' A' ' 85' ' ' MET . 3.0 t . . . . . 0 N--CA 1.469 0.492 0 CA-C-O 121.17 0.509 . . . . 7.48 111.07 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -49.92 -18.95 0.59 Allowed 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 115.281 -0.872 . . . . 9.74 113.112 -178.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -60.35 -56.28 23.35 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 111.854 0.316 . . . . 12.11 111.854 -179.213 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -72.73 -13.65 61.38 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.357 -0.383 . . . . 10.87 111.285 -179.455 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' MET . . . . . 0.519 ' HG2' ' O ' ' A' ' 81' ' ' THR . 5.6 mmm -79.34 -49.28 12.66 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.468 -0.333 . . . . 11.09 110.627 -179.197 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 16.3 ttp180 -63.45 -42.23 98.65 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 116.219 -0.446 . . . . 16.05 109.912 179.586 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -60.11 -42.14 94.1 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.013 -0.539 . . . . 14.85 109.795 179.105 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -72.17 -23.23 61.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.75 -0.659 . . . . 14.11 110.597 179.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -68.95 -43.44 75.04 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.194 -0.457 . . . . 16.42 110.482 179.649 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 47.7 mtmt -68.32 -40.99 81.46 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.135 -0.484 . . . . 17.66 110.353 179.482 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 93.0 mt -64.47 -46.36 93.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.89 -0.595 . . . . 18.15 111.106 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -65.93 -49.13 69.03 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.281 -0.418 . . . . 18.34 110.907 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -61.06 98.63 0.08 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.28 -0.418 . . . . 19.29 110.069 179.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.42 ' HG2' ' HB3' ' A' ' 104' ' ' GLU . 18.9 mmm180 -51.7 -27.77 12.76 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.918 -0.583 . . . . 22.47 111.231 -179.414 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . 0.408 ' HB2' ' OD1' ' A' ' 97' ' ' ASP . 4.0 m-20 -112.22 169.9 8.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.3 -0.409 . . . . 23.34 110.731 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.41 5.6 57.31 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.891 -0.671 . . . . 22.77 112.051 179.675 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.416 ' OD2' ' HB2' ' A' ' 99' ' ' PHE . 7.8 p-10 -57.43 -32.7 67.16 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.687 0.28 . . . . 23.0 111.23 -179.659 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 107.43 12.97 22.06 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.698 -0.763 . . . . 20.02 112.926 179.626 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . 0.443 ' HA ' ' O ' ' A' ' 136' ' ' ILE . 97.3 m-85 -138.69 145.26 40.14 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.834 0.349 . . . . 20.56 111.071 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 48.5 mt -115.85 137.81 48.33 Favored 'Isoleucine or valine' 0 C--O 1.232 0.148 0 CA-C-N 116.151 -0.477 . . . . 19.37 111.445 -179.726 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 28.3 p -115.84 156.31 46.65 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 115.827 -0.624 . . . . 22.65 110.606 179.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_exo -44.34 -38.01 11.0 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.396 2.064 . . . . 23.78 112.552 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -63.89 -40.05 95.6 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.055 -0.521 . . . . 25.0 111.037 179.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . 0.425 ' O ' HG21 ' A' ' 108' ' ' VAL . 42.2 mt-10 -72.82 -41.44 64.9 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.473 -0.785 . . . . 22.31 110.369 -179.896 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.503 HD21 ' HB ' ' A' ' 121' ' ' ILE . 4.9 tp -58.05 -55.04 40.14 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.695 -0.684 . . . . 20.62 110.381 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.483 ' HA ' ' HE1' ' A' ' 109' ' ' MET . 9.0 ttp180 -54.61 -49.78 69.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.588 -0.733 . . . . 27.9 111.573 -179.813 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 55.3 t80 -54.59 -33.8 60.93 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.203 -0.453 . . . . 25.96 111.786 -178.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.48 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 58.3 t -79.23 -55.43 9.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 112.113 0.412 . . . . 21.06 112.113 -179.187 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.483 ' HE1' ' HA ' ' A' ' 106' ' ' ARG . 49.5 mtm -50.64 -41.23 55.02 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.524 0.202 . . . . 20.93 111.429 -179.278 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 88.9 mt -62.85 -32.59 56.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.928 0.394 . . . . 25.52 110.546 179.36 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 95.8 m-20 -71.46 -38.27 71.29 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.007 -0.542 . . . . 23.32 110.828 179.501 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.48 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 2.3 mt -74.66 -25.94 59.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.191 -0.459 . . . . 21.07 110.936 -179.708 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 98.23 46.87 2.12 Favored Glycine 0 N--CA 1.453 -0.23 0 C-N-CA 120.887 -0.673 . . . . 23.25 112.433 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -100.26 -27.02 13.71 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.523 0.201 . . . . 22.59 111.359 -179.684 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 13.4 mmmm 52.3 85.97 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.327 -0.397 . . . . 28.21 110.809 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . 0.467 HG23 ' SD ' ' A' ' 109' ' ' MET . 2.8 m -129.44 155.38 41.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.122 -0.49 . . . . 24.75 111.824 -179.514 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 59.2 p -95.87 146.71 24.35 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.798 -0.637 . . . . 27.5 109.864 178.608 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -55.54 -15.85 3.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.476 -0.329 . . . . 27.03 111.618 -179.453 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -79.21 -55.22 5.26 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.498 -0.319 . . . . 29.14 111.612 -179.573 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . 0.424 ' OE1' HG13 ' A' ' 116' ' ' VAL . 13.3 pt-20 -62.03 -37.34 84.54 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 111.824 0.305 . . . . 24.7 111.824 -179.347 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.503 ' HB ' HD21 ' A' ' 105' ' ' LEU . 33.3 pt -74.89 -38.19 43.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 N-CA-C 111.887 0.329 . . . . 22.9 111.887 -179.06 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . 0.49 ' N ' HG13 ' A' ' 121' ' ' ILE . 18.0 t70 -62.33 -43.94 97.66 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.872 0.367 . . . . 24.29 110.561 179.753 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -62.55 -43.03 99.83 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.03 -0.532 . . . . 24.74 110.565 179.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 45.4 ttp -56.41 -36.95 69.51 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.063 -0.517 . . . . 20.15 110.651 179.389 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.512 HG22 HD11 ' A' ' 136' ' ' ILE . 71.9 mt -65.24 -43.05 95.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.045 -0.525 . . . . 20.23 110.514 179.751 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 69.9 ttt180 -59.4 -37.92 79.25 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.815 -0.63 . . . . 25.57 111.046 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -70.92 -24.48 62.47 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.202 -0.454 . . . . 19.18 111.315 -179.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.553 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -98.94 -12.77 20.37 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.309 -0.405 . . . . 16.88 111.272 -179.831 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 62.1 t0 -103.32 96.45 6.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.204 -0.453 . . . . 20.4 110.935 -179.553 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -66.38 -54.05 28.88 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.896 -0.593 . . . . 21.43 111.128 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -61.14 -19.3 61.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.153 -0.476 . . . . 23.37 111.042 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 52.16 77.38 0.14 Allowed Glycine 0 N--CA 1.453 -0.186 0 C-N-CA 120.904 -0.665 . . . . 24.32 112.753 179.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -128.75 -0.3 5.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.825 0.345 . . . . 24.4 110.667 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 80.74 19.66 67.56 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.9 -0.667 . . . . 23.47 112.617 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 38.2 mtp -139.33 149.33 44.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.65 0.262 . . . . 22.91 110.419 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.543 HG23 ' HB2' ' A' ' 141' ' ' PHE . 47.4 mm -116.62 142.3 30.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 121.254 0.549 . . . . 18.67 111.95 -179.408 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . 0.543 ' ND2' ' HB2' ' A' ' 139' ' ' GLU . 1.2 p-10 -114.94 158.75 21.58 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.159 -0.928 . . . . 16.97 109.239 178.647 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 11.8 t80 -37.72 -27.56 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 112.481 0.549 . . . . 15.28 112.481 -179.067 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . 0.543 ' HB2' ' ND2' ' A' ' 137' ' ' ASN . 43.3 mt-10 -80.54 -55.73 4.66 Favored 'General case' 0 C--N 1.328 -0.327 0 O-C-N 122.155 -0.34 . . . . 14.82 111.236 -179.328 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . 0.429 ' HB2' HG21 ' A' ' 136' ' ' ILE . 71.4 mt-10 -59.15 -29.76 67.66 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.228 -0.442 . . . . 17.46 110.504 179.819 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.563 ' HA ' ' HE1' ' A' ' 144' ' ' MET . 78.7 t80 -70.23 -55.61 8.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.821 -0.627 . . . . 13.65 110.575 179.715 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 53.7 t -48.25 -35.86 5.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 115.917 -0.583 . . . . 11.12 111.972 179.728 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 143' ' ' TRP . . . . . 0.455 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 91.4 t90 -72.23 -56.06 6.16 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.469 0.544 . . . . 14.4 112.469 -179.018 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 144' ' ' MET . . . . . 0.563 ' HE1' ' HA ' ' A' ' 141' ' ' PHE . 18.2 ptt? -61.35 -25.76 67.37 Favored 'General case' 0 N--CA 1.464 0.244 0 N-CA-C 112.93 0.715 . . . . 14.63 112.93 -177.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 145' ' ' ILE . . . . . 0.53 HG13 ' N ' ' A' ' 146' ' ' SER . 45.6 pt -80.48 -40.78 19.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 112.022 0.378 . . . . 11.62 112.022 -179.559 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 146' ' ' SER . . . . . 0.53 ' N ' HG13 ' A' ' 145' ' ' ILE . 22.6 t -59.7 -14.49 14.34 Favored 'General case' 0 CA--C 1.519 -0.25 0 CA-C-O 121.45 0.643 . . . . 8.66 109.841 -179.804 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 147' ' ' GLN . . . . . 0.455 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 2.6 mm-40 -114.63 -15.54 11.95 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.887 -1.051 . . . . 11.87 110.242 -179.579 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.312 -0.851 . . . . 13.97 110.904 179.822 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.548 HD12 ' SG ' ' A' ' 69' ' ' CYS . 31.3 mt . . . . . 0 CA--C 1.528 0.101 0 CA-C-O 120.792 0.33 . . . . 2.0 110.925 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 76.3 p -70.34 -167.84 0.2 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.259 -0.428 . . . . 1.72 111.057 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.417 ' HG3' ' N ' ' A' ' 7' ' ' GLU . 10.0 pt-20 -72.64 -40.46 66.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.908 0.385 . . . . 2.2 110.505 -179.91 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.417 ' N ' ' HG3' ' A' ' 6' ' ' GLU . 9.4 pt-20 -74.18 -39.05 63.46 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.936 -0.574 . . . . 1.35 110.515 179.733 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -65.13 -48.99 71.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.905 -0.588 . . . . 2.34 110.64 179.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . 0.514 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 61.9 mt -55.8 -50.59 67.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.389 -0.369 . . . . 1.27 110.705 179.829 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.61 -23.11 66.13 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.163 -0.472 . . . . 1.22 111.255 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -69.71 -56.35 7.45 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.295 -0.412 . . . . 2.27 111.828 -179.108 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.514 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 12.3 p90 -78.22 -25.47 46.99 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 120.586 -0.446 . . . . 0.46 110.879 -179.775 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.457 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 20.0 tptm -63.32 -36.23 83.02 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 108.989 -0.745 . . . . 1.85 108.989 178.484 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.447 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 15.7 t70 -68.44 -51.98 37.75 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 108.825 -0.806 . . . . 0.44 108.825 177.927 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.34 -13.81 22.31 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.399 -0.819 . . . . 1.08 110.568 179.069 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.457 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 55.0 t80 -79.43 -51.45 9.35 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.886 -0.597 . . . . 0.56 110.597 -179.697 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 26.9 m -65.36 -18.92 24.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 121.003 0.43 . . . . 1.69 110.294 179.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.447 ' HG2' ' O ' ' A' ' 14' ' ' ASP . 29.2 mm-40 -63.2 -29.62 70.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.648 -0.705 . . . . 2.23 111.719 179.483 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -105.87 27.1 8.85 Favored 'General case' 0 N--CA 1.463 0.217 0 N-CA-C 112.04 0.385 . . . . 0.69 112.04 -179.185 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -113.94 86.74 2.47 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.988 0.423 . . . . 0.46 110.589 179.217 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.556 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -94.85 -38.01 10.94 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.917 -0.583 . . . . 2.55 111.438 -179.599 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -56.8 -24.59 51.73 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.307 -0.406 . . . . 1.8 111.477 -179.583 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 87.28 1.92 83.56 Favored Glycine 0 C--N 1.33 0.209 0 C-N-CA 120.793 -0.717 . . . . 0.54 112.88 179.62 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 26.8 p -82.35 16.07 2.2 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.688 0.28 . . . . 1.1 111.195 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 54.93 25.55 38.17 Favored Glycine 0 C--N 1.331 0.299 0 C-N-CA 120.721 -0.752 . . . . 0.37 111.766 -179.539 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.47 ' C ' HE22 ' A' ' 62' ' ' GLN . 35.4 mtmm -132.38 156.61 46.34 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.842 0.353 . . . . 1.75 111.067 -179.382 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.669 HG13 ' HB2' ' A' ' 63' ' ' LEU . 31.1 pt -114.33 124.94 71.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 121.001 0.429 . . . . 1.2 111.341 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -51.2 141.19 15.05 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.063 -0.517 . . . . 1.04 111.416 179.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 8.3 t -65.91 -11.84 50.13 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.94 -0.573 . . . . 1.71 111.313 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.455 ' HD2' ' N ' ' A' ' 30' ' ' ARG . 2.5 mpt_? -90.76 5.25 49.05 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.971 0.415 . . . . 3.53 110.492 179.777 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -120.86 -9.43 9.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.923 -0.58 . . . . 2.26 110.788 -179.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.404 HD23 HD12 ' A' ' 51' ' ' LEU . 7.9 tt -53.25 -52.46 58.92 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.317 -0.401 . . . . 1.95 110.747 179.671 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.426 ' HA2' HD12 ' A' ' 48' ' ' LEU . . . -54.3 -48.01 65.97 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.427 -0.892 . . . . 0.32 111.602 179.551 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 30.2 m -58.3 -29.25 65.71 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 121.423 0.63 . . . . 1.01 109.643 178.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.404 HD11 HD12 ' A' ' 27' ' ' ILE . 1.2 tt -72.67 -35.07 67.62 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.163 -0.926 . . . . 1.85 109.905 179.391 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.549 ' SD ' ' HG3' ' A' ' 43' ' ' PRO . 7.4 mtp -76.92 -16.9 59.23 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.976 -0.556 . . . . 1.43 110.297 179.89 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -80.63 -41.78 23.3 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.977 -0.556 . . . . 3.27 110.302 179.049 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.426 HG22 ' HG ' ' A' ' 39' ' ' LEU . 10.4 t -67.32 -12.44 60.16 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.991 -0.55 . . . . 1.54 110.769 179.568 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.427 ' C ' ' H ' ' A' ' 41' ' ' GLN . 26.4 mt -112.28 155.53 23.9 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.918 -0.583 . . . . 1.94 110.136 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -72.42 16.83 1.62 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.834 -0.698 . . . . 0.69 113.462 -179.272 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.427 ' H ' ' C ' ' A' ' 39' ' ' LEU . 85.1 mm-40 -68.09 -63.2 1.11 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.907 0.384 . . . . 1.97 110.932 179.602 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 69.7 m-20 55.57 70.77 1.43 Allowed Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 115.936 -0.574 . . . . 3.44 111.061 -179.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . 0.549 ' HG3' ' SD ' ' A' ' 36' ' ' MET . 57.5 Cg_endo -67.97 -167.78 0.18 Allowed 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.87 2.38 . . . . 0.59 112.307 179.645 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 41.1 m -100.17 144.23 29.44 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.036 -0.529 . . . . 1.28 110.489 179.45 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -48.99 -55.14 12.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.742 0.306 . . . . 2.7 111.364 -179.442 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -54.49 -48.24 72.09 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.204 -0.453 . . . . 1.15 111.622 -179.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.428 ' HG2' HD23 ' A' ' 51' ' ' LEU . 37.8 tt0 -56.4 -47.29 79.27 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.813 0.339 . . . . 2.23 110.651 -179.778 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.426 HD12 ' HA2' ' A' ' 33' ' ' GLY . 13.9 tp -58.83 -41.88 87.92 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.936 -0.575 . . . . 2.01 111.112 -179.764 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 82.8 mm-40 -71.12 -31.76 68.15 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.249 -0.432 . . . . 1.68 111.759 -179.384 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . 0.456 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 28.8 m-20 -74.07 -55.88 5.58 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 111.919 0.34 . . . . 0.62 111.919 -179.199 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.428 HD23 ' HG2' ' A' ' 47' ' ' GLU . 3.1 pp -59.51 -37.29 77.93 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.696 -0.229 . . . . 1.11 111.285 -179.314 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 76.8 mt -69.35 -35.39 67.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.754 0.312 . . . . 1.25 110.556 179.539 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.68 -36.55 81.19 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.301 -0.409 . . . . 1.24 110.756 179.45 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.456 ' HG2' ' O ' ' A' ' 50' ' ' ASP . 3.3 mm-40 -73.23 -50.38 22.72 Favored 'General case' 0 CA--C 1.516 -0.365 0 N-CA-C 109.623 -0.51 . . . . 2.54 109.623 179.178 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -63.12 -14.36 47.66 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.551 -0.749 . . . . 1.19 110.975 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -57.47 -37.26 72.6 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.975 -0.557 . . . . 1.95 111.61 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 6.8 p30 -127.09 -36.95 2.12 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.597 -0.274 . . . . 3.19 111.563 -179.416 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 19.9 m120 -62.0 -15.53 44.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.557 -0.292 . . . . 2.69 111.37 -179.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . 0.443 ' C ' ' H ' ' A' ' 61' ' ' GLY . 14.4 m120 -123.24 1.28 9.09 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.436 -0.347 . . . . 2.05 110.972 179.861 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . 0.406 ' HB2' ' O ' ' A' ' 59' ' ' ASN . 12.5 m120 73.24 -31.24 0.22 Allowed 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.99 -0.55 . . . . 1.67 111.766 179.794 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . 0.443 ' H ' ' C ' ' A' ' 59' ' ' ASN . . . 140.5 15.5 0.49 Allowed Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.553 -0.832 . . . . 0.86 112.738 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.485 ' HA ' HE21 ' A' ' 62' ' ' GLN . 0.0 OUTLIER -138.66 151.49 47.24 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.077 0.465 . . . . 0.49 111.195 179.825 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.669 ' HB2' HG13 ' A' ' 27' ' ' ILE . 6.3 mp -119.12 150.02 40.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.627 -0.715 . . . . 2.05 110.685 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . 0.422 ' H ' ' HB2' ' A' ' 67' ' ' GLU . 50.0 m-80 -113.94 157.67 22.12 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.961 -0.385 . . . . 1.52 109.961 178.876 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.514 ' O ' ' HB2' ' A' ' 69' ' ' CYS . 85.3 t80 -43.68 -35.32 1.76 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.881 0.372 . . . . 0.46 110.411 179.147 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -77.08 -37.84 53.64 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.994 -0.548 . . . . 1.41 111.748 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.422 ' HB2' ' H ' ' A' ' 64' ' ' ASN . 10.2 mm-40 -59.64 -49.4 77.88 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.144 0.497 . . . . 1.36 110.016 179.486 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.462 ' HE2' ' HB2' ' A' ' 12' ' ' PHE . 28.5 t80 -69.08 -52.85 24.2 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.548 -0.751 . . . . 0.61 111.087 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.548 ' SG ' HD12 ' A' ' 4' ' ' LEU . 1.4 t -52.44 -45.02 65.82 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 121.002 0.43 . . . . 1.41 110.311 179.788 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -54.26 -50.85 54.46 Favored Glycine 0 N--CA 1.451 -0.32 0 CA-C-N 115.644 -0.707 . . . . 0.41 112.046 179.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.421 ' HA ' ' HG2' ' A' ' 74' ' ' LYS . 11.7 mt -62.54 -40.57 88.72 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.375 0 CA-C-O 120.973 0.416 . . . . 1.13 110.523 179.296 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' MET . . . . . 0.457 ' HA ' HE21 ' A' ' 75' ' ' GLN . 3.6 mtp -58.92 -22.72 60.29 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.784 -0.644 . . . . 1.24 109.998 179.43 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -74.89 -52.23 11.82 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.03 -0.532 . . . . 1.17 109.969 178.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.421 ' HG2' ' HA ' ' A' ' 71' ' ' ILE . 61.2 pttt -67.05 -24.25 65.97 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 121.08 0.467 . . . . 1.91 110.07 179.164 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . 0.457 HE21 ' HA ' ' A' ' 72' ' ' MET . 7.7 tt0 -78.08 -49.72 13.41 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.756 -0.657 . . . . 2.03 110.593 178.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 38.9 mtt . . . . . 0 N--CA 1.449 -0.497 0 CA-C-N 115.82 -0.627 . . . . 1.52 110.84 179.744 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.566 ' O ' ' HG2' ' A' ' 85' ' ' MET . 91.9 m . . . . . 0 N--CA 1.46 0.07 0 CA-C-O 120.825 0.345 . . . . 7.48 110.477 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.412 ' HB3' ' OH ' ' A' ' 138' ' ' TYR . 32.3 mt-10 -59.27 -14.88 12.68 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 113.034 0.753 . . . . 9.74 113.034 -178.507 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -64.61 -56.71 12.14 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 120.821 0.344 . . . . 12.11 111.66 -179.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -67.43 -16.55 64.29 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.134 0.492 . . . . 10.87 110.381 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' MET . . . . . 0.566 ' HG2' ' O ' ' A' ' 81' ' ' THR . 7.1 mmm -80.36 -34.96 36.09 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.646 -0.706 . . . . 11.09 109.768 -179.702 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 17.8 ttm180 -65.82 -42.6 90.42 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.643 -0.708 . . . . 16.05 109.512 179.039 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.418 ' HA ' ' HE3' ' A' ' 90' ' ' LYS . 1.9 tm-20 -59.87 -47.43 85.77 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 109.272 -0.64 . . . . 14.85 109.272 178.62 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.79 -26.08 68.19 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.59 -0.732 . . . . 14.11 110.553 179.155 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -69.77 -38.22 76.65 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.203 -0.453 . . . . 16.42 110.229 179.481 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . 0.588 ' HZ1' ' HB2' ' A' ' 90' ' ' LYS . 9.6 mtmp? -63.09 -48.79 77.09 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.929 -0.578 . . . . 17.66 110.416 179.57 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 84.1 mt -61.21 -46.25 96.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.179 -0.464 . . . . 18.15 110.882 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.493 ' HA ' HG23 ' A' ' 108' ' ' VAL . 0.9 OUTLIER -60.43 -39.91 89.16 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.147 -0.478 . . . . 18.34 111.132 -179.871 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 36.7 t0 -72.83 95.54 1.95 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.943 0.401 . . . . 19.29 110.0 179.425 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.421 ' HG3' ' HA ' ' A' ' 104' ' ' GLU . 0.6 OUTLIER -56.75 -16.25 6.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.754 -0.657 . . . . 22.47 111.177 -179.366 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . 0.423 ' HB2' ' OD1' ' A' ' 97' ' ' ASP . 24.2 m-20 -118.14 169.43 9.69 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.94 0.4 . . . . 23.34 110.859 179.73 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.27 5.4 57.45 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.869 -0.681 . . . . 22.77 112.342 179.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.423 ' OD1' ' HB2' ' A' ' 95' ' ' ASP . 5.7 p-10 -62.0 -41.69 98.33 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.716 0.293 . . . . 23.0 111.147 -179.758 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 117.69 10.94 8.9 Favored Glycine 0 C--N 1.332 0.335 0 C-N-CA 120.717 -0.754 . . . . 20.02 112.767 179.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -137.87 150.84 47.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.786 0.327 . . . . 20.56 110.948 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 46.6 mt -114.81 139.44 40.97 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.141 0 CA-C-N 116.253 -0.43 . . . . 19.37 111.315 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 74.2 m -114.53 156.24 44.9 Favored Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 115.894 -0.594 . . . . 22.65 110.045 179.512 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_exo -44.16 -36.3 8.71 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.304 2.003 . . . . 23.78 112.846 -179.43 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.63 -39.72 88.41 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.223 0.535 . . . . 25.0 110.884 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . 0.421 ' HA ' ' HG3' ' A' ' 94' ' ' ARG . 42.1 mt-10 -74.51 -44.65 50.31 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.409 -0.814 . . . . 22.31 110.202 -179.847 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.452 HD21 ' HB ' ' A' ' 121' ' ' ILE . 2.8 tp -54.32 -51.66 63.98 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.232 -0.894 . . . . 20.62 110.246 179.733 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.446 ' HA ' ' HE2' ' A' ' 109' ' ' MET . 10.7 ttt85 -57.07 -55.24 37.32 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.337 -0.847 . . . . 27.9 111.633 -179.749 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 36.0 t80 -46.11 -44.35 15.6 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.102 -0.499 . . . . 25.96 112.32 -178.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.493 HG23 ' HA ' ' A' ' 92' ' ' PHE . 23.0 t -69.62 -54.55 18.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 N-CA-C 112.235 0.457 . . . . 21.06 112.235 -178.706 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.446 ' HE2' ' HA ' ' A' ' 106' ' ' ARG . 62.3 mtm -52.51 -37.38 57.31 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 120.886 0.374 . . . . 20.93 110.531 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 72.5 mt -64.88 -36.47 77.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.987 -0.552 . . . . 25.52 110.162 178.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 14.4 m120 -67.31 -34.92 78.39 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.844 -0.616 . . . . 23.32 110.504 179.448 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 69.5 mt -72.0 -40.83 68.24 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.875 -0.602 . . . . 21.07 110.825 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 129.51 -3.48 6.18 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.759 -0.734 . . . . 23.25 112.557 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -86.94 93.92 9.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.679 0.276 . . . . 22.59 110.984 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -64.7 119.34 10.38 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.274 -0.421 . . . . 28.21 110.635 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 4.8 m -137.89 154.9 29.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.992 -0.549 . . . . 24.75 111.398 -179.638 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 71.3 p -98.12 147.37 24.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.804 -0.634 . . . . 27.5 110.576 179.463 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . 0.425 ' HA ' HG12 ' A' ' 121' ' ' ILE . 21.3 m-20 -53.7 -21.42 7.04 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.23 -0.441 . . . . 27.03 111.065 -179.908 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -80.5 -50.41 10.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.257 -0.429 . . . . 29.14 111.106 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.3 -33.62 75.91 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.265 -0.425 . . . . 24.7 111.121 -179.483 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.452 ' HB ' HD21 ' A' ' 105' ' ' LEU . 32.6 pt -79.17 -35.08 16.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.399 -0.364 . . . . 22.9 110.946 -179.892 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . 0.433 ' N ' HG13 ' A' ' 121' ' ' ILE . 14.8 t70 -62.13 -32.0 72.54 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.041 0.448 . . . . 24.29 109.827 179.307 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -72.79 -47.08 49.61 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.763 -0.653 . . . . 24.74 110.203 179.278 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 49.3 ttp -55.62 -40.13 71.7 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.977 -0.556 . . . . 20.15 110.526 179.375 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.447 HG22 HD11 ' A' ' 136' ' ' ILE . 85.7 mt -65.89 -41.85 90.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.089 -0.505 . . . . 20.23 110.27 179.33 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 56.1 ttt180 -59.76 -31.96 70.14 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.697 -0.683 . . . . 25.57 110.826 179.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -77.79 -28.18 50.39 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.142 -0.481 . . . . 19.18 111.101 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.593 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -92.7 -14.13 28.44 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.17 -0.468 . . . . 16.88 111.029 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . 0.43 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 30.0 t70 -100.86 106.64 18.03 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.045 -0.525 . . . . 20.4 110.613 -179.798 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 74.1 m-85 -93.4 -41.83 9.61 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.739 -0.664 . . . . 21.43 111.499 -179.351 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -56.19 -26.17 49.82 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.417 -0.356 . . . . 23.37 111.021 -179.76 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 76.26 62.85 2.5 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.879 -0.677 . . . . 24.32 112.432 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . 0.401 ' OD2' ' HB2' ' A' ' 135' ' ' MET . 3.3 p-10 -130.35 -0.73 4.51 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.69 0.281 . . . . 24.4 111.258 -179.697 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 66.98 18.2 68.54 Favored Glycine 0 C--N 1.33 0.245 0 C-N-CA 120.814 -0.708 . . . . 23.47 112.731 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' MET . . . . . 0.401 ' HB2' ' OD2' ' A' ' 133' ' ' ASP . 68.4 mtp -134.3 155.36 50.35 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 110.183 -0.303 . . . . 22.91 110.183 179.857 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.515 HG23 ' HB2' ' A' ' 140' ' ' GLU . 47.5 mm -114.12 145.59 19.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 121.497 0.665 . . . . 18.67 112.119 -179.089 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . 0.498 HD21 ' H ' ' A' ' 139' ' ' GLU . 6.5 t30 -118.64 158.41 25.53 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 114.901 -1.045 . . . . 16.97 108.922 178.508 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . 0.412 ' OH ' ' HB3' ' A' ' 82' ' ' GLU . 8.2 t80 -38.72 -26.6 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 112.009 0.374 . . . . 15.28 112.009 -179.664 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . 0.498 ' H ' HD21 ' A' ' 137' ' ' ASN . 45.4 mt-10 -80.68 -55.85 4.55 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.774 0.321 . . . . 14.82 111.097 -179.546 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . 0.515 ' HB2' HG23 ' A' ' 136' ' ' ILE . 27.5 mt-10 -60.87 -24.41 65.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.164 0.507 . . . . 17.46 110.214 179.712 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.58 ' HA ' ' HE3' ' A' ' 144' ' ' MET . 86.6 t80 -74.0 -55.56 5.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.556 -0.747 . . . . 13.65 110.527 179.857 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . 0.402 HG22 ' O ' ' A' ' 138' ' ' TYR . 42.9 t -48.63 -37.0 7.9 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 CA-C-N 115.9 -0.591 . . . . 11.12 111.417 179.499 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 76.8 t90 -70.57 -55.0 9.87 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.265 0.469 . . . . 14.4 112.265 -179.165 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 144' ' ' MET . . . . . 0.593 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 24.6 ptt? -65.13 -22.22 66.9 Favored 'General case' 0 N--CA 1.464 0.274 0 N-CA-C 113.339 0.866 . . . . 14.63 113.339 -177.611 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 145' ' ' ILE . . . . . 0.623 ' HA ' ' HB2' ' A' ' 148' ' ' LYS . 39.6 pt -80.55 -44.6 21.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 C-N-CA 120.751 -0.38 . . . . 11.62 111.833 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 146' ' ' SER . . . . . 0.518 ' N ' HG13 ' A' ' 145' ' ' ILE . 78.7 p -64.29 -14.19 54.41 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-O 121.448 0.642 . . . . 8.66 109.59 179.629 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 147' ' ' GLN . . . . . 0.485 HE21 ' HG ' ' A' ' 146' ' ' SER . 8.0 mm-40 -125.35 19.93 8.11 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 114.967 -1.015 . . . . 11.87 110.245 -179.417 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . 0.623 ' HB2' ' HA ' ' A' ' 145' ' ' ILE . 16.5 ttpp . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.267 -0.873 . . . . 13.97 111.069 -179.451 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 65.2 mt . . . . . 0 CA--C 1.528 0.129 0 CA-C-O 120.767 0.318 . . . . 2.0 110.898 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 67.6 p -87.01 -165.55 1.32 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.242 -0.435 . . . . 1.72 111.15 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -73.78 -39.78 63.92 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.991 0.424 . . . . 2.2 110.762 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -74.46 -41.13 61.32 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.827 -0.624 . . . . 1.35 110.813 -179.665 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 -63.74 -49.39 73.2 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.164 -0.471 . . . . 2.34 110.79 179.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . 0.522 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 63.8 mt -55.95 -52.44 49.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.445 -0.343 . . . . 1.27 110.882 179.76 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.86 -21.54 66.82 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.38 -0.373 . . . . 1.22 111.371 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -71.23 -56.75 5.41 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 116.441 -0.345 . . . . 2.27 111.923 -179.181 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.522 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 17.9 p90 -78.51 -26.11 45.81 Favored 'General case' 0 C--N 1.332 -0.154 0 C-N-CA 120.579 -0.448 . . . . 0.46 110.931 -179.666 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 49.9 tptt -66.15 -34.95 79.22 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.348 -0.612 . . . . 1.85 109.348 178.769 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.432 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 24.8 t70 -68.83 -50.94 45.84 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.349 -0.612 . . . . 0.44 109.349 178.489 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.58 -14.3 57.1 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.823 -0.626 . . . . 1.08 110.445 178.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -80.09 -44.38 20.1 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.816 -0.629 . . . . 0.56 111.016 -179.442 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 34.2 m -73.45 -22.75 19.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.336 -0.393 . . . . 1.69 111.021 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.432 ' HG2' ' O ' ' A' ' 14' ' ' ASP . 82.5 mm-40 -63.21 -34.16 77.05 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.137 -0.483 . . . . 2.23 111.201 179.74 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 46.9 m-85 -86.95 -13.38 44.79 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.473 -0.331 . . . . 0.69 111.579 -179.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -90.35 87.62 6.88 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.832 0.349 . . . . 0.46 110.596 179.777 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 70.4 mmtt -95.0 -19.78 19.91 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.078 -0.51 . . . . 2.55 111.292 -179.605 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -78.59 -42.29 29.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.252 -0.431 . . . . 1.8 111.204 -179.669 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.95 3.94 29.77 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.649 -0.786 . . . . 0.54 112.735 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 49.4 p -73.06 1.09 9.69 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.628 0.251 . . . . 1.1 111.216 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 61.6 23.73 63.24 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.503 -0.856 . . . . 0.37 111.679 -179.369 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.641 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 28.9 mtpt -133.83 155.76 49.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.817 0.341 . . . . 1.75 111.065 -179.748 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.535 HG13 ' HB3' ' A' ' 63' ' ' LEU . 23.3 pt -117.41 131.77 69.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.108 -0.496 . . . . 1.2 111.714 -179.257 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -54.97 130.46 41.63 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.27 -0.423 . . . . 1.04 110.974 179.599 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 81.5 p -62.68 -22.46 66.49 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.154 -0.475 . . . . 1.71 111.13 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 52.6 mtp180 -73.25 -18.03 61.27 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.087 -0.506 . . . . 3.53 110.41 179.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -102.6 0.85 33.95 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.75 -0.659 . . . . 2.26 110.595 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.401 HD21 HD21 ' A' ' 63' ' ' LEU . 0.5 OUTLIER -60.07 -52.44 65.36 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.939 -0.573 . . . . 1.95 110.646 -179.818 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -54.12 -39.54 64.04 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.628 -0.796 . . . . 0.32 111.799 179.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.4 ' O ' HG21 ' A' ' 38' ' ' THR . 60.7 m -70.04 -28.11 65.21 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.021 0.439 . . . . 1.01 110.559 179.462 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 52.4 tp -72.23 -34.41 68.3 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.66 -0.7 . . . . 1.85 111.526 -179.324 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.437 ' SD ' ' HG3' ' A' ' 43' ' ' PRO . 26.7 mtp -80.4 -29.02 37.73 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.439 -0.346 . . . . 1.43 110.8 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 76.3 mtp180 -68.21 -41.86 80.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.269 -0.423 . . . . 3.27 110.466 179.557 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.414 HG23 ' CD1' ' A' ' 39' ' ' LEU . 1.8 t -66.13 -13.07 59.54 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.153 -0.476 . . . . 1.54 111.006 179.51 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.414 ' CD1' HG23 ' A' ' 38' ' ' THR . 10.5 mp -113.12 156.06 23.84 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.982 -0.553 . . . . 1.94 110.553 179.574 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -42.32 -33.48 1.38 Allowed Glycine 0 CA--C 1.52 0.378 0 C-N-CA 121.305 -0.474 . . . . 0.69 113.817 -179.173 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 24.8 mp0 -52.52 143.7 15.06 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.883 0.373 . . . . 1.97 111.282 -179.544 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -133.43 72.75 74.45 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 115.886 -0.597 . . . . 3.44 110.869 179.706 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . 0.437 ' HG3' ' SD ' ' A' ' 36' ' ' MET . 28.0 Cg_endo -60.54 150.08 83.43 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.814 2.343 . . . . 0.59 112.482 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.3 m -78.61 159.92 27.83 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.191 -0.458 . . . . 1.28 110.456 179.662 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -59.52 -55.23 37.17 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.768 0.318 . . . . 2.7 111.242 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.0 -49.18 77.08 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.303 -0.408 . . . . 1.15 111.459 -179.725 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.436 ' O ' HD22 ' A' ' 51' ' ' LEU . 42.2 tt0 -55.06 -43.95 74.31 Favored 'General case' 0 CA--C 1.518 -0.25 0 CA-C-N 116.322 -0.399 . . . . 2.23 110.086 -179.798 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.459 ' HA ' HD23 ' A' ' 51' ' ' LEU . 55.9 tp -56.55 -44.78 81.25 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.577 -0.738 . . . . 2.01 110.806 179.765 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -70.59 -25.55 63.12 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.081 -0.509 . . . . 1.68 111.251 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -68.6 -51.54 41.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.539 -0.3 . . . . 0.62 111.39 179.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.459 HD23 ' HA ' ' A' ' 48' ' ' LEU . 0.9 OUTLIER -70.64 -36.14 73.25 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.502 -0.317 . . . . 1.11 111.363 -179.643 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 75.8 mt -65.68 -46.03 90.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.459 -0.337 . . . . 1.25 111.033 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.56 -34.45 78.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.393 -0.367 . . . . 1.24 110.882 179.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -65.12 -47.12 78.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.136 -0.484 . . . . 2.54 110.691 179.778 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -79.0 -14.62 59.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.139 -0.482 . . . . 1.19 111.383 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -71.33 -37.47 71.72 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.265 -0.425 . . . . 1.95 111.391 -179.556 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 30.5 p-10 -106.91 10.73 30.47 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.503 -0.317 . . . . 3.19 111.654 -179.372 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 24.0 t-20 -125.87 -11.99 6.54 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.91 0.386 . . . . 2.69 110.939 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -138.42 18.8 2.74 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.089 -0.505 . . . . 2.05 110.599 179.764 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 21.6 m-80 64.6 -80.26 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 115.672 -0.694 . . . . 1.67 111.544 179.666 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -153.93 4.1 0.29 Allowed Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.502 -0.856 . . . . 0.86 112.681 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.641 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -118.46 155.3 31.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.011 0.434 . . . . 0.49 111.271 179.88 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.637 ' HG ' ' HB2' ' A' ' 67' ' ' GLU . 2.4 tp -126.64 155.21 42.92 Favored 'General case' 0 C--O 1.223 -0.304 0 CA-C-N 115.778 -0.647 . . . . 2.05 110.554 -179.389 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . 0.456 ' OD1' ' HE3' ' A' ' 26' ' ' LYS . 0.7 OUTLIER -110.43 155.58 22.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.893 0.377 . . . . 1.52 111.3 -179.113 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 82.0 t80 -44.93 -46.07 10.79 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.618 -0.719 . . . . 0.46 111.424 179.869 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -64.3 -33.89 76.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.433 -0.349 . . . . 1.41 111.926 -179.594 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.637 ' HB2' ' HG ' ' A' ' 63' ' ' LEU . 12.3 mm-40 -63.18 -55.84 21.73 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.778 0.323 . . . . 1.36 110.446 179.901 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.442 ' HE2' ' HB2' ' A' ' 12' ' ' PHE . 41.6 t80 -59.93 -49.36 77.99 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.262 -0.426 . . . . 0.61 110.337 179.142 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 1.7 t -53.22 -45.25 68.61 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.131 -0.486 . . . . 1.41 110.305 179.548 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -51.5 -47.14 52.24 Favored Glycine 0 N--CA 1.448 -0.512 0 N-CA-C 111.103 -0.799 . . . . 0.41 111.103 179.135 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.479 ' HA ' ' HG2' ' A' ' 74' ' ' LYS . 14.1 mt -63.96 -40.99 91.05 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.45 0 CA-C-O 120.851 0.358 . . . . 1.13 110.664 179.104 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' MET . . . . . 0.425 ' HG2' ' O ' ' A' ' 68' ' ' PHE . 95.3 mmm -51.82 -41.76 61.99 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.986 -0.552 . . . . 1.24 109.659 179.346 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.84 -55.35 35.26 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.561 -0.745 . . . . 1.17 110.938 179.12 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.479 ' HG2' ' HA ' ' A' ' 71' ' ' ILE . 21.8 pttp -64.15 -25.95 68.31 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.422 -0.354 . . . . 1.91 111.715 -179.411 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -81.92 -33.7 30.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.352 0.596 . . . . 2.03 110.55 -179.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' MET . . . . . 0.412 ' HG3' ' O ' ' A' ' 72' ' ' MET . 54.7 mtt . . . . . 0 C--N 1.325 -0.479 0 CA-C-N 115.055 -0.975 . . . . 1.52 111.053 -179.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.568 ' O ' ' HG2' ' A' ' 85' ' ' MET . 52.7 m . . . . . 0 N--CA 1.46 0.075 0 N-CA-C 110.374 -0.232 . . . . 7.48 110.374 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -68.44 -25.12 64.85 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 112.857 0.688 . . . . 9.74 112.857 -178.478 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 -54.35 -55.79 25.03 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 111.957 0.354 . . . . 12.11 111.957 -178.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -63.97 -20.82 66.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.949 0.404 . . . . 10.87 111.065 -179.743 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' MET . . . . . 0.568 ' HG2' ' O ' ' A' ' 81' ' ' THR . 4.7 mmm -79.89 -25.67 40.54 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.07 -0.514 . . . . 11.09 110.175 -179.336 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 29.2 ttt180 -74.19 -50.09 20.72 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.517 -0.765 . . . . 16.05 109.754 179.619 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -59.86 -36.45 76.9 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.826 -0.624 . . . . 14.85 109.512 178.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -72.16 -35.5 69.05 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-N 115.663 -0.698 . . . . 14.11 110.897 179.249 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -67.76 -20.57 65.24 Favored 'General case' 0 CA--C 1.52 -0.183 0 CA-C-O 121.326 0.584 . . . . 16.42 110.093 179.49 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 15.6 tttt -79.91 -47.13 15.55 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 115.298 -0.865 . . . . 17.66 110.169 179.775 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 73.7 mt -64.29 -43.47 97.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.496 -0.775 . . . . 18.15 111.111 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -66.82 -52.66 41.13 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.271 -0.422 . . . . 18.34 111.025 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -59.63 99.83 0.07 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.303 -0.408 . . . . 19.29 110.386 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.503 ' HG2' ' HB3' ' A' ' 104' ' ' GLU . 22.4 mmm180 -53.04 -37.2 61.37 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.859 -0.61 . . . . 22.47 111.316 -179.393 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -107.84 -176.73 3.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.9 0.381 . . . . 23.34 111.09 -179.697 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.77 4.26 56.25 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.944 -0.646 . . . . 22.77 112.631 179.754 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -63.66 -31.25 72.37 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.64 0.257 . . . . 23.0 111.29 -179.761 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 92.89 35.18 6.49 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.791 -0.718 . . . . 20.02 112.83 179.771 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . 0.416 ' HA ' ' O ' ' A' ' 136' ' ' ILE . 96.6 m-85 -147.54 142.27 26.7 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.638 0.256 . . . . 20.56 110.811 179.857 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 59.6 mt -114.35 125.83 71.74 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.162 0 CA-C-O 121.054 0.454 . . . . 19.37 110.998 179.672 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 23.5 p -114.48 156.07 45.07 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 115.793 -0.639 . . . . 22.65 110.626 -179.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_exo -39.95 -35.61 1.16 Allowed 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.608 2.206 . . . . 23.78 112.681 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.07 -53.43 25.63 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.254 -0.43 . . . . 25.0 110.973 179.782 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . 0.503 ' HB3' ' HG2' ' A' ' 94' ' ' ARG . 46.8 mt-10 -62.29 -38.78 90.66 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.872 -0.604 . . . . 22.31 110.55 179.87 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.464 HD23 ' HB ' ' A' ' 121' ' ' ILE . 39.9 tp -64.48 -35.6 81.47 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.541 -0.754 . . . . 20.62 110.869 -179.892 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 10.4 ttp180 -63.97 -52.53 59.25 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.343 -0.389 . . . . 27.9 110.858 179.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 35.7 t80 -54.27 -47.92 71.79 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.088 -0.506 . . . . 25.96 111.563 -179.407 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 7.7 p -70.77 -46.98 66.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 N-CA-C 112.144 0.424 . . . . 21.06 112.144 -179.14 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.424 ' HG3' ' HG ' ' A' ' 105' ' ' LEU . 0.4 OUTLIER -57.2 -20.68 28.37 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 111.728 0.27 . . . . 20.93 111.728 -179.018 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.574 ' HA ' ' HA ' ' A' ' 114' ' ' GLU . 83.0 mt -82.67 -28.71 8.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 120.943 0.402 . . . . 25.52 110.353 178.915 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -73.87 -36.21 64.79 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.103 -0.499 . . . . 23.32 109.904 178.765 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.454 HD11 ' N ' ' A' ' 112' ' ' LEU . 7.0 mp -85.85 -41.69 14.78 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.648 -0.705 . . . . 21.07 109.762 179.223 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -148.93 80.83 0.2 Allowed Glycine 0 C--N 1.33 0.235 0 CA-C-N 115.33 -0.85 . . . . 23.25 111.769 179.498 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . 0.574 ' HA ' ' HA ' ' A' ' 110' ' ' ILE . 0.0 OUTLIER -48.14 160.48 0.15 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.064 0.459 . . . . 22.59 112.136 -179.356 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 23.6 ttmm 70.67 62.97 0.19 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.238 -0.892 . . . . 28.21 111.858 179.488 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . 0.472 HG12 ' OE1' ' A' ' 120' ' ' GLU . 1.6 m -125.81 114.73 40.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.165 -0.47 . . . . 24.75 110.625 178.286 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' THR . . . . . 0.401 ' HG1' ' HG2' ' A' ' 120' ' ' GLU . 72.7 p -67.51 147.42 52.84 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.295 -0.411 . . . . 27.5 110.419 179.8 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 28.8 m-20 -56.3 -14.73 3.09 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.208 -0.451 . . . . 27.03 110.581 179.804 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -79.7 -55.17 5.2 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.032 -0.531 . . . . 29.14 111.249 -179.876 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . 0.472 ' OE1' HG12 ' A' ' 116' ' ' VAL . 14.0 pt-20 -58.57 -42.56 88.25 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.748 -0.205 . . . . 24.7 111.46 -179.576 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.528 HG13 ' H ' ' A' ' 122' ' ' ASP . 2.7 pt -68.37 -42.92 84.5 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-O 120.643 0.259 . . . . 22.9 111.144 179.487 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . 0.528 ' H ' HG13 ' A' ' 121' ' ' ILE . 17.8 t70 -60.24 -40.42 90.17 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.826 0.346 . . . . 24.29 110.444 179.666 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -58.34 -46.05 86.96 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.002 -0.545 . . . . 24.74 110.201 179.382 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' MET . . . . . 0.416 ' HE3' HD21 ' A' ' 105' ' ' LEU . 58.9 ttp -55.54 -37.17 67.62 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.214 -0.448 . . . . 20.15 110.328 179.195 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.438 HG23 HD11 ' A' ' 136' ' ' ILE . 78.6 mt -65.92 -42.38 91.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.049 -0.523 . . . . 20.23 110.337 179.341 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 21.4 tpp180 -63.43 -25.26 68.19 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.806 -0.634 . . . . 25.57 111.042 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -78.53 -30.02 46.81 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.229 -0.441 . . . . 19.18 111.308 -179.535 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.641 ' HB1' ' HB3' ' A' ' 144' ' ' MET . . . -99.73 -12.39 20.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.309 -0.405 . . . . 16.88 111.479 -179.689 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . 0.444 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 25.4 t0 -100.68 104.03 15.31 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.977 0.418 . . . . 20.4 110.906 -179.615 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 88.1 m-85 -82.79 -39.46 21.74 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.962 -0.563 . . . . 21.43 111.174 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -69.07 -13.35 62.39 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.381 -0.372 . . . . 23.37 111.007 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 47.63 82.38 0.03 OUTLIER Glycine 0 C--N 1.331 0.256 0 C-N-CA 121.19 -0.528 . . . . 24.32 113.212 179.629 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -133.22 -24.49 1.84 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.846 0.355 . . . . 24.4 110.617 179.579 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 105.84 10.62 30.16 Favored Glycine 0 C--N 1.332 0.321 0 C-N-CA 120.794 -0.717 . . . . 23.47 112.562 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 91.1 mmm -135.37 150.42 49.92 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.805 0.336 . . . . 22.91 110.756 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.531 HG23 ' HB2' ' A' ' 140' ' ' GLU . 46.9 mm -114.83 141.17 32.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.037 0.446 . . . . 18.67 111.486 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . 0.451 ' O ' ' N ' ' A' ' 139' ' ' GLU . 29.2 p-10 -114.78 157.51 23.13 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.002 -0.74 . . . . 16.97 109.002 178.405 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 42.4 t80 -40.59 -21.51 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 111.97 0.359 . . . . 15.28 111.97 -179.754 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . 0.451 ' N ' ' O ' ' A' ' 137' ' ' ASN . 44.2 mt-10 -80.76 -56.76 3.92 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.786 0.327 . . . . 14.82 111.261 -179.615 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . 0.531 ' HB2' HG23 ' A' ' 136' ' ' ILE . 45.5 mt-10 -61.16 -29.82 70.02 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 121.0 0.429 . . . . 17.46 110.102 179.93 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.563 ' HA ' ' HE1' ' A' ' 144' ' ' MET . 83.9 t80 -67.09 -55.52 13.93 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.848 -0.614 . . . . 13.65 110.186 179.403 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . 0.562 ' HA ' HD11 ' A' ' 145' ' ' ILE . 42.9 t -51.42 -30.77 11.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.667 -0.697 . . . . 11.12 111.392 179.811 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 143' ' ' TRP . . . . . 0.462 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 90.3 t90 -70.65 -55.84 7.82 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.496 0.554 . . . . 14.4 112.496 -179.122 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 144' ' ' MET . . . . . 0.641 ' HB3' ' HB1' ' A' ' 128' ' ' ALA . 18.8 ptt? -63.48 -28.79 70.2 Favored 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 113.272 0.842 . . . . 14.63 113.272 -177.771 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 145' ' ' ILE . . . . . 0.562 HD11 ' HA ' ' A' ' 142' ' ' VAL . 42.8 pt -80.76 -35.9 15.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 112.383 0.512 . . . . 11.62 112.383 -179.304 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 146' ' ' SER . . . . . 0.475 ' N ' HG13 ' A' ' 145' ' ' ILE . 42.0 t -60.69 -14.12 18.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.198 0.523 . . . . 8.66 110.432 -179.679 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 147' ' ' GLN . . . . . 0.462 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 4.0 mm-40 -101.04 -16.22 17.19 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.362 -0.835 . . . . 11.87 111.089 -179.053 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 65.1 mttm . . . . . 0 C--O 1.25 1.111 0 CA-C-O 118.296 -0.859 . . . . 13.97 110.829 179.685 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.5 mp . . . . . 0 C--O 1.232 0.149 0 CA-C-O 120.878 0.371 . . . . 2.0 110.961 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.487 ' H ' HE21 ' A' ' 8' ' ' GLN . 6.8 m -90.49 158.89 16.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.034 -0.53 . . . . 1.72 110.565 179.853 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -47.34 -42.83 22.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.709 0.29 . . . . 2.2 111.63 -179.651 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -73.32 -41.41 63.56 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.033 0.444 . . . . 1.35 111.005 -179.476 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . 0.487 HE21 ' H ' ' A' ' 5' ' ' THR . 24.1 mt-30 -63.99 -40.43 96.36 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.833 -0.622 . . . . 2.34 111.001 -179.879 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . 0.48 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 89.2 mt -62.11 -50.79 78.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.117 -0.492 . . . . 1.27 110.628 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.41 -24.81 67.6 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.001 -0.545 . . . . 1.22 111.366 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -69.91 -56.35 7.27 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.39 -0.368 . . . . 2.27 111.939 -179.033 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.48 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 10.5 p90 -78.4 -28.07 46.81 Favored 'General case' 0 C--N 1.332 -0.155 0 C-N-CA 120.603 -0.439 . . . . 0.46 111.009 -179.532 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 21.2 tptm -62.65 -35.62 80.2 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.153 -0.684 . . . . 1.85 109.153 178.669 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.47 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 33.1 t70 -69.44 -50.12 48.66 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 115.706 -0.679 . . . . 0.44 109.179 178.315 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.27 -17.67 54.63 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.68 -0.691 . . . . 1.08 110.574 179.058 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -77.96 -48.21 16.78 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.003 -0.544 . . . . 0.56 110.638 -179.495 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 23.3 m -70.32 -15.85 19.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.146 -0.479 . . . . 1.69 110.532 179.648 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.47 ' HG3' ' O ' ' A' ' 14' ' ' ASP . 73.2 mt-30 -64.01 -44.53 92.3 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.787 -0.642 . . . . 2.23 111.111 179.326 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -90.39 31.16 1.04 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.16 -0.473 . . . . 0.69 111.71 -179.298 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -118.96 70.96 0.84 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.001 0.429 . . . . 0.46 110.4 179.284 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 33.7 mmtp -76.5 -17.63 59.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.866 -0.606 . . . . 2.55 111.205 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -83.05 -10.94 58.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.212 -0.449 . . . . 1.8 110.907 -179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 65.44 14.3 59.72 Favored Glycine 0 C--N 1.33 0.236 0 C-N-CA 120.869 -0.681 . . . . 0.54 112.648 179.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 30.0 p -83.74 11.86 6.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.671 0.272 . . . . 1.1 111.205 -179.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 56.22 18.88 22.3 Favored Glycine 0 C--N 1.332 0.361 0 C-N-CA 120.709 -0.758 . . . . 0.37 111.596 -179.383 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.601 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 51.7 mtpt -135.43 155.26 50.84 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.501 -0.35 . . . . 1.75 110.334 -179.488 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 42.4 pt -120.9 140.65 44.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.871 0.367 . . . . 1.2 111.286 -179.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -57.97 135.95 57.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.153 -0.476 . . . . 1.04 110.612 179.651 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 5.7 t -64.69 -8.56 15.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.19 -0.459 . . . . 1.71 110.994 179.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 43.5 mtt180 -89.76 -11.21 42.89 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.043 -0.526 . . . . 3.53 110.851 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -107.57 -4.58 18.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.92 -0.582 . . . . 2.26 110.908 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.587 HD22 HD23 ' A' ' 63' ' ' LEU . 1.4 tm? -57.72 -51.0 71.32 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.355 -0.384 . . . . 1.95 110.311 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -53.59 -42.71 67.25 Favored Glycine 0 C--N 1.332 0.344 0 C-N-CA 120.617 -0.801 . . . . 0.32 111.692 179.438 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 94.9 m -63.88 -36.07 82.73 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.226 0.536 . . . . 1.01 109.868 179.038 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 38.8 tp -65.94 -24.05 66.74 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.369 -0.832 . . . . 1.85 110.773 -179.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.452 ' HG2' ' O ' ' A' ' 32' ' ' LEU . 79.9 mmm -80.36 -37.87 31.53 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.252 -0.431 . . . . 1.43 110.19 179.346 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 69.6 mtp180 -59.64 -44.34 93.53 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.942 -0.572 . . . . 3.27 110.964 179.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.436 HG21 HD12 ' A' ' 39' ' ' LEU . 1.3 t -64.23 -13.52 49.61 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.235 -0.439 . . . . 1.54 111.321 179.835 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.436 HD12 HG21 ' A' ' 38' ' ' THR . 10.8 mp -113.75 156.14 24.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.115 -0.493 . . . . 1.94 110.412 179.365 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -58.35 -5.69 2.67 Favored Glycine 0 CA--C 1.518 0.255 0 CA-C-N 116.014 -0.539 . . . . 0.69 113.759 -178.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 15.9 mp0 -88.29 130.91 34.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 117.107 0.453 . . . . 1.97 110.972 179.746 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -131.88 87.05 46.06 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.092 -0.503 . . . . 3.44 110.775 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -70.47 151.37 64.98 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 122.511 2.141 . . . . 0.59 112.275 -179.839 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 27.4 m -64.35 150.06 46.99 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.22 -0.445 . . . . 1.28 110.738 179.746 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -48.07 -54.51 12.86 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.562 -0.29 . . . . 2.7 111.336 -179.631 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.57 -53.27 54.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.264 -0.426 . . . . 1.15 111.745 -179.574 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -53.79 -46.03 70.9 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-O 120.938 0.399 . . . . 2.23 110.446 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.486 ' HA ' HD22 ' A' ' 51' ' ' LEU . 32.5 tp -57.27 -42.69 82.12 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.741 -0.663 . . . . 2.01 110.71 179.837 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -68.46 -30.19 69.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.227 -0.442 . . . . 1.68 111.095 -179.8 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -68.45 -53.55 22.81 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.382 -0.372 . . . . 0.62 110.965 179.551 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.539 HD11 HD13 ' A' ' 71' ' ' ILE . 1.0 OUTLIER -65.38 -34.87 79.34 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.318 -0.401 . . . . 1.11 110.979 179.931 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 34.9 mt -59.78 -44.73 94.58 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.134 0 CA-C-N 116.523 -0.308 . . . . 1.25 110.458 179.467 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.68 -32.47 73.81 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.236 -0.438 . . . . 1.24 110.53 179.624 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -66.53 -46.04 77.48 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.007 -0.542 . . . . 2.54 110.178 179.352 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . 0.407 ' HB3' ' HB3' ' A' ' 63' ' ' LEU . . . -76.21 -20.76 57.17 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.014 -0.539 . . . . 1.19 111.078 179.585 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -80.35 -31.74 37.89 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.277 -0.42 . . . . 1.95 110.985 -179.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -91.98 -12.95 31.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.053 -0.522 . . . . 3.19 110.763 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.484 ' C ' HD21 ' A' ' 58' ' ' ASN . 0.2 OUTLIER -81.2 -84.02 0.11 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.098 -0.501 . . . . 2.69 110.785 -179.852 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . 0.583 ' HB3' ' HZ1' ' A' ' 26' ' ' LYS . 15.7 m-80 -101.54 35.97 2.16 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.885 0.374 . . . . 2.05 110.805 -179.914 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.8 m120 62.27 -132.82 0.55 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.883 -0.599 . . . . 1.67 111.116 179.62 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -78.71 29.65 2.04 Favored Glycine 0 C--N 1.334 0.419 0 C-N-CA 120.638 -0.791 . . . . 0.86 112.526 -179.706 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.601 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -145.1 155.32 43.25 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.17 0.51 . . . . 0.49 111.338 179.829 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.587 HD23 HD22 ' A' ' 32' ' ' LEU . 2.1 pp -142.07 157.93 44.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.442 -0.799 . . . . 2.05 109.084 179.529 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . 0.464 ' OD1' ' HE3' ' A' ' 26' ' ' LYS . 0.7 OUTLIER -110.23 157.37 19.51 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.74 -0.384 . . . . 1.52 111.856 -177.411 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -39.28 -33.47 0.15 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.476 -0.784 . . . . 0.46 111.846 -179.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 2.8 m -64.25 -43.9 93.47 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 111.663 0.245 . . . . 1.41 111.663 -179.582 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -61.96 -55.14 32.49 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.853 0.359 . . . . 1.36 110.958 179.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -59.39 -49.7 76.78 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.041 -0.527 . . . . 0.61 111.376 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 6.3 t -61.14 -39.24 89.3 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-O 120.869 0.366 . . . . 1.41 110.692 -179.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . 0.502 ' O ' ' HB2' ' A' ' 73' ' ' ALA . . . -60.08 -42.86 98.65 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.648 -0.787 . . . . 0.41 111.85 179.783 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.539 HD13 HD11 ' A' ' 51' ' ' LEU . 64.8 mt -63.59 -51.23 72.92 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.688 0 CA-C-O 121.657 0.742 . . . . 1.13 109.294 177.997 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' MET . . . . . 0.503 ' O ' ' HB2' ' A' ' 76' ' ' MET . 14.2 mtp -53.73 -29.63 40.36 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.027 -0.988 . . . . 1.24 108.729 178.375 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.502 ' HB2' ' O ' ' A' ' 70' ' ' GLY . . . -72.14 -35.39 69.06 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.12 -0.945 . . . . 1.17 110.623 179.866 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.529 ' HG2' ' O ' ' A' ' 71' ' ' ILE . 0.1 OUTLIER -80.34 -32.83 37.75 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.338 -0.392 . . . . 1.91 111.73 -179.724 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -82.71 -42.72 17.72 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.082 0.468 . . . . 2.03 111.195 -178.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' MET . . . . . 0.503 ' HB2' ' O ' ' A' ' 72' ' ' MET . 80.7 mtp . . . . . 0 C--N 1.324 -0.522 0 CA-C-N 115.574 -0.739 . . . . 1.52 112.005 -179.299 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.501 ' O ' ' HG2' ' A' ' 85' ' ' MET . 3.9 t . . . . . 0 N--CA 1.468 0.432 0 CA-C-O 120.988 0.423 . . . . 7.48 111.298 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -47.32 -24.23 0.72 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.51 -0.768 . . . . 9.74 112.3 -179.138 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -64.14 -55.28 22.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.753 0.311 . . . . 12.11 111.391 -179.78 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -64.03 -18.3 64.19 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.379 -0.373 . . . . 10.87 110.908 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' MET . . . . . 0.521 ' HB3' HD11 ' A' ' 145' ' ' ILE . 4.1 mmm -78.81 -48.03 15.55 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.104 -0.498 . . . . 11.09 110.059 -179.662 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 21.0 ttt180 -55.71 -39.0 70.45 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.517 -0.765 . . . . 16.05 110.134 179.272 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -65.2 -47.66 76.15 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.989 -0.551 . . . . 14.85 110.228 179.158 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -65.57 -24.26 67.05 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.057 -0.52 . . . . 14.11 111.332 179.781 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 86.7 t80 -73.83 -46.91 42.18 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.95 0.405 . . . . 16.42 110.852 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -60.65 -38.31 84.42 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.991 -0.549 . . . . 17.66 110.866 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 67.7 mt -70.98 -46.27 68.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.863 -0.608 . . . . 18.15 111.166 -179.631 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.43 ' HA ' HG21 ' A' ' 108' ' ' VAL . 0.7 OUTLIER -66.96 -26.67 66.94 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.382 -0.372 . . . . 18.34 111.099 -179.885 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 23.7 t0 -96.16 93.92 7.21 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.153 -0.476 . . . . 19.29 110.237 179.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -69.61 -11.46 60.85 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.083 -0.508 . . . . 22.47 111.354 -179.386 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 47.8 m-20 -101.71 167.75 9.9 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.341 -0.391 . . . . 23.34 110.94 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.07 5.18 57.66 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.842 -0.694 . . . . 22.77 112.072 179.513 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -70.84 -31.47 68.19 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.682 0.277 . . . . 23.0 111.267 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 92.37 27.25 15.81 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.686 -0.768 . . . . 20.02 112.519 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 90.1 m-85 -139.47 147.23 41.04 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.498 0.19 . . . . 20.56 110.632 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.449 ' HB ' ' HB ' ' A' ' 136' ' ' ILE . 71.1 mt -113.92 131.37 66.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 121.149 0.5 . . . . 19.37 111.223 179.789 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 79.4 p -114.02 157.8 41.09 Favored Pre-proline 0 C--N 1.326 -0.42 0 CA-C-N 115.509 -0.769 . . . . 22.65 110.049 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_exo -47.94 -31.55 15.9 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.068 1.845 . . . . 23.78 111.676 -179.658 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.57 -36.86 79.33 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.726 -0.67 . . . . 25.0 111.11 179.668 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -80.26 -36.68 34.23 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.938 -0.574 . . . . 22.31 109.889 -179.477 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.574 HD22 ' HB ' ' A' ' 121' ' ' ILE . 5.5 tt -62.12 -43.57 98.54 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.331 -0.85 . . . . 20.62 110.267 179.859 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.436 ' O ' HG13 ' A' ' 110' ' ' ILE . 61.1 ttt180 -65.59 -54.63 25.24 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.933 -0.576 . . . . 27.9 110.89 179.783 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 4.3 m-85 -49.38 -49.46 44.46 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.137 -0.483 . . . . 25.96 111.973 -179.454 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.43 HG21 ' HA ' ' A' ' 92' ' ' PHE . 83.6 t -64.46 -50.72 74.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.695 -0.23 . . . . 21.06 111.557 -179.475 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -53.15 -39.22 63.38 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.741 0.305 . . . . 20.93 110.739 -179.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.436 HG13 ' O ' ' A' ' 106' ' ' ARG . 82.7 mt -70.74 -29.59 38.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 120.999 0.428 . . . . 25.52 110.28 179.329 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -71.13 -39.73 71.83 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.828 -0.624 . . . . 23.32 110.741 179.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.422 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 38.2 mt -65.33 -32.57 74.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.043 -0.526 . . . . 21.07 110.664 179.879 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 126.87 -11.98 6.92 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.828 -0.701 . . . . 23.25 112.271 -179.854 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -91.06 114.49 27.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.743 0.306 . . . . 22.59 111.127 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.441 ' HD3' ' N ' ' A' ' 115' ' ' LYS . 3.8 mppt? -84.08 125.65 32.32 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.225 -0.443 . . . . 28.21 110.779 179.848 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . 0.444 HG12 ' OE1' ' A' ' 120' ' ' GLU . 2.4 m -135.57 147.27 28.79 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.241 -0.436 . . . . 24.75 111.44 -179.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' THR . . . . . 0.432 ' HG1' ' HG2' ' A' ' 120' ' ' GLU . 82.2 p -87.99 147.24 25.11 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.935 -0.575 . . . . 27.5 110.198 179.105 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -53.64 -19.93 4.63 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.259 -0.428 . . . . 27.03 111.576 -179.529 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 23.1 mm-40 -77.61 -55.69 5.15 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.01 0.374 . . . . 29.14 112.01 -179.264 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . 0.444 ' OE1' HG12 ' A' ' 116' ' ' VAL . 14.6 pt-20 -58.47 -41.69 85.82 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.636 0.255 . . . . 24.7 111.563 -179.306 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.574 ' HB ' HD22 ' A' ' 105' ' ' LEU . 45.7 pt -70.74 -33.59 53.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 C-N-CA 120.903 -0.319 . . . . 22.9 110.749 179.67 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -56.03 -50.98 69.41 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 120.768 0.318 . . . . 24.29 110.617 179.401 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.55 -43.35 99.02 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.204 -0.453 . . . . 24.74 110.736 179.797 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 51.0 ttp -54.66 -38.6 67.13 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.174 -0.466 . . . . 20.15 110.915 179.65 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.481 HG23 HD11 ' A' ' 136' ' ' ILE . 85.0 mt -68.47 -37.07 77.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.232 -0.44 . . . . 20.23 110.742 179.682 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 70.3 ttt180 -65.94 -30.08 70.59 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.155 -0.475 . . . . 25.57 110.637 179.677 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -74.67 -24.86 58.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.077 -0.511 . . . . 19.18 111.173 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.556 ' HB1' ' HB3' ' A' ' 144' ' ' MET . . . -100.58 -13.63 18.52 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.183 -0.462 . . . . 16.88 111.118 179.855 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -97.14 105.31 17.43 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.052 -0.522 . . . . 20.4 110.931 -179.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 -97.96 -33.94 11.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.931 -0.577 . . . . 21.43 111.153 -179.651 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -66.02 -13.86 60.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.365 -0.38 . . . . 23.37 110.777 -179.835 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.13 85.31 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.834 -0.698 . . . . 24.32 112.521 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -153.8 -19.53 0.14 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.661 0.267 . . . . 24.4 111.475 -179.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 87.21 16.25 61.09 Favored Glycine 0 N--CA 1.453 -0.211 0 C-N-CA 120.67 -0.776 . . . . 23.47 112.6 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 70.3 mtp -132.72 155.54 48.65 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.625 0.25 . . . . 22.91 110.539 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.481 HD11 HG23 ' A' ' 125' ' ' ILE . 50.5 mm -114.61 138.65 44.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.367 0.604 . . . . 18.67 112.076 -179.238 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . 0.48 ' N ' HG22 ' A' ' 136' ' ' ILE . 21.8 p30 -115.5 159.06 21.69 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.194 -0.912 . . . . 16.97 108.644 177.893 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 47.0 t80 -38.21 -24.67 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 112.416 0.524 . . . . 15.28 112.416 -178.789 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . 0.472 ' N ' ' O ' ' A' ' 137' ' ' ASN . 47.2 mt-10 -80.44 -55.27 5.0 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.742 0.306 . . . . 14.82 111.19 -179.636 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -60.69 -28.4 68.6 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.319 -0.4 . . . . 17.46 110.738 -179.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.589 ' HA ' ' HE3' ' A' ' 144' ' ' MET . 86.5 t80 -72.46 -56.12 5.93 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.292 -0.413 . . . . 13.65 110.703 179.841 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . 0.419 HG22 ' CB ' ' A' ' 85' ' ' MET . 50.3 t -48.32 -37.01 7.09 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 CA-C-N 115.939 -0.573 . . . . 11.12 111.589 179.478 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 143' ' ' TRP . . . . . 0.491 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 92.7 t90 -71.11 -55.58 7.91 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.296 0.48 . . . . 14.4 112.296 -178.872 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 144' ' ' MET . . . . . 0.589 ' HE3' ' HA ' ' A' ' 141' ' ' PHE . 22.8 ptt? -63.11 -24.38 67.87 Favored 'General case' 0 N--CA 1.464 0.237 0 N-CA-C 112.957 0.725 . . . . 14.63 112.957 -177.808 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 145' ' ' ILE . . . . . 0.521 HD11 ' HB3' ' A' ' 85' ' ' MET . 48.6 pt -80.73 -40.48 19.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 N-CA-C 112.182 0.438 . . . . 11.62 112.182 -179.513 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 146' ' ' SER . . . . . 0.505 ' N ' HG13 ' A' ' 145' ' ' ILE . 86.4 p -59.38 -13.61 9.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.275 0.559 . . . . 8.66 110.436 -179.759 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 147' ' ' GLN . . . . . 0.491 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 4.4 mm-40 -105.34 26.71 9.08 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.304 -0.862 . . . . 11.87 111.529 -178.692 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . 0.618 ' HZ2' ' HB2' ' A' ' 148' ' ' LYS . 9.6 mtmp? . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.158 -0.925 . . . . 13.97 110.721 179.593 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 20.1 mt . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.851 0.358 . . . . 2.0 110.806 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 6.2 m -84.0 158.99 21.31 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.139 -0.482 . . . . 1.72 110.801 -179.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -47.63 -30.84 4.0 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 111.818 0.303 . . . . 2.2 111.818 -179.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.4 ' HG3' ' N ' ' A' ' 8' ' ' GLN . 11.0 pt-20 -76.58 -51.29 11.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.947 0.403 . . . . 1.35 110.916 -179.567 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . 0.4 ' N ' ' HG3' ' A' ' 7' ' ' GLU . 26.1 mt-30 -63.18 -36.08 82.44 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.025 -0.534 . . . . 2.34 110.682 179.924 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . 0.541 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 97.1 mt -62.68 -52.09 63.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.959 -0.564 . . . . 1.27 110.65 179.859 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.25 -26.48 67.78 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.888 -0.596 . . . . 1.22 111.4 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -69.61 -56.93 5.91 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 111.889 0.329 . . . . 2.27 111.889 -179.161 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.541 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 4.1 p90 -76.47 -23.6 53.83 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 120.54 -0.464 . . . . 0.46 110.92 -179.557 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.427 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 18.1 tptm -66.33 -35.59 80.76 Favored 'General case' 0 C--N 1.332 -0.163 0 N-CA-C 109.145 -0.687 . . . . 1.85 109.145 178.911 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.423 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 23.5 t70 -68.03 -49.82 59.1 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 108.777 -0.823 . . . . 0.44 108.777 177.995 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.28 -13.95 52.82 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.303 -0.862 . . . . 1.08 110.453 178.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.428 ' HA ' HD11 ' A' ' 35' ' ' LEU . 83.4 t80 -79.65 -48.9 12.96 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.842 -0.617 . . . . 0.56 110.823 -179.629 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 19.7 m -67.89 -20.88 26.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 120.974 0.416 . . . . 1.69 110.415 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.423 ' HG2' ' O ' ' A' ' 14' ' ' ASP . 77.6 mm-40 -60.36 -32.82 71.63 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.827 -0.624 . . . . 2.23 111.455 179.334 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 82.3 m-85 -93.93 4.02 54.52 Favored 'General case' 0 N--CA 1.463 0.191 0 N-CA-C 111.721 0.267 . . . . 0.69 111.721 -179.578 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -101.79 87.21 3.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.002 0.43 . . . . 0.46 110.672 179.672 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -97.4 -15.0 20.88 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.9 -0.591 . . . . 2.55 111.322 -179.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -83.58 1.14 43.58 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.225 -0.443 . . . . 1.8 111.365 -179.547 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 63.67 16.07 58.43 Favored Glycine 0 C--N 1.331 0.268 0 C-N-CA 120.987 -0.625 . . . . 0.54 113.032 179.645 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 46.1 p -92.65 8.34 39.55 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.642 0.258 . . . . 1.1 111.124 179.838 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 57.1 18.19 26.35 Favored Glycine 0 C--N 1.331 0.304 0 C-N-CA 120.823 -0.703 . . . . 0.37 111.822 -179.677 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.456 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 35.7 mtpt -127.4 155.54 43.47 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.82 0.343 . . . . 1.75 111.06 -179.512 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 43.6 pt -116.67 134.72 59.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.272 -0.422 . . . . 1.2 111.601 -179.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -53.47 138.91 32.49 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.083 -0.508 . . . . 1.04 111.282 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.446 ' HG1' ' HB1' ' A' ' 55' ' ' ALA . 7.7 t -68.98 -5.39 21.35 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.073 -0.512 . . . . 1.71 111.161 -179.901 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 49.6 mtp180 -97.53 4.93 50.22 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.954 -0.566 . . . . 3.53 110.385 179.717 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -128.7 -1.49 5.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.864 -0.607 . . . . 2.26 110.824 -179.862 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -55.3 -54.15 47.11 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.158 -0.474 . . . . 1.95 110.495 179.834 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.41 ' O ' ' HG3' ' A' ' 37' ' ' ARG . . . -56.01 -42.25 86.59 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.578 -0.82 . . . . 0.32 111.815 179.433 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 56.6 m -55.63 -37.19 67.86 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.023 0.44 . . . . 1.01 110.256 179.291 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.428 HD11 ' HA ' ' A' ' 16' ' ' PHE . 1.2 tt -65.36 -36.23 83.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.681 -0.69 . . . . 1.85 110.031 179.386 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.495 ' SD ' ' HG3' ' A' ' 43' ' ' PRO . 25.1 mtp -78.2 -20.35 52.04 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.788 -0.642 . . . . 1.43 110.853 179.887 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.41 ' HG3' ' O ' ' A' ' 33' ' ' GLY . 62.3 mtp180 -77.57 -38.52 48.28 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.315 -0.402 . . . . 3.27 110.498 179.527 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.5 t -71.39 -13.31 61.81 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.222 -0.444 . . . . 1.54 110.943 179.588 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.43 ' HB3' ' OE1' ' A' ' 41' ' ' GLN . 10.9 mp -113.28 156.23 23.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.096 -0.502 . . . . 1.94 110.701 179.691 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -49.5 -20.69 2.67 Favored Glycine 0 CA--C 1.521 0.46 0 CA-C-N 115.679 -0.691 . . . . 0.69 114.303 -178.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.644 ' HG2' HE22 ' A' ' 75' ' ' GLN . 20.0 mp0 -60.78 139.06 58.04 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 117.382 0.591 . . . . 1.97 111.09 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 74.9 m-20 -130.97 78.51 73.32 Favored Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 116.179 -0.464 . . . . 3.44 110.966 179.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . 0.495 ' HG3' ' SD ' ' A' ' 36' ' ' MET . 59.9 Cg_endo -68.97 147.59 68.3 Favored 'Trans proline' 0 C--N 1.343 0.259 0 C-N-CA 122.767 2.311 . . . . 0.59 112.256 179.757 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 63.5 m -68.9 143.34 54.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.339 -0.391 . . . . 1.28 110.59 179.505 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.451 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 8.9 tp10 -47.93 -55.32 10.2 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.612 0.244 . . . . 2.7 111.051 -179.601 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -55.09 -45.08 75.41 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.296 -0.411 . . . . 1.15 111.164 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -53.27 -53.8 45.49 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.278 -0.419 . . . . 2.23 110.704 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.432 ' HA ' HD22 ' A' ' 51' ' ' LEU . 12.3 mt -56.6 -38.14 71.62 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.313 -0.403 . . . . 2.01 110.47 179.44 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.451 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 84.0 mm-40 -67.25 -27.17 66.99 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.394 -0.366 . . . . 1.68 110.585 179.603 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 38.5 m-20 -77.35 -55.35 5.48 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.207 -0.451 . . . . 0.62 111.8 -179.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.547 HD13 HD12 ' A' ' 71' ' ' ILE . 1.1 pp -65.8 -35.88 81.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.497 -0.319 . . . . 1.11 111.8 -179.19 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 82.6 mt -71.21 -43.22 74.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.698 0.285 . . . . 1.25 111.016 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.58 -49.94 71.39 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.406 -0.361 . . . . 1.24 111.0 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -58.91 -36.15 74.23 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.892 0.377 . . . . 2.54 110.072 179.474 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . 0.446 ' HB1' ' HG1' ' A' ' 29' ' ' THR . . . -76.23 -19.63 58.18 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.077 -0.511 . . . . 1.19 110.767 179.217 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -79.16 -31.21 43.91 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.164 -0.471 . . . . 1.95 110.802 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 14.4 m120 -111.5 41.75 1.83 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.145 -0.48 . . . . 3.19 110.875 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.445 ' C ' HD21 ' A' ' 58' ' ' ASN . 0.2 OUTLIER -158.03 -63.42 0.09 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.076 -0.511 . . . . 2.69 110.519 179.985 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 25.2 m-80 -87.42 23.1 1.98 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.122 -0.49 . . . . 2.05 110.803 179.827 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 11.3 m120 66.27 -76.69 0.05 OUTLIER 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.009 -0.541 . . . . 1.67 111.086 -179.814 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -165.15 21.01 0.12 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.842 -0.694 . . . . 0.86 112.373 179.767 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.456 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -132.14 155.22 48.56 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.982 0.42 . . . . 0.49 111.406 -179.814 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 24.1 mt -123.88 152.38 42.43 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.837 -0.619 . . . . 2.05 110.403 179.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 19.9 m-80 -113.2 157.77 21.29 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.884 0.373 . . . . 1.52 111.132 -179.757 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -42.3 -37.71 1.6 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.67 -0.695 . . . . 0.46 111.158 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -72.32 -38.96 68.56 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.206 -0.452 . . . . 1.41 111.544 179.8 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -58.07 -51.2 70.66 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.026 0.441 . . . . 1.36 110.4 179.744 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.449 ' HE2' ' HB2' ' A' ' 12' ' ' PHE . 29.5 t80 -67.1 -46.83 73.03 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.739 -0.664 . . . . 0.61 110.797 179.904 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 10.6 m -55.12 -50.82 68.29 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.148 -0.478 . . . . 1.41 111.038 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -52.82 -52.4 39.1 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.891 -0.671 . . . . 0.41 112.007 179.799 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.547 HD12 HD13 ' A' ' 51' ' ' LEU . 70.2 mt -58.24 -50.28 78.95 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.601 0 CA-C-O 120.967 0.413 . . . . 1.13 110.8 179.204 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 2.3 mtp -43.39 -37.63 2.39 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.569 -0.741 . . . . 1.24 110.819 179.625 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.27 -55.28 10.98 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.118 -0.492 . . . . 1.17 111.133 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.519 ' HE2' HG22 ' A' ' 71' ' ' ILE . 57.7 pttt -59.8 -30.26 68.79 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.963 -0.562 . . . . 1.91 111.411 -179.389 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . 0.644 HE22 ' HG2' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -81.59 -46.46 14.39 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.289 -0.414 . . . . 2.03 111.919 -179.369 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 32.4 mtt . . . . . 0 N--CA 1.452 -0.356 0 CA-C-N 116.328 -0.396 . . . . 1.52 111.632 -179.431 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.52 ' O ' ' HG2' ' A' ' 85' ' ' MET . 1.7 t . . . . . 0 N--CA 1.466 0.339 0 CA-C-O 120.972 0.415 . . . . 7.48 110.723 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.425 ' HB3' ' HH ' ' A' ' 138' ' ' TYR . 43.8 mt-10 -49.34 -19.88 0.58 Allowed 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 113.353 0.871 . . . . 9.74 113.353 -178.221 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -62.28 -55.87 24.05 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 120.992 0.425 . . . . 12.11 111.461 -179.423 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -69.63 -16.01 63.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.131 -0.486 . . . . 10.87 111.17 -179.525 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' MET . . . . . 0.527 ' HB3' HD13 ' A' ' 145' ' ' ILE . 2.8 mmm -82.61 -32.12 28.53 Favored 'General case' 0 CA--C 1.508 -0.639 0 CA-C-O 121.979 0.895 . . . . 11.09 108.84 -179.24 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 25.9 tpt180 -64.67 -50.12 68.28 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 113.655 -1.611 . . . . 16.05 110.037 179.404 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -65.54 -37.09 85.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.8 -0.636 . . . . 14.85 110.195 179.164 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.79 -31.13 69.92 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.973 -0.558 . . . . 14.11 111.128 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 87.6 t80 -68.04 -39.59 83.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.137 0.494 . . . . 16.42 110.373 179.789 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 65.7 mttm -65.83 -39.51 90.88 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.543 -0.753 . . . . 17.66 110.918 179.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 78.2 mt -70.46 -45.43 74.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.059 -0.518 . . . . 18.15 111.59 -179.755 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -67.51 -55.46 13.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.452 -0.34 . . . . 18.34 111.511 -179.503 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 27.9 t0 -58.35 109.14 0.72 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.879 0.371 . . . . 19.29 110.523 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.5 ' HG2' ' HB3' ' A' ' 104' ' ' GLU . 22.4 mmm180 -57.88 -37.0 73.18 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.967 -0.56 . . . . 22.47 111.129 -179.464 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . 0.412 ' HB2' ' OD1' ' A' ' 97' ' ' ASP . 0.3 OUTLIER -107.8 176.46 5.14 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.22 -0.445 . . . . 23.34 110.784 -179.78 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.03 5.34 57.79 Favored Glycine 0 N--CA 1.449 -0.433 0 C-N-CA 120.896 -0.668 . . . . 22.77 112.157 179.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.426 ' OD2' ' HB2' ' A' ' 99' ' ' PHE . 11.6 p-10 -58.8 -38.79 79.38 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.808 0.337 . . . . 23.0 110.98 -179.875 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 105.21 28.15 5.62 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.858 -0.687 . . . . 20.02 113.076 179.427 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . 0.426 ' HB2' ' OD2' ' A' ' 97' ' ' ASP . 59.8 m-85 -145.39 139.06 26.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.012 0.435 . . . . 20.56 111.622 179.89 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.408 ' HB ' ' HB ' ' A' ' 136' ' ' ILE . 84.3 mt -114.84 124.59 71.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 115.774 -0.648 . . . . 19.37 110.619 179.414 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 58.4 m -114.21 156.55 44.1 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.154 -0.475 . . . . 22.65 110.958 -179.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -41.25 -32.54 1.18 Allowed 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 122.723 2.282 . . . . 23.78 112.181 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.55 -51.08 62.53 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.1 0.476 . . . . 25.0 110.531 179.299 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . 0.5 ' HB3' ' HG2' ' A' ' 94' ' ' ARG . 45.0 mt-10 -69.57 -26.99 64.75 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.674 -0.694 . . . . 22.31 110.875 179.851 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.586 HD12 ' HE1' ' A' ' 124' ' ' MET . 5.8 tt -69.13 -55.83 9.51 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.333 -0.394 . . . . 20.62 111.161 -179.583 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.411 ' O ' HG13 ' A' ' 110' ' ' ILE . 7.1 ppt_? -62.49 -30.57 71.36 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.034 0.445 . . . . 27.9 110.597 -179.679 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -74.19 -36.59 64.02 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.785 -0.643 . . . . 25.96 112.043 -179.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.483 HG13 ' O ' ' A' ' 105' ' ' LEU . 7.2 p -80.0 -44.88 22.85 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 N-CA-C 111.947 0.351 . . . . 21.06 111.947 -179.352 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 12.0 mmt -52.69 -38.98 61.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.49 -0.323 . . . . 20.93 111.429 -179.587 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.411 HG13 ' O ' ' A' ' 106' ' ' ARG . 89.6 mt -65.65 -34.48 70.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.843 0.354 . . . . 25.52 110.538 179.488 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 69.7 m-20 -65.64 -22.93 66.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.09 -0.505 . . . . 23.32 110.444 179.559 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 7.5 mt -88.42 -27.87 21.28 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.954 -0.566 . . . . 21.07 110.531 179.722 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 106.22 10.8 29.02 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.896 -0.668 . . . . 23.25 112.217 -179.741 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -74.61 -34.86 62.9 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.65 0.262 . . . . 22.59 111.306 -179.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 57.3 tptt 53.85 90.69 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.119 -0.491 . . . . 28.21 110.76 -179.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . 0.401 ' HB ' HG22 ' A' ' 121' ' ' ILE . 3.3 m -124.23 156.33 31.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.919 -0.582 . . . . 24.75 111.698 -179.525 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' THR . . . . . 0.426 ' O ' HG12 ' A' ' 121' ' ' ILE . 61.9 p -99.22 147.16 25.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.696 -0.683 . . . . 27.5 110.272 179.676 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . 0.412 ' O ' ' HB2' ' A' ' 122' ' ' ASP . 14.8 m-20 -53.55 -17.67 2.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.258 -0.428 . . . . 27.03 111.439 -179.593 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -79.93 -55.71 4.77 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.739 0.304 . . . . 29.14 111.381 -179.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -61.79 -35.03 76.99 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.412 -0.358 . . . . 24.7 111.44 -179.539 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.46 ' O ' HG13 ' A' ' 125' ' ' ILE . 7.4 pt -78.01 -33.52 18.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 C-N-CA 120.976 -0.289 . . . . 22.9 111.174 -179.909 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . 0.428 ' N ' HG13 ' A' ' 121' ' ' ILE . 12.7 t70 -55.85 -44.83 78.37 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.598 -0.519 . . . . 24.29 109.598 178.819 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -67.66 -42.59 81.95 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.621 -0.718 . . . . 24.74 110.214 179.073 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' MET . . . . . 0.586 ' HE1' HD12 ' A' ' 105' ' ' LEU . 54.7 ttp -58.1 -37.06 73.82 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.026 -0.533 . . . . 20.15 110.99 179.643 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.46 HG13 ' O ' ' A' ' 121' ' ' ILE . 77.3 mt -65.87 -45.32 91.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.278 -0.419 . . . . 20.23 110.38 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 61.3 ttt180 -58.68 -38.05 77.38 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.81 -0.632 . . . . 25.57 111.089 179.753 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -63.01 -28.12 69.89 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.205 -0.452 . . . . 19.18 111.076 -179.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.513 ' HB1' ' HB3' ' A' ' 144' ' ' MET . . . -103.44 -6.61 21.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.259 -0.428 . . . . 16.88 111.038 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 54.4 t0 -109.34 100.96 10.0 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.15 -0.477 . . . . 20.4 111.071 -179.583 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 92.6 m-85 -70.38 -48.82 54.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.948 -0.569 . . . . 21.43 111.018 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -64.99 -21.85 66.91 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.182 -0.463 . . . . 23.37 110.863 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 55.26 55.51 28.01 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.941 -0.647 . . . . 24.32 112.698 179.74 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -101.73 -7.07 22.93 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.826 0.346 . . . . 24.4 110.765 179.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 89.93 9.49 65.85 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.844 -0.693 . . . . 23.47 112.305 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 68.3 mtp -134.93 154.38 51.71 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.843 0.354 . . . . 22.91 110.835 -179.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.554 HG21 ' HB2' ' A' ' 140' ' ' GLU . 27.8 mm -114.87 144.0 23.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.1 -0.5 . . . . 18.67 111.812 -179.516 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . 0.485 HD21 ' H ' ' A' ' 139' ' ' GLU . 6.3 t30 -114.59 157.15 23.43 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.43 -0.805 . . . . 16.97 108.993 178.437 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . 0.425 ' HH ' ' HB3' ' A' ' 82' ' ' GLU . 39.4 t80 -40.85 -24.08 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 111.821 0.304 . . . . 15.28 111.821 -179.828 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . 0.485 ' H ' HD21 ' A' ' 137' ' ' ASN . 10.6 mm-40 -80.8 -56.25 4.26 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 120.818 0.342 . . . . 14.82 110.983 -179.359 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . 0.554 ' HB2' HG21 ' A' ' 136' ' ' ILE . 39.5 mt-10 -59.09 -29.45 67.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.134 0.492 . . . . 17.46 109.892 179.539 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.441 ' CZ ' HG21 ' A' ' 145' ' ' ILE . 86.5 t80 -66.37 -55.41 16.0 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.585 -0.734 . . . . 13.65 109.834 179.141 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . 0.411 HG12 ' HG3' ' A' ' 85' ' ' MET . 55.3 t -47.67 -36.53 5.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.65 -0.704 . . . . 11.12 111.273 179.022 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 79.4 t90 -67.81 -55.97 10.98 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.833 0.679 . . . . 14.4 112.833 -178.656 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 144' ' ' MET . . . . . 0.513 ' HB3' ' HB1' ' A' ' 128' ' ' ALA . 15.5 ptt? -65.72 -28.72 69.26 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 113.348 0.87 . . . . 14.63 113.348 -177.564 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 145' ' ' ILE . . . . . 0.529 ' O ' ' HG2' ' A' ' 148' ' ' LYS . 49.2 pt -73.19 -42.05 58.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 C-N-CA 120.832 -0.347 . . . . 11.62 111.763 -179.388 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 146' ' ' SER . . . . . 0.52 ' N ' HG13 ' A' ' 145' ' ' ILE . 79.0 p -64.6 -13.03 51.52 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.227 0.536 . . . . 8.66 109.845 179.374 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 11.1 mm-40 -122.11 13.1 10.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.265 -0.88 . . . . 11.87 111.839 -178.355 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . 0.529 ' HG2' ' O ' ' A' ' 145' ' ' ILE . 19.2 pttp . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.162 -0.923 . . . . 13.97 110.914 179.611 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.439 HD12 ' SG ' ' A' ' 69' ' ' CYS . 56.2 mt . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.754 0.311 . . . . 2.0 110.674 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 58.8 p -80.02 -170.71 2.58 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.261 -0.427 . . . . 1.72 111.423 -179.679 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -66.15 -46.79 76.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.277 -0.42 . . . . 2.2 111.259 -179.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -71.9 -38.81 69.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.235 -0.439 . . . . 1.35 110.947 -179.519 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 15.9 mm100 -64.64 -44.38 90.65 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.108 -0.496 . . . . 2.34 110.676 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . 0.506 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 45.7 mt -59.35 -50.47 79.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.376 -0.374 . . . . 1.27 110.484 179.598 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.89 -19.78 65.79 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.111 -0.495 . . . . 1.22 111.08 179.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -71.44 -56.2 6.42 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.231 -0.44 . . . . 2.27 111.887 -178.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.506 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 20.1 p90 -78.67 -27.96 45.24 Favored 'General case' 0 C--N 1.333 -0.122 0 C-N-CA 120.565 -0.454 . . . . 0.46 110.863 -179.823 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 27.3 tptp -61.83 -37.65 85.23 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.272 -0.64 . . . . 1.85 109.272 178.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -69.39 -49.93 50.82 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.719 -0.673 . . . . 0.44 109.488 178.483 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.26 -14.82 42.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.617 -0.72 . . . . 1.08 110.79 179.389 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 47.3 t80 -80.5 -51.84 8.32 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.975 -0.557 . . . . 0.56 110.863 -179.61 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 13.6 m -66.1 -19.55 25.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.091 0.472 . . . . 1.69 110.629 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 73.5 mm-40 -65.22 -21.8 66.8 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.648 -0.706 . . . . 2.23 111.37 179.588 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 -110.85 12.34 22.34 Favored 'General case' 0 N--CA 1.462 0.174 0 N-CA-C 112.026 0.38 . . . . 0.69 112.026 -179.499 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -100.96 92.55 5.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.023 0.44 . . . . 0.46 110.716 179.483 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -99.7 -1.13 38.66 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.885 -0.598 . . . . 2.55 111.222 -179.883 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -95.29 -23.19 17.33 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.186 -0.461 . . . . 1.8 111.465 -179.299 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.1 7.21 87.69 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.831 -0.7 . . . . 0.54 112.796 179.784 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 24.3 p -84.53 17.36 2.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.589 0.233 . . . . 1.1 111.172 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 57.48 18.0 28.27 Favored Glycine 0 C--N 1.332 0.332 0 C-N-CA 120.718 -0.753 . . . . 0.37 111.841 -179.475 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.641 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 44.8 mtpt -136.82 154.71 50.45 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.598 -0.301 . . . . 1.75 110.444 -179.443 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 44.1 pt -119.68 135.45 59.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 120.612 0.244 . . . . 1.2 111.048 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -49.17 132.12 19.54 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.499 -0.319 . . . . 1.04 110.894 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 5.9 t -61.03 -17.05 50.19 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.129 -0.487 . . . . 1.71 111.019 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 69.3 mtt180 -79.23 -2.67 42.22 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.826 -0.625 . . . . 3.53 110.653 179.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -116.83 -8.8 11.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.79 -0.641 . . . . 2.26 110.799 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -55.64 -48.09 75.55 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.155 -0.475 . . . . 1.95 110.228 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.46 ' HA2' HD12 ' A' ' 48' ' ' LEU . . . -56.1 -41.34 85.44 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.503 -0.856 . . . . 0.32 111.485 179.28 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 77.3 m -65.54 -28.91 69.51 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.066 0.46 . . . . 1.01 110.314 179.069 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.83 -35.07 72.31 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.751 -0.659 . . . . 1.85 110.593 -179.982 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.442 ' SD ' ' HG3' ' A' ' 43' ' ' PRO . 26.7 mtp -80.27 -21.62 42.53 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.224 -0.444 . . . . 1.43 110.648 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -77.0 -37.33 55.3 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.069 -0.514 . . . . 3.27 110.224 179.277 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 5.9 t -73.41 -12.17 60.72 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.802 -0.636 . . . . 1.54 110.636 179.266 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 65.5 mt -111.86 155.71 23.18 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.798 -0.637 . . . . 1.94 110.366 -179.895 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -50.73 -18.12 2.49 Favored Glycine 0 CA--C 1.52 0.352 0 CA-C-N 115.929 -0.578 . . . . 0.69 114.358 -178.737 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 26.7 mp0 -65.54 141.61 58.4 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 117.354 0.577 . . . . 1.97 111.352 -179.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 48.9 m-80 -129.29 72.65 81.96 Favored Pre-proline 0 C--N 1.331 -0.225 0 CA-C-N 116.196 -0.456 . . . . 3.44 110.857 179.393 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . 0.442 ' HG3' ' SD ' ' A' ' 36' ' ' MET . 29.4 Cg_endo -60.83 148.96 90.54 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.719 2.28 . . . . 0.59 112.309 179.806 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 32.3 m -77.34 150.02 35.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.167 -0.469 . . . . 1.28 110.6 179.565 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -49.41 -55.23 13.79 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.573 0.225 . . . . 2.7 111.483 -179.556 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -55.89 -42.79 76.49 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.443 -0.344 . . . . 1.15 111.735 -179.497 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -62.29 -53.89 48.62 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.375 -0.375 . . . . 2.23 110.95 -179.57 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.46 HD12 ' HA2' ' A' ' 33' ' ' GLY . 14.5 tp -55.57 -42.22 74.42 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.009 -0.541 . . . . 2.01 111.168 -179.745 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 85.2 mm-40 -69.27 -32.13 71.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.47 -0.332 . . . . 1.68 111.281 -179.686 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 76.6 m-20 -70.62 -51.5 27.7 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.527 -0.306 . . . . 0.62 111.638 -179.727 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.447 HD23 ' HA ' ' A' ' 48' ' ' LEU . 1.8 pp -65.85 -41.16 92.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.624 -0.262 . . . . 1.11 111.508 -179.516 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 60.5 mt -62.79 -49.2 84.65 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-O 120.808 0.337 . . . . 1.25 110.477 179.51 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.77 -34.19 76.73 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.214 -0.448 . . . . 1.24 110.381 179.471 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -63.85 -50.22 69.7 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.008 -0.542 . . . . 2.54 110.145 179.305 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -71.99 -14.59 61.93 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.93 -0.577 . . . . 1.19 110.984 179.446 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -68.99 -55.4 10.98 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.303 -0.408 . . . . 1.95 111.301 -179.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 7.6 p30 -97.03 48.58 1.05 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.033 0.444 . . . . 3.19 111.083 -179.757 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 10.4 m120 -156.21 -41.31 0.08 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.721 -0.672 . . . . 2.69 110.719 179.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 21.6 m-80 -115.17 23.33 12.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.967 -0.56 . . . . 2.05 110.694 179.866 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 12.3 m120 65.87 -78.21 0.04 OUTLIER 'General case' 0 C--O 1.232 0.178 0 CA-C-N 115.869 -0.605 . . . . 1.67 111.052 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -159.24 23.21 0.3 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.671 -0.776 . . . . 0.86 112.729 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.641 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -126.93 155.19 43.47 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.348 0.594 . . . . 0.49 111.639 -179.938 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.506 HD11 ' N ' ' A' ' 64' ' ' ASN . 1.2 tm? -121.97 148.25 45.03 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.108 -0.951 . . . . 2.05 109.002 -179.714 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . 0.506 ' N ' HD11 ' A' ' 63' ' ' LEU . 0.1 OUTLIER -111.35 155.67 22.75 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.587 -0.445 . . . . 1.52 111.965 -178.561 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.457 ' O ' ' HB2' ' A' ' 69' ' ' CYS . 70.0 t80 -51.99 -31.52 29.83 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.638 -0.71 . . . . 0.46 110.713 179.491 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -77.13 -36.6 55.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.327 -0.397 . . . . 1.41 111.868 -179.914 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -63.68 -46.46 85.44 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 110.043 -0.354 . . . . 1.36 110.043 179.767 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.435 ' HE2' ' HB2' ' A' ' 12' ' ' PHE . 31.0 t80 -68.44 -51.52 42.76 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.183 -0.462 . . . . 0.61 110.472 179.263 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.457 ' HB2' ' O ' ' A' ' 65' ' ' PHE . 2.1 t -53.43 -45.86 69.57 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-O 120.945 0.402 . . . . 1.41 110.121 179.739 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -52.61 -51.27 44.84 Favored Glycine 0 N--CA 1.448 -0.542 0 CA-C-N 115.666 -0.697 . . . . 0.41 111.68 179.463 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.468 ' HA ' ' HG2' ' A' ' 74' ' ' LYS . 13.0 mt -61.9 -39.44 83.57 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.316 0 CA-C-O 121.026 0.441 . . . . 1.13 110.602 179.429 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 3.4 mtp -57.88 -30.21 65.66 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.802 -0.635 . . . . 1.24 110.096 179.618 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.25 -45.72 65.87 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.965 -0.561 . . . . 1.17 110.799 179.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.468 ' HG2' ' HA ' ' A' ' 71' ' ' ILE . 58.2 pttt -75.52 -25.46 57.26 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.194 -0.457 . . . . 1.91 111.767 -179.667 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . 0.446 HE21 ' HB2' ' A' ' 75' ' ' GLN . 4.4 tt0 -82.53 -43.95 16.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.056 0.455 . . . . 2.03 110.851 -179.533 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' MET . . . . . 0.405 ' SD ' HD23 ' A' ' 4' ' ' LEU . 29.0 mtt . . . . . 0 C--N 1.325 -0.472 0 CA-C-N 115.787 -0.642 . . . . 1.52 111.41 179.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.547 ' O ' ' HG3' ' A' ' 85' ' ' MET . 61.9 m . . . . . 0 N--CA 1.469 0.501 0 N-CA-C 111.993 0.368 . . . . 7.48 111.993 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.441 ' HA ' ' SD ' ' A' ' 85' ' ' MET . 38.6 tt0 -44.88 -41.73 7.39 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.002 -0.544 . . . . 9.74 112.456 -179.163 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -55.92 -54.02 49.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.786 0.327 . . . . 12.11 111.623 -179.372 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -63.24 -18.75 63.89 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.305 -0.407 . . . . 10.87 111.386 -179.467 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' MET . . . . . 0.547 ' HG3' ' O ' ' A' ' 81' ' ' THR . 6.6 mtp -74.74 -35.62 62.62 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-O 121.185 0.517 . . . . 11.09 109.894 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 15.9 ttm180 -68.63 -51.46 41.97 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.542 -0.754 . . . . 16.05 110.295 179.457 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.413 ' HA ' ' HD3' ' A' ' 90' ' ' LYS . 16.2 mm-40 -58.41 -39.16 78.98 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.11 -0.496 . . . . 14.85 110.501 179.32 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -69.87 -33.02 71.68 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.006 -0.543 . . . . 14.11 110.568 179.543 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 52.8 t80 -66.78 -29.05 68.9 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.949 -0.568 . . . . 16.42 110.234 179.594 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . 0.413 ' HD3' ' HA ' ' A' ' 87' ' ' GLU . 24.9 mtpp -73.32 -46.48 49.19 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.475 -0.784 . . . . 17.66 110.945 179.783 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 75.2 mt -58.6 -50.52 78.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.164 -0.471 . . . . 18.15 111.245 -179.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -64.08 -43.4 95.51 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.36 -0.382 . . . . 18.34 110.976 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 30.7 t0 -64.47 93.28 0.1 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.997 0.427 . . . . 19.29 110.297 179.621 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -56.48 -29.42 61.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.778 -0.646 . . . . 22.47 111.532 -179.269 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -101.12 177.97 4.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.874 0.369 . . . . 23.34 111.028 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -101.0 0.27 54.99 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.949 -0.643 . . . . 22.77 112.002 179.364 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -70.36 -22.36 62.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.701 0.286 . . . . 23.0 111.659 -179.691 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 86.39 45.45 5.56 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.705 -0.76 . . . . 20.02 112.492 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . 0.423 ' HA ' ' O ' ' A' ' 136' ' ' ILE . 99.6 m-85 -147.64 138.86 23.62 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.595 0.236 . . . . 20.56 111.04 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 53.7 mt -114.13 117.43 55.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 121.009 0.433 . . . . 19.37 110.756 179.407 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 68.1 m -114.11 157.32 42.49 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 115.736 -0.666 . . . . 22.65 111.046 -179.296 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . 0.43 ' HG3' HD12 ' A' ' 125' ' ' ILE . 94.4 Cg_exo -41.45 -36.57 2.92 Favored 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 122.602 2.201 . . . . 23.78 112.742 -179.832 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.32 -40.9 81.52 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.161 -0.472 . . . . 25.0 111.17 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -78.02 -22.85 48.64 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.835 -0.62 . . . . 22.31 109.878 -179.473 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.534 HD21 ' HB ' ' A' ' 121' ' ' ILE . 3.4 tt -77.0 -43.04 36.3 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 115.215 -0.902 . . . . 20.62 111.128 -179.445 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.418 ' O ' HG13 ' A' ' 110' ' ' ILE . 54.2 ttt180 -66.57 -48.27 70.15 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.468 -0.333 . . . . 27.9 110.346 179.463 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 8.5 m-85 -55.86 -50.69 69.9 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.159 -0.473 . . . . 25.96 111.492 -179.681 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.439 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 9.3 p -63.99 -43.13 97.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.582 0.229 . . . . 21.06 111.568 -179.623 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 9.0 mmt -58.98 -43.19 91.37 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 120.773 0.32 . . . . 20.93 111.013 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.418 HG13 ' O ' ' A' ' 106' ' ' ARG . 90.9 mt -67.33 -21.6 28.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.144 -0.48 . . . . 25.52 110.313 179.704 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 84.1 m-20 -79.74 -37.64 35.06 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.861 -0.609 . . . . 23.32 110.495 179.345 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.439 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 58.2 mt -59.64 -36.02 75.54 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.103 -0.499 . . . . 21.07 110.422 179.754 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 133.84 -15.88 4.55 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.858 -0.687 . . . . 23.25 112.22 -179.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -93.62 165.2 12.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.863 0.363 . . . . 22.59 111.227 -179.689 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -124.07 128.06 48.76 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.064 -0.517 . . . . 28.21 110.676 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . 0.417 ' HB ' HG23 ' A' ' 121' ' ' ILE . 2.8 m -135.57 146.79 29.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.207 -0.451 . . . . 24.75 111.624 -179.885 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 59.5 p -89.32 147.15 24.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.734 -0.666 . . . . 27.5 110.223 179.331 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -53.74 -19.04 3.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.21 -0.45 . . . . 27.03 111.411 -179.521 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -78.5 -54.64 5.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.405 -0.362 . . . . 29.14 111.575 -179.51 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -61.46 -37.92 85.34 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.557 -0.292 . . . . 24.7 111.769 -179.063 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.534 ' HB ' HD21 ' A' ' 105' ' ' LEU . 47.8 pt -74.32 -35.88 41.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 C-N-CA 120.689 -0.404 . . . . 22.9 111.062 179.99 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -58.72 -37.6 76.5 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.915 0.388 . . . . 24.29 110.365 179.251 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -69.53 -47.1 64.85 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.912 -0.585 . . . . 24.74 110.709 179.693 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 56.5 ttp -53.37 -38.71 63.59 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 116.246 -0.433 . . . . 20.15 110.76 179.658 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.486 HG23 HD13 ' A' ' 136' ' ' ILE . 79.7 mt -67.42 -42.99 87.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.118 -0.492 . . . . 20.23 110.473 179.686 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 3.2 tmt_? -61.87 -30.52 70.92 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.989 -0.551 . . . . 25.57 110.942 179.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -69.87 -28.01 65.29 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.354 -0.385 . . . . 19.18 111.127 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.544 ' HB3' ' HB3' ' A' ' 144' ' ' MET . . . -104.66 -6.73 20.17 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.087 -0.506 . . . . 16.88 111.347 -179.808 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . 0.409 ' OD1' ' N ' ' A' ' 132' ' ' GLY . 3.0 t0 -112.36 105.0 13.18 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.033 0.444 . . . . 20.4 111.431 -179.102 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 74.3 m-85 -71.51 -7.58 48.44 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.749 -0.659 . . . . 21.43 111.031 179.597 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -128.21 -7.62 5.35 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.091 -0.504 . . . . 23.37 110.718 179.914 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . 0.44 ' C ' ' H ' ' A' ' 134' ' ' GLY . . . 61.31 -84.93 0.03 OUTLIER Glycine 0 N--CA 1.447 -0.607 0 CA-C-N 115.703 -0.68 . . . . 24.32 112.049 -179.484 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . 0.468 ' OD2' ' HB2' ' A' ' 135' ' ' MET . 0.8 OUTLIER 44.08 17.14 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 123.43 0.692 . . . . 24.4 111.809 -179.669 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . 0.44 ' H ' ' C ' ' A' ' 132' ' ' GLY . . . 53.33 23.56 19.01 Favored Glycine 0 CA--C 1.522 0.487 0 CA-C-N 115.923 -0.58 . . . . 23.47 114.085 179.547 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 135' ' ' MET . . . . . 0.468 ' HB2' ' OD2' ' A' ' 133' ' ' ASP . 40.3 mtp -145.35 142.73 29.65 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 117.431 0.616 . . . . 22.91 110.828 179.408 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.547 HG23 ' HB2' ' A' ' 140' ' ' GLU . 29.9 mm -113.56 146.82 17.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 121.233 0.539 . . . . 18.67 111.586 -179.091 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -114.65 156.96 23.77 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.413 -0.812 . . . . 16.97 109.525 179.025 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 49.1 t80 -43.14 -21.48 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 111.789 0.292 . . . . 15.28 111.789 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -80.95 -56.35 4.17 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 120.949 0.404 . . . . 14.82 111.032 -179.517 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . 0.547 ' HB2' HG23 ' A' ' 136' ' ' ILE . 58.6 mt-10 -61.9 -32.79 73.2 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.216 0.532 . . . . 17.46 110.104 179.797 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.491 ' HA ' ' HE1' ' A' ' 144' ' ' MET . 81.2 t80 -65.28 -54.15 33.48 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.586 -0.734 . . . . 13.65 109.854 178.951 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . 0.401 HG11 ' SD ' ' A' ' 85' ' ' MET . 2.5 t -48.89 -35.21 6.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.39 -0.823 . . . . 11.12 111.555 179.265 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 143' ' ' TRP . . . . . 0.489 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 92.0 t90 -69.27 -55.94 9.03 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.588 0.588 . . . . 14.4 112.588 -179.066 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 144' ' ' MET . . . . . 0.544 ' HB3' ' HB3' ' A' ' 128' ' ' ALA . 21.9 ptt? -64.26 -24.93 67.84 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 113.324 0.861 . . . . 14.63 113.324 -177.674 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 145' ' ' ILE . . . . . 0.516 HG13 ' N ' ' A' ' 146' ' ' SER . 39.7 pt -80.61 -38.27 17.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 111.993 0.368 . . . . 11.62 111.993 -179.51 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 146' ' ' SER . . . . . 0.516 ' N ' HG13 ' A' ' 145' ' ' ILE . 39.9 t -59.67 -13.55 10.25 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.225 0.536 . . . . 8.66 110.559 -179.883 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 147' ' ' GLN . . . . . 0.489 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 2.8 mm-40 -94.51 -22.8 18.0 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.402 -0.817 . . . . 11.87 111.032 -179.152 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 99.1 mttt . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.223 -0.894 . . . . 13.97 111.003 179.808 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 18.5 mt . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.863 0.364 . . . . 2.0 110.684 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.87 176.17 8.66 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.006 -0.543 . . . . 1.72 110.857 -179.813 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -62.59 -37.75 87.42 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.251 0.548 . . . . 2.2 110.32 179.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -75.38 -45.76 37.17 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.377 -0.829 . . . . 1.35 110.923 -179.634 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -62.46 -45.73 91.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.056 -0.52 . . . . 2.34 110.909 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . 0.523 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 80.7 mt -57.46 -54.74 27.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.123 -0.49 . . . . 1.27 111.096 179.926 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.78 -24.08 65.5 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.246 -0.434 . . . . 1.22 111.88 -179.525 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -72.54 -56.19 5.76 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 112.135 0.42 . . . . 2.27 112.135 -179.08 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.523 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 5.2 p90 -76.98 -24.29 52.26 Favored 'General case' 0 C--N 1.332 -0.158 0 C-N-CA 120.614 -0.434 . . . . 0.46 110.728 -179.591 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.414 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 18.6 tptp -65.62 -39.77 91.85 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.259 -0.645 . . . . 1.85 109.259 178.87 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.435 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 17.9 t70 -68.1 -44.33 76.47 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 108.994 -0.743 . . . . 0.44 108.994 177.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.09 -15.11 62.8 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 115.249 -0.887 . . . . 1.08 110.42 179.275 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.414 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 74.1 t80 -79.6 -48.28 14.04 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.821 -0.627 . . . . 0.56 110.527 -179.734 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 30.1 m -66.01 -23.1 31.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 121.0 0.428 . . . . 1.69 110.253 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.435 ' HG2' ' O ' ' A' ' 14' ' ' ASP . 26.5 mm-40 -57.02 -45.79 82.82 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 115.791 -0.641 . . . . 2.23 111.799 179.358 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -85.63 22.5 1.58 Allowed 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 112.053 0.39 . . . . 0.69 112.053 -179.252 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -120.87 78.82 1.43 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.026 0.441 . . . . 0.46 110.815 179.646 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 11.4 mmmm -89.86 -24.71 21.33 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.854 -0.612 . . . . 2.55 110.999 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -67.54 -35.66 79.48 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.963 -0.562 . . . . 1.8 111.23 -179.608 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 101.83 3.51 52.17 Favored Glycine 0 C--N 1.331 0.255 0 C-N-CA 120.686 -0.768 . . . . 0.54 112.819 179.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 53.6 p -80.2 7.12 10.02 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.731 0.3 . . . . 1.1 111.202 179.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 56.96 19.42 30.11 Favored Glycine 0 C--N 1.333 0.405 0 C-N-CA 120.746 -0.74 . . . . 0.37 111.986 -179.611 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.438 ' C ' HE22 ' A' ' 62' ' ' GLN . 29.6 mtpt -126.34 155.7 41.64 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.696 0.284 . . . . 1.75 111.104 -179.593 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.442 HG13 ' HB2' ' A' ' 63' ' ' LEU . 41.3 pt -114.69 130.12 69.64 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 CA-C-O 120.915 0.388 . . . . 1.2 111.591 -179.843 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -54.53 134.36 46.35 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.091 -0.504 . . . . 1.04 111.161 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 6.1 t -66.82 -8.22 27.15 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.055 -0.52 . . . . 1.71 111.053 179.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 53.9 mtp180 -89.34 -1.19 57.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.912 -0.586 . . . . 3.53 110.491 179.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -127.62 2.05 6.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.808 -0.633 . . . . 2.26 110.971 -179.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.44 ' O ' ' HB3' ' A' ' 35' ' ' LEU . 2.7 tm? -57.09 -51.8 67.82 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.396 -0.365 . . . . 1.95 110.581 -179.791 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.455 ' O ' ' HG3' ' A' ' 37' ' ' ARG . . . -55.55 -44.22 85.75 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.376 -0.916 . . . . 0.32 111.443 179.236 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 87.9 m -56.32 -36.17 68.41 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.105 0.478 . . . . 1.01 110.22 179.124 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.44 ' HB3' ' O ' ' A' ' 32' ' ' LEU . 42.2 tp -65.92 -32.4 73.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.635 -0.712 . . . . 1.85 110.347 179.483 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 16.6 mtp -80.91 -20.17 42.72 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.744 -0.662 . . . . 1.43 110.812 179.793 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.455 ' HG3' ' O ' ' A' ' 33' ' ' GLY . 71.8 mtp180 -74.72 -43.36 55.47 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.344 -0.389 . . . . 3.27 110.646 179.753 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.3 t -65.74 -14.0 60.45 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.168 -0.469 . . . . 1.54 110.981 179.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.486 ' HB3' ' OE1' ' A' ' 41' ' ' GLN . 9.7 mp -113.9 156.14 24.5 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.028 -0.533 . . . . 1.94 110.539 179.491 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -55.15 -7.37 1.14 Allowed Glycine 0 CA--C 1.521 0.455 0 N-CA-C 114.931 0.732 . . . . 0.69 114.931 -178.497 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.486 ' OE1' ' HB3' ' A' ' 39' ' ' LEU . 16.0 mp0 -59.44 -79.72 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 117.86 0.83 . . . . 1.97 110.998 179.697 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 53.69 74.24 0.79 Allowed Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.216 -0.447 . . . . 3.44 111.118 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -71.42 -167.76 0.31 Allowed 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.509 2.14 . . . . 0.59 112.442 179.79 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.9 m -86.27 157.16 19.99 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.125 -0.489 . . . . 1.28 110.934 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -61.32 -55.05 36.1 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.677 0.275 . . . . 2.7 111.056 -179.745 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.57 -53.09 56.66 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.216 -0.447 . . . . 1.15 111.374 -179.843 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -54.87 -41.66 71.1 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.207 -0.451 . . . . 2.23 110.247 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.451 ' HA ' HD21 ' A' ' 51' ' ' LEU . 27.3 tp -60.61 -39.44 88.19 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.722 -0.672 . . . . 2.01 110.641 179.68 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 86.2 mm-40 -70.49 -30.8 67.68 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.145 -0.48 . . . . 1.68 110.823 179.769 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 30.4 m-20 -67.08 -49.31 65.48 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.208 -0.451 . . . . 0.62 111.481 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.451 HD21 ' HA ' ' A' ' 48' ' ' LEU . 1.0 OUTLIER -71.06 -38.96 72.49 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.637 -0.256 . . . . 1.11 111.401 -179.586 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 73.4 mt -65.88 -32.19 57.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 120.74 0.305 . . . . 1.25 110.636 179.607 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -68.66 -50.8 48.29 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.254 -0.43 . . . . 1.24 110.839 179.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -65.24 -32.91 74.82 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.892 0.377 . . . . 2.54 110.277 179.526 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . 0.439 ' HB3' HD22 ' A' ' 63' ' ' LEU . . . -79.85 -14.83 58.37 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.044 -0.525 . . . . 1.19 110.838 179.415 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -70.09 -39.41 75.6 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.189 -0.459 . . . . 1.95 110.84 179.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -82.64 -22.83 34.53 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.145 -0.48 . . . . 3.19 110.969 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -91.42 136.74 32.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.201 -0.454 . . . . 2.69 111.015 -179.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . 0.459 ' C ' ' H ' ' A' ' 61' ' ' GLY . 88.0 m-20 64.01 6.46 2.85 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.957 -0.565 . . . . 2.05 111.362 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 18.6 m-80 71.01 -27.03 0.17 Allowed 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 112.474 0.546 . . . . 1.67 112.474 179.244 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . 0.459 ' H ' ' C ' ' A' ' 59' ' ' ASN . . . 160.91 34.97 0.02 OUTLIER Glycine 0 C--N 1.33 0.23 0 C-N-CA 120.301 -0.952 . . . . 0.86 112.933 -179.937 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.498 ' HA ' HE21 ' A' ' 62' ' ' GLN . 0.0 OUTLIER -141.65 154.69 45.52 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.929 0.395 . . . . 0.49 111.167 179.663 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.442 ' HB2' HG13 ' A' ' 27' ' ' ILE . 17.9 mt -127.96 153.84 46.26 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.876 -0.602 . . . . 2.05 110.332 179.908 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -113.43 156.99 22.5 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 110.288 -0.264 . . . . 1.52 110.288 -179.91 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.472 ' O ' ' HB2' ' A' ' 69' ' ' CYS . 77.6 t80 -44.32 -34.6 2.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.813 0.34 . . . . 0.46 110.44 179.339 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.97 -33.7 57.62 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.088 -0.505 . . . . 1.41 111.926 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -64.67 -50.13 68.27 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.012 0.434 . . . . 1.36 110.062 179.208 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.469 ' HE2' ' HB2' ' A' ' 12' ' ' PHE . 31.3 t80 -64.8 -53.54 45.26 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.902 -0.59 . . . . 0.61 110.518 179.64 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.472 ' HB2' ' O ' ' A' ' 65' ' ' PHE . 0.1 OUTLIER -55.13 -41.38 71.65 Favored 'General case' 0 CA--C 1.521 -0.168 0 CA-C-O 120.827 0.346 . . . . 1.41 110.429 179.691 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -53.06 -46.56 61.58 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.791 -0.718 . . . . 0.41 111.392 179.375 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.471 ' HA ' ' HG2' ' A' ' 74' ' ' LYS . 11.3 mt -65.15 -38.53 82.91 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.421 0 CA-C-O 120.936 0.398 . . . . 1.13 110.314 178.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' MET . . . . . 0.503 ' O ' ' HG3' ' A' ' 76' ' ' MET . 79.4 mmm -61.99 -30.58 71.04 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.075 -0.511 . . . . 1.24 109.796 179.282 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -67.82 -43.31 79.9 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.807 -0.633 . . . . 1.17 110.278 179.512 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.471 ' HG2' ' HA ' ' A' ' 71' ' ' ILE . 64.1 pttt -75.63 -29.83 59.3 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.32 -0.4 . . . . 1.91 110.762 179.572 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 4.6 tt0 -73.0 -55.95 5.82 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.306 -0.406 . . . . 2.03 110.794 179.426 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' MET . . . . . 0.503 ' HG3' ' O ' ' A' ' 72' ' ' MET . 43.1 mtt . . . . . 0 N--CA 1.445 -0.712 0 CA-C-O 120.933 0.397 . . . . 1.52 110.584 179.375 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.475 ' O ' ' HG3' ' A' ' 85' ' ' MET . 2.6 t . . . . . 0 N--CA 1.469 0.503 0 CA-C-O 120.987 0.422 . . . . 7.48 111.736 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.481 ' HA ' ' SD ' ' A' ' 85' ' ' MET . 11.7 pt-20 -80.16 -15.85 56.16 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.044 -0.526 . . . . 9.74 112.29 -178.895 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -59.74 -55.71 30.87 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 120.988 0.423 . . . . 12.11 110.991 -179.829 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -67.99 -15.76 63.75 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.976 -0.556 . . . . 10.87 110.558 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' MET . . . . . 0.481 ' SD ' ' HA ' ' A' ' 82' ' ' GLU . 8.5 mtt -80.4 -34.44 36.29 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.089 -0.505 . . . . 11.09 110.302 -179.875 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 37.3 ttt180 -68.78 -46.76 67.89 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.747 -0.66 . . . . 16.05 109.875 179.454 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.453 ' O ' HG12 ' A' ' 91' ' ' ILE . 38.3 tt0 -59.45 -45.19 92.3 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.886 -0.597 . . . . 14.85 109.818 178.981 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.88 -35.28 80.64 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.832 -0.622 . . . . 14.11 111.074 179.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -58.55 -39.2 79.57 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.099 0.476 . . . . 16.42 110.237 179.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 58.7 mttp -68.41 -40.1 81.4 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.665 -0.698 . . . . 17.66 110.682 179.497 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.453 HG12 ' O ' ' A' ' 87' ' ' GLU . 42.0 mm -60.06 -38.54 77.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.086 -0.506 . . . . 18.15 111.287 -179.826 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.501 ' HA ' HG22 ' A' ' 108' ' ' VAL . 12.8 m-85 -79.21 -35.37 41.78 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.386 -0.37 . . . . 18.34 111.333 -179.798 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 46.4 t0 -79.22 108.16 12.51 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.9 0.381 . . . . 19.29 110.946 -179.64 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.13 -9.55 58.82 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.979 -0.555 . . . . 22.47 111.313 -179.639 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . 0.41 ' HB2' ' OD1' ' A' ' 97' ' ' ASP . 22.0 m-20 -117.18 168.08 10.62 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.888 0.375 . . . . 23.34 110.85 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -99.76 5.28 58.19 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.781 -0.723 . . . . 22.77 112.081 179.659 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.45 ' OD2' ' HB2' ' A' ' 99' ' ' PHE . 6.0 p-10 -63.27 -39.66 95.23 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.726 0.298 . . . . 23.0 111.061 -179.612 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 110.99 15.71 10.51 Favored Glycine 0 C--N 1.332 0.324 0 C-N-CA 120.659 -0.781 . . . . 20.02 112.921 179.727 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . 0.45 ' HB2' ' OD2' ' A' ' 97' ' ' ASP . 82.3 m-85 -139.69 152.12 46.45 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.892 0.377 . . . . 20.56 111.263 179.795 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.43 ' HB ' ' HB ' ' A' ' 136' ' ' ILE . 63.5 mt -114.68 132.13 64.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 115.964 -0.562 . . . . 19.37 110.8 179.71 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 35.2 p -114.35 155.96 45.06 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.206 -0.452 . . . . 22.65 110.756 -179.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_exo -40.54 -37.6 2.2 Favored 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 122.586 2.191 . . . . 23.78 112.567 -179.842 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.07 -49.52 77.02 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.131 0.491 . . . . 25.0 110.59 179.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -69.46 -32.75 71.88 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.612 -0.722 . . . . 22.31 110.694 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.518 HD11 HD11 ' A' ' 121' ' ' ILE . 3.4 tm? -62.24 -56.03 22.56 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.018 -0.537 . . . . 20.62 110.359 -179.775 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 3.2 ttp180 -56.06 -40.59 73.77 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.193 -0.458 . . . . 27.9 111.03 179.712 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -58.38 -46.9 85.47 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.189 0.44 . . . . 25.96 112.189 -179.316 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.52 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 17.6 t -78.77 -54.06 12.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 N-CA-C 111.967 0.358 . . . . 21.06 111.967 -179.1 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.485 ' HG3' ' CD1' ' A' ' 105' ' ' LEU . 1.1 mmt -47.03 -22.22 0.31 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 120.706 0.289 . . . . 20.93 111.4 -179.77 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 78.1 mt -95.26 -38.83 9.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 121.023 0.439 . . . . 25.52 110.354 178.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -58.57 -33.16 69.63 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.681 -0.69 . . . . 23.32 110.893 179.858 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.52 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 19.1 mt -66.7 -24.93 66.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.139 -0.482 . . . . 21.07 110.832 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 117.34 -7.99 15.92 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.945 -0.645 . . . . 23.25 112.49 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -82.54 127.43 33.32 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.718 0.294 . . . . 22.59 110.918 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -87.17 104.38 16.3 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.229 -0.441 . . . . 28.21 110.713 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . 0.47 ' HB ' HG21 ' A' ' 121' ' ' ILE . 3.2 m -123.42 149.94 27.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.158 -0.474 . . . . 24.75 111.504 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' THR . . . . . 0.435 ' O ' HG12 ' A' ' 121' ' ' ILE . 67.5 p -98.73 144.54 27.86 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.791 -0.64 . . . . 27.5 110.061 179.182 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . 0.469 ' HA ' HD13 ' A' ' 121' ' ' ILE . 5.7 m-20 -48.65 -23.08 0.9 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.051 -0.522 . . . . 27.03 111.775 -179.492 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -77.31 -55.74 5.15 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 111.743 0.275 . . . . 29.14 111.743 -179.394 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . 0.414 ' OE1' HG12 ' A' ' 116' ' ' VAL . 13.2 pt-20 -59.52 -38.43 80.96 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.624 -0.262 . . . . 24.7 111.588 -179.19 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.518 HD11 HD11 ' A' ' 105' ' ' LEU . 33.5 pt -73.15 -34.53 45.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 C-N-CA 120.996 -0.282 . . . . 22.9 111.515 -179.946 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -57.05 -46.23 82.61 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.91 -0.404 . . . . 24.29 109.91 179.513 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.86 -37.69 88.47 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.068 -0.515 . . . . 24.74 110.119 179.038 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 5.2 ttp -53.16 -48.41 68.01 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.034 -0.53 . . . . 20.15 110.676 179.237 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.405 HG22 HD12 ' A' ' 136' ' ' ILE . 76.8 mt -61.05 -43.13 95.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.026 -0.534 . . . . 20.23 110.449 179.711 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 29.3 ttm180 -61.76 -33.82 74.76 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.957 -0.565 . . . . 25.57 110.87 179.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -69.06 -19.17 64.08 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.983 -0.553 . . . . 19.18 111.171 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.608 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -113.5 -5.06 13.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.228 -0.442 . . . . 16.88 111.217 -179.922 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 18.9 t0 -107.02 101.61 11.02 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.071 0.462 . . . . 20.4 110.903 -179.679 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 85.6 m-85 -86.77 -42.72 13.1 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.797 -0.638 . . . . 21.43 111.374 -179.784 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -59.69 -23.72 63.35 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.314 -0.403 . . . . 23.37 110.909 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 64.25 78.21 0.21 Allowed Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.857 -0.687 . . . . 24.32 112.739 179.632 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -143.38 6.56 1.49 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.844 0.354 . . . . 24.4 110.794 179.568 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 67.58 20.06 71.58 Favored Glycine 0 C--N 1.331 0.289 0 C-N-CA 120.87 -0.681 . . . . 23.47 112.698 179.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 72.8 mtp -136.76 155.24 50.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.805 0.336 . . . . 22.91 110.636 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.53 HG23 ' HB2' ' A' ' 140' ' ' GLU . 43.6 mm -114.7 144.76 21.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 121.163 0.506 . . . . 18.67 111.51 -179.566 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . 0.448 ' ND2' ' H ' ' A' ' 138' ' ' TYR . 4.0 t-20 -114.58 156.59 24.39 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.44 -0.8 . . . . 16.97 109.031 178.744 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . 0.448 ' H ' ' ND2' ' A' ' 137' ' ' ASN . 34.1 t80 -41.8 -24.07 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 120.864 0.364 . . . . 15.28 111.141 179.82 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . 0.412 ' N ' ' O ' ' A' ' 137' ' ' ASN . 47.3 mt-10 -81.02 -55.35 4.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.113 -0.494 . . . . 14.82 110.632 179.928 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . 0.53 ' HB2' HG23 ' A' ' 136' ' ' ILE . 36.9 mt-10 -57.38 -29.22 63.89 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.905 -0.589 . . . . 17.46 110.487 179.786 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.541 ' HA ' ' HE1' ' A' ' 144' ' ' MET . 86.0 t80 -71.68 -55.57 7.45 Favored 'General case' 0 C--N 1.334 -0.108 0 CA-C-N 116.06 -0.518 . . . . 13.65 110.122 179.322 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . 0.48 HG12 ' SD ' ' A' ' 85' ' ' MET . 6.7 t -46.69 -35.13 2.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 CA-C-N 115.748 -0.66 . . . . 11.12 111.507 179.217 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 143' ' ' TRP . . . . . 0.537 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 84.1 t90 -73.35 -55.82 5.89 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.215 0.45 . . . . 14.4 112.215 -179.092 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 144' ' ' MET . . . . . 0.608 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 20.1 ptt? -63.11 -19.97 64.93 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.916 0.709 . . . . 14.63 112.916 -177.884 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 145' ' ' ILE . . . . . 0.55 HG13 ' N ' ' A' ' 146' ' ' SER . 33.3 pt -81.44 -48.73 18.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 N-CA-C 112.02 0.378 . . . . 11.62 112.02 179.851 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 146' ' ' SER . . . . . 0.55 ' N ' HG13 ' A' ' 145' ' ' ILE . 29.3 t -63.95 -14.29 52.66 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-O 121.264 0.554 . . . . 8.66 109.999 -179.711 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 147' ' ' GLN . . . . . 0.537 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 7.6 mm-40 -124.67 18.25 8.74 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.188 -0.915 . . . . 11.87 110.268 -179.235 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . 0.529 ' HB2' ' HA ' ' A' ' 145' ' ' ILE . 14.8 ttpp . . . . . 0 C--O 1.249 1.043 0 CA-C-N 115.289 -0.869 . . . . 13.97 111.053 -179.684 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.441 HD11 ' SG ' ' A' ' 69' ' ' CYS . 72.5 mt . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.928 0.394 . . . . 2.0 110.631 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -77.79 166.62 22.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.986 -0.552 . . . . 1.72 111.008 -179.653 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -52.52 -52.31 55.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.512 -0.313 . . . . 2.2 111.677 179.822 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -68.58 -40.16 80.65 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.049 0.452 . . . . 1.35 110.838 -179.374 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -60.63 -40.88 93.54 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.644 -0.707 . . . . 2.34 111.014 -179.837 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . 0.505 ' HA ' ' CZ ' ' A' ' 12' ' ' PHE . 72.7 mt -63.58 -49.4 82.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.264 -0.426 . . . . 1.27 110.414 179.821 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.98 -18.96 65.63 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.949 -0.569 . . . . 1.22 110.849 179.658 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -71.76 -56.96 4.81 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 116.06 -0.518 . . . . 2.27 111.646 -179.117 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.505 ' CZ ' ' HA ' ' A' ' 9' ' ' ILE . 9.3 p90 -77.76 -26.65 49.97 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.595 -0.442 . . . . 0.46 110.751 -179.714 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.406 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 20.0 tptm -64.23 -36.71 84.97 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.234 -0.654 . . . . 1.85 109.234 178.639 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -67.46 -48.18 67.95 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.772 -0.649 . . . . 0.44 109.393 178.374 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.18 -14.81 61.5 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.884 -0.598 . . . . 1.08 110.952 179.002 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.406 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 36.9 t80 -79.16 -47.49 15.96 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.866 -0.606 . . . . 0.56 110.807 -179.4 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 31.6 m -70.18 -24.75 26.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.135 -0.484 . . . . 1.69 110.849 -179.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 76.6 mm-40 -60.58 -32.14 71.24 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.96 -0.564 . . . . 2.23 111.365 179.816 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 20.5 m-85 -85.93 -20.96 28.2 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.569 -0.287 . . . . 0.69 111.537 -179.57 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -80.19 90.13 5.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.934 0.397 . . . . 0.46 110.855 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 12.3 mmmm -100.18 4.49 44.43 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.03 -0.532 . . . . 2.55 111.218 -179.688 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -99.41 -36.72 9.49 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.225 -0.443 . . . . 1.8 111.233 -179.434 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 96.85 30.06 7.75 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.774 -0.727 . . . . 0.54 112.811 179.614 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 31.1 p -103.57 10.79 36.85 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.655 0.264 . . . . 1.1 111.166 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.93 15.96 30.12 Favored Glycine 0 C--N 1.331 0.282 0 C-N-CA 120.715 -0.755 . . . . 0.37 112.045 -179.67 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.463 ' HE3' ' HB3' ' A' ' 62' ' ' GLN . 5.1 mtmt -139.79 151.95 46.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.661 0.267 . . . . 1.75 110.712 -179.769 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 50.3 pt -119.28 136.25 57.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.49 -0.323 . . . . 1.2 111.251 -179.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -50.39 125.9 13.81 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.356 -0.384 . . . . 1.04 110.949 179.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 6.9 t -62.62 -16.15 55.23 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.119 -0.491 . . . . 1.71 111.036 -179.869 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 65.8 mtp180 -75.99 -18.79 59.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.082 -0.508 . . . . 3.53 110.353 179.701 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -104.28 0.57 29.45 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.707 -0.678 . . . . 2.26 110.478 179.621 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.411 ' O ' ' HG2' ' A' ' 36' ' ' MET . 0.9 OUTLIER -60.85 -49.49 77.26 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.025 -0.534 . . . . 1.95 110.311 179.936 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.444 ' HA2' HD12 ' A' ' 48' ' ' LEU . . . -54.18 -39.17 63.24 Favored Glycine 0 C--N 1.332 0.343 0 C-N-CA 120.502 -0.856 . . . . 0.32 111.347 179.077 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 94.2 m -66.24 -33.03 74.83 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.243 0.544 . . . . 1.01 109.963 178.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 65.6 tp -70.96 -20.68 62.42 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.536 -0.756 . . . . 1.85 110.701 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.411 ' HG2' ' O ' ' A' ' 32' ' ' LEU . 90.8 mmm -80.29 -49.64 11.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.259 -0.428 . . . . 1.43 111.104 179.757 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 10.6 ptm180 -60.62 -34.39 74.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.446 -0.343 . . . . 3.27 110.983 179.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 14.5 t -72.25 -13.16 61.45 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.065 0.46 . . . . 1.54 110.611 179.295 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 86.1 mt -113.11 156.91 22.34 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.581 -0.736 . . . . 1.94 110.487 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -44.35 -31.73 2.42 Favored Glycine 0 CA--C 1.52 0.345 0 C-N-CA 120.686 -0.769 . . . . 0.69 112.689 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -64.14 160.07 19.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.827 0.346 . . . . 1.97 110.965 179.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 17.6 p-10 -164.28 76.23 1.59 Allowed Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.153 -0.476 . . . . 3.44 110.739 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -66.19 150.18 85.07 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.642 2.228 . . . . 0.59 112.562 -179.712 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 19.6 m -71.29 157.06 38.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.04 -0.527 . . . . 1.28 110.469 179.588 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.418 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 0.9 OUTLIER -48.48 -54.76 13.01 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 111.608 0.225 . . . . 2.7 111.608 -179.703 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -48.16 -55.49 10.23 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.569 -0.287 . . . . 1.15 111.749 -179.496 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -56.74 -48.44 77.78 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.318 -0.401 . . . . 2.23 110.564 -179.785 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.515 ' HA ' HD22 ' A' ' 51' ' ' LEU . 14.3 tp -57.26 -35.65 70.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.116 -0.493 . . . . 2.01 110.888 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.418 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 37.0 mm-40 -72.57 -33.33 66.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.386 -0.37 . . . . 1.68 110.509 179.663 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 63.1 m-20 -69.31 -54.11 16.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.083 -0.508 . . . . 0.62 111.707 -179.725 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.515 HD22 ' HA ' ' A' ' 48' ' ' LEU . 1.2 pp -63.78 -44.08 94.44 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 112.077 0.399 . . . . 1.11 112.077 -179.123 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 76.8 mt -64.1 -44.94 97.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.742 0.306 . . . . 1.25 111.081 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.77 -52.42 63.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.322 -0.399 . . . . 1.24 111.152 -179.821 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -60.38 -34.05 73.34 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.423 -0.353 . . . . 2.54 110.637 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -77.78 -15.8 58.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.366 -0.379 . . . . 1.19 110.914 179.553 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -80.3 -51.3 9.07 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.252 -0.431 . . . . 1.95 111.309 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 9.5 p30 -88.44 30.4 0.89 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.423 -0.353 . . . . 3.19 111.504 -179.416 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -149.34 -18.09 0.28 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.39 -0.368 . . . . 2.69 110.971 179.534 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 25.2 m-80 -135.79 21.38 3.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.217 -0.447 . . . . 2.05 110.731 179.887 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 11.2 m120 61.49 -86.38 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.928 -0.578 . . . . 1.67 111.522 179.821 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -146.53 4.28 1.07 Allowed Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.564 -0.827 . . . . 0.86 112.833 -179.683 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.463 ' HB3' ' HE3' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -114.96 150.41 35.79 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.03 0.443 . . . . 0.49 111.093 179.863 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.423 ' O ' ' HB3' ' A' ' 26' ' ' LYS . 0.5 OUTLIER -118.02 153.02 34.38 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.603 -0.726 . . . . 2.05 109.96 -179.939 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . 0.454 ' N ' ' OD1' ' A' ' 64' ' ' ASN . 0.6 OUTLIER -112.59 156.49 22.59 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.648 0.261 . . . . 1.52 111.304 -178.388 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -48.54 -38.93 21.71 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.142 -0.481 . . . . 0.46 110.919 179.862 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.22 -33.07 71.23 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.502 -0.317 . . . . 1.41 111.065 179.779 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.411 ' HB2' ' HG ' ' A' ' 63' ' ' LEU . 12.9 mm-40 -66.32 -47.42 73.57 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.312 0.577 . . . . 1.36 109.547 178.616 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.417 ' HE2' ' HB2' ' A' ' 12' ' ' PHE . 27.1 t80 -63.3 -55.35 25.45 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.297 -0.865 . . . . 0.61 110.504 179.282 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.441 ' SG ' HD11 ' A' ' 4' ' ' LEU . 0.5 OUTLIER -56.18 -39.1 71.86 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.001 -0.545 . . . . 1.41 110.222 179.609 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -53.27 -50.25 53.02 Favored Glycine 0 N--CA 1.451 -0.343 0 CA-C-N 115.637 -0.711 . . . . 0.41 112.148 179.682 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.523 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 11.6 mt -65.48 -44.09 94.29 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.36 0 CA-C-O 121.136 0.494 . . . . 1.13 110.66 179.632 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' MET . . . . . 0.467 ' O ' ' HB2' ' A' ' 76' ' ' MET . 21.4 mtp -53.27 -33.07 51.63 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.9 -0.591 . . . . 1.24 109.654 179.613 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.11 -44.63 68.6 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.99 -0.55 . . . . 1.17 110.791 179.479 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.523 ' HG2' ' O ' ' A' ' 71' ' ' ILE . 0.0 OUTLIER -65.96 -33.25 75.38 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.394 -0.366 . . . . 1.91 111.58 -179.355 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -83.16 -55.42 4.36 Favored 'General case' 0 CA--C 1.521 -0.135 0 CA-C-O 121.235 0.541 . . . . 2.03 111.14 -179.153 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' MET . . . . . 0.467 ' HB2' ' O ' ' A' ' 72' ' ' MET . 84.0 mtp . . . . . 0 C--N 1.325 -0.461 0 CA-C-N 115.12 -0.946 . . . . 1.52 112.633 -178.82 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.495 ' O ' ' HG2' ' A' ' 85' ' ' MET . 5.2 t . . . . . 0 N--CA 1.469 0.497 0 CA-C-O 121.039 0.447 . . . . 7.48 111.64 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -41.33 -41.84 2.05 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.552 -0.749 . . . . 9.74 112.743 -179.025 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -55.52 -53.37 57.25 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 111.861 0.319 . . . . 12.11 111.861 -179.171 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -64.26 -15.64 60.52 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.36 -0.382 . . . . 10.87 111.572 -179.308 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' MET . . . . . 0.495 ' HG2' ' O ' ' A' ' 81' ' ' THR . 13.3 mmm -81.02 -36.6 30.39 Favored 'General case' 0 CA--C 1.511 -0.537 0 CA-C-O 121.738 0.78 . . . . 11.09 109.304 -178.837 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 6.2 tpt180 -64.2 -52.67 57.75 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.246 -1.343 . . . . 16.05 110.353 179.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -58.6 -36.11 73.48 Favored 'General case' 0 C--O 1.233 0.187 0 N-CA-C 109.754 -0.462 . . . . 14.85 109.754 178.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.75 -36.47 80.6 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.049 -0.523 . . . . 14.11 110.589 178.688 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 94.7 t80 -72.3 -16.82 61.9 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 116.014 -0.539 . . . . 16.42 110.465 179.711 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 16.8 tttt -79.46 -49.03 12.92 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 115.572 -0.74 . . . . 17.66 110.684 -179.625 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 65.7 mt -71.71 -44.79 68.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.809 -0.632 . . . . 18.15 111.517 -179.708 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.444 ' HA ' HG23 ' A' ' 108' ' ' VAL . 2.5 m-85 -61.11 -44.29 97.58 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.396 -0.365 . . . . 18.34 111.314 -179.656 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 45.7 t0 -72.33 105.03 3.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.386 -0.37 . . . . 19.29 110.354 179.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.529 ' HG2' ' HB3' ' A' ' 104' ' ' GLU . 19.7 mmm180 -59.42 -53.79 54.07 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.007 -0.542 . . . . 22.47 110.933 -179.561 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . 0.419 ' HB2' ' OD1' ' A' ' 97' ' ' ASP . 0.6 OUTLIER -86.24 170.82 11.76 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.068 -0.515 . . . . 23.34 110.722 -179.88 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -97.74 5.53 62.06 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.901 -0.666 . . . . 22.77 112.155 179.866 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.419 ' OD1' ' HB2' ' A' ' 95' ' ' ASP . 6.5 p-10 -56.97 -43.82 82.02 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.734 0.302 . . . . 23.0 111.109 -179.777 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 114.61 20.84 5.65 Favored Glycine 0 CA--C 1.518 0.241 0 C-N-CA 120.837 -0.697 . . . . 20.02 112.869 179.633 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . 0.402 ' HA ' ' O ' ' A' ' 136' ' ' ILE . 98.5 m-85 -144.98 145.76 31.66 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.785 0.326 . . . . 20.56 111.071 179.861 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 56.2 mt -114.6 130.4 69.03 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 CA-C-N 116.208 -0.451 . . . . 19.37 110.679 179.429 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 68.6 m -114.41 156.06 45.0 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-N 116.148 -0.478 . . . . 22.65 110.684 -179.666 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_exo -43.59 -37.55 8.2 Favored 'Trans proline' 0 C--N 1.349 0.564 0 C-N-CA 122.38 2.053 . . . . 23.78 112.492 -179.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -62.21 -43.5 98.68 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.096 0.474 . . . . 25.0 110.657 179.569 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . 0.529 ' HB3' ' HG2' ' A' ' 94' ' ' ARG . 43.8 mt-10 -73.82 -35.91 64.91 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.636 -0.711 . . . . 22.31 110.545 179.827 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.575 HD21 ' HB ' ' A' ' 121' ' ' ILE . 35.7 tp -60.75 -40.6 93.06 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.625 -0.716 . . . . 20.62 110.873 -179.606 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.482 ' HG3' HD13 ' A' ' 110' ' ' ILE . 8.7 ttm180 -69.98 -46.57 64.9 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.28 -0.418 . . . . 27.9 110.449 179.16 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -56.18 -41.83 76.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.992 -0.549 . . . . 25.96 111.58 -179.511 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.517 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 5.3 p -73.2 -49.23 39.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 C-N-CA 121.057 -0.257 . . . . 21.06 111.627 -179.516 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -50.5 -45.75 56.65 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.804 0.335 . . . . 20.93 110.667 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.482 HD13 ' HG3' ' A' ' 106' ' ' ARG . 42.4 mt -70.06 -30.16 42.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.174 -0.467 . . . . 25.52 110.185 179.31 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -68.18 -29.71 68.64 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.735 -0.666 . . . . 23.32 110.538 179.475 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.517 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 62.6 mt -72.97 -40.63 65.13 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.02 -0.536 . . . . 21.07 110.451 179.829 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 136.8 -1.59 3.21 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.941 -0.647 . . . . 23.25 112.331 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -117.02 130.73 56.87 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.926 0.393 . . . . 22.59 111.298 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 9.8 ptpp? -88.18 153.3 21.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.136 -0.484 . . . . 28.21 110.928 179.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . 0.422 ' HB ' HG23 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -152.1 155.6 6.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.03 -0.532 . . . . 24.75 111.314 -179.814 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' THR . . . . . 0.446 ' O ' HG12 ' A' ' 121' ' ' ILE . 73.0 p -94.42 138.41 32.39 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.935 -0.575 . . . . 27.5 110.186 179.671 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 22.2 m-20 -50.0 -19.63 0.76 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.017 -0.538 . . . . 27.03 111.571 -179.49 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -77.48 -55.24 5.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.47 -0.332 . . . . 29.14 111.842 -179.414 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -62.48 -41.15 98.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.479 -0.328 . . . . 24.7 111.773 -179.091 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.575 ' HB ' HD21 ' A' ' 105' ' ' LEU . 15.1 pt -70.35 -38.14 73.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 C-N-CA 120.982 -0.287 . . . . 22.9 111.412 -179.431 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . 0.405 ' N ' HG13 ' A' ' 121' ' ' ILE . 17.0 t70 -63.16 -32.87 74.36 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.928 0.394 . . . . 24.29 110.27 179.303 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 22.3 mm-40 -65.79 -46.97 76.7 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.012 -0.54 . . . . 24.74 110.53 179.541 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 55.5 ttp -56.73 -39.14 73.4 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.084 -0.507 . . . . 20.15 110.853 179.526 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 66.6 mt -64.92 -42.05 93.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.983 0.421 . . . . 20.23 110.301 179.61 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 35.2 ttp180 -59.14 -46.12 89.18 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.745 -0.662 . . . . 25.57 110.875 179.517 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -63.43 -29.73 70.97 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.832 -0.622 . . . . 19.18 111.237 -179.551 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.512 ' HB1' ' HB3' ' A' ' 144' ' ' MET . . . -91.48 -13.84 31.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.852 0.358 . . . . 16.88 111.079 179.829 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . 0.405 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 5.9 t70 -101.04 105.86 17.1 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.123 -0.49 . . . . 20.4 110.924 -179.723 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -89.6 -41.36 12.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.951 -0.568 . . . . 21.43 111.609 -179.6 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -59.95 -26.14 65.75 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.867 0.365 . . . . 23.37 110.769 -179.614 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 72.05 79.34 0.44 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.804 -0.712 . . . . 24.32 112.87 179.782 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 13.3 p-10 -138.83 -33.28 0.65 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.651 0.263 . . . . 24.4 111.031 179.641 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 108.21 7.91 29.99 Favored Glycine 0 N--CA 1.452 -0.233 0 C-N-CA 120.799 -0.715 . . . . 23.47 112.669 179.892 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 63.9 mtp -130.71 155.53 46.46 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.622 0.249 . . . . 22.91 110.508 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.503 HG22 ' HB2' ' A' ' 140' ' ' GLU . 46.6 mm -114.69 143.34 24.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 121.207 0.527 . . . . 18.67 111.973 -179.501 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . 0.443 ' O ' ' N ' ' A' ' 139' ' ' GLU . 28.9 p-10 -115.71 157.94 23.54 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.282 -0.872 . . . . 16.97 108.749 178.257 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 48.7 t80 -39.33 -24.23 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 112.312 0.486 . . . . 15.28 112.312 -179.358 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . 0.443 ' N ' ' O ' ' A' ' 137' ' ' ASN . 12.8 mm-40 -80.77 -56.29 4.24 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 120.742 0.306 . . . . 14.82 111.45 -179.55 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . 0.503 ' HB2' HG22 ' A' ' 136' ' ' ILE . 44.0 mt-10 -62.1 -25.57 67.79 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.149 0.499 . . . . 17.46 110.015 179.788 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.535 ' HA ' ' HE3' ' A' ' 144' ' ' MET . 63.7 t80 -70.13 -55.29 9.78 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.618 -0.719 . . . . 13.65 110.111 179.235 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . 0.41 HG23 ' CB ' ' A' ' 85' ' ' MET . 43.6 t -47.83 -44.21 10.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.697 -0.683 . . . . 11.12 111.463 179.736 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 84.2 t90 -63.77 -55.34 23.89 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.406 0.521 . . . . 14.4 112.406 -178.883 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 144' ' ' MET . . . . . 0.535 ' HE3' ' HA ' ' A' ' 141' ' ' PHE . 18.8 ptt? -61.31 -35.48 77.49 Favored 'General case' 0 N--CA 1.463 0.191 0 N-CA-C 112.726 0.639 . . . . 14.63 112.726 -177.921 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 145' ' ' ILE . . . . . 0.464 HD13 ' HB3' ' A' ' 85' ' ' MET . 13.9 pt -76.53 -23.07 15.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 C-N-CA 120.809 -0.357 . . . . 11.62 111.721 -179.388 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 146' ' ' SER . . . . . 0.423 ' HB3' ' NE2' ' A' ' 147' ' ' GLN . 48.0 t -67.64 -29.84 69.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.99 0.424 . . . . 8.66 110.245 179.945 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 147' ' ' GLN . . . . . 0.423 ' NE2' ' HB3' ' A' ' 146' ' ' SER . 13.9 mm-40 -91.61 -21.9 20.57 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.728 -0.669 . . . . 11.87 111.38 -179.759 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . 0.436 ' HG3' ' O ' ' A' ' 144' ' ' MET . 88.1 mttt . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.264 -0.874 . . . . 13.97 111.098 179.653 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.439 HD13 ' HE2' ' A' ' 76' ' ' MET . 6.9 mp . . . . . 0 C--O 1.232 0.159 0 CA-C-O 120.699 0.285 . . . . 2.0 110.624 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -66.19 -153.71 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.846 0.355 . . . . 1.72 111.242 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -80.3 -54.95 5.26 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.116 0.484 . . . . 2.2 110.537 -179.561 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -70.29 -28.59 65.31 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.722 -0.672 . . . . 1.35 110.199 179.812 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -66.57 -48.17 70.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.675 -0.693 . . . . 2.34 110.565 179.575 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . 0.525 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 64.5 mt -60.28 -40.68 84.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.08 -0.509 . . . . 1.27 110.885 179.831 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -77.12 -18.79 57.66 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.979 0.418 . . . . 1.22 110.673 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -72.24 -56.26 5.83 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.865 -0.607 . . . . 2.27 111.751 -179.154 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.525 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 8.3 p90 -75.99 -26.83 57.1 Favored 'General case' 0 C--N 1.333 -0.152 0 C-N-CA 120.577 -0.449 . . . . 0.46 110.758 -179.843 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 26.1 tptp -64.12 -37.05 86.04 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 109.467 -0.568 . . . . 1.85 109.467 178.74 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -70.12 -46.79 64.06 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.857 -0.61 . . . . 0.44 109.691 178.666 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.69 -19.9 66.01 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.903 -0.59 . . . . 1.08 110.392 179.246 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -79.4 -39.15 33.16 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.573 -0.739 . . . . 0.56 110.522 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -71.57 -26.04 25.63 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.701 0 CA-C-N 115.939 -0.573 . . . . 1.69 111.05 -179.888 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 82.2 mm-40 -61.13 -29.48 69.8 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.793 -0.64 . . . . 2.23 111.357 -179.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 47.9 m-85 -93.16 -6.95 46.71 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.596 -0.275 . . . . 0.69 111.338 -179.792 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -97.85 89.62 4.66 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.889 0.376 . . . . 0.46 110.697 179.395 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -99.52 -21.18 16.03 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.042 -0.526 . . . . 2.55 111.266 -179.759 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -78.05 -11.08 59.88 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.262 -0.426 . . . . 1.8 111.193 -179.711 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.5 7.45 87.1 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.765 -0.731 . . . . 0.54 112.814 179.702 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 76.2 p -76.67 5.36 7.68 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.674 0.273 . . . . 1.1 111.146 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 56.15 23.84 41.58 Favored Glycine 0 C--N 1.332 0.331 0 C-N-CA 120.811 -0.709 . . . . 0.37 111.73 -179.608 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.639 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 36.1 mtpt -136.09 155.87 49.56 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.725 0.298 . . . . 1.75 111.346 -179.244 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.432 ' N ' HE22 ' A' ' 62' ' ' GLN . 44.3 pt -117.93 129.8 73.77 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.2 0 CA-C-O 120.951 0.405 . . . . 1.2 111.367 179.876 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -52.47 141.3 20.33 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.186 -0.461 . . . . 1.04 111.29 -179.732 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 38.7 p -66.69 -12.84 60.09 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.852 -0.613 . . . . 1.71 111.254 -179.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 39.0 mtp180 -89.43 5.34 45.73 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.974 -0.557 . . . . 3.53 110.676 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -124.57 -7.92 7.43 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.081 -0.509 . . . . 2.26 111.296 -179.537 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.501 HD21 HD11 ' A' ' 63' ' ' LEU . 1.2 tm? -56.15 -52.73 63.31 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.553 -0.294 . . . . 1.95 110.746 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -53.95 -44.9 72.16 Favored Glycine 0 C--N 1.33 0.244 0 C-N-CA 120.598 -0.81 . . . . 0.32 111.979 179.701 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 45.2 m -60.55 -32.52 71.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.037 0.446 . . . . 1.01 110.512 179.432 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -69.06 -31.36 70.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.815 -0.63 . . . . 1.85 110.701 -179.99 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 69.7 mmm -76.96 -24.86 52.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.205 -0.452 . . . . 1.43 110.325 179.766 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -71.32 -48.43 50.52 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.256 -0.429 . . . . 3.27 110.581 179.319 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.2 t -64.52 -13.81 54.28 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.037 -0.529 . . . . 1.54 111.21 179.847 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 10.4 mp -113.54 156.38 23.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.187 -0.46 . . . . 1.94 110.441 179.778 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -50.2 -18.32 2.14 Favored Glycine 0 CA--C 1.52 0.38 0 CA-C-N 115.827 -0.624 . . . . 0.69 114.175 -179.014 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 11.8 mp0 -64.61 163.09 14.35 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 117.42 0.61 . . . . 1.97 111.105 -179.881 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -165.21 72.27 1.41 Allowed Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 115.932 -0.576 . . . . 3.44 110.834 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -66.61 164.22 29.81 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.648 2.232 . . . . 0.59 112.437 -179.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 44.2 m -82.58 152.05 26.12 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.028 -0.533 . . . . 1.28 110.752 179.757 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -45.47 -52.52 10.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.441 -0.345 . . . . 2.7 111.344 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.95 -47.82 70.9 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.215 -0.448 . . . . 1.15 111.592 -179.738 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -53.38 -55.0 28.54 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.391 -0.368 . . . . 2.23 111.282 -179.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 39.6 mt -57.98 -44.86 87.35 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.537 -0.302 . . . . 2.01 110.955 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 83.5 mm-40 -62.56 -29.88 70.91 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.728 0.299 . . . . 1.68 111.288 -179.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -76.09 -52.59 9.83 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.345 -0.389 . . . . 0.62 111.903 -179.285 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 2.2 pp -68.94 -38.19 79.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.567 -0.288 . . . . 1.11 111.602 -179.133 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 85.0 mt -65.06 -53.28 43.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.628 -0.26 . . . . 1.25 110.969 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.5 -35.47 79.47 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.799 0.333 . . . . 1.24 111.145 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -62.92 -55.16 28.48 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.319 -0.401 . . . . 2.54 110.535 179.734 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -71.18 -14.83 62.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.076 -0.511 . . . . 1.19 111.348 179.777 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -65.98 -51.93 54.01 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.435 -0.348 . . . . 1.95 110.979 -179.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 28.7 p-10 -94.58 22.22 6.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.215 -0.448 . . . . 3.19 111.352 -179.649 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 12.1 m120 -134.36 -5.26 2.62 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.371 -0.377 . . . . 2.69 110.979 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 34.3 m-80 -146.4 14.35 1.26 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.34 -0.391 . . . . 2.05 111.046 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 28.4 m-80 62.96 7.69 2.79 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.027 -0.533 . . . . 1.67 111.845 179.578 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 108.0 38.66 1.97 Allowed Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.617 -0.801 . . . . 0.86 112.945 179.49 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.639 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -144.21 155.51 43.92 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.974 0.416 . . . . 0.49 111.195 179.749 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.501 HD11 HD21 ' A' ' 32' ' ' LEU . 8.4 mt -128.37 153.99 46.47 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-N 116.033 -0.53 . . . . 2.05 110.395 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -112.43 156.38 22.64 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 121.143 -0.223 . . . . 1.52 110.696 -179.633 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -42.74 -32.44 0.6 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.285 -0.416 . . . . 0.46 111.074 179.646 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.49 -41.27 55.82 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.209 -0.45 . . . . 1.41 112.012 -179.727 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -63.36 -52.76 60.38 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.323 -0.399 . . . . 1.36 110.493 -179.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.458 ' O ' ' HG3' ' A' ' 72' ' ' MET . 17.8 t80 -59.69 -55.16 37.87 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.933 -0.576 . . . . 0.61 110.478 179.312 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 8.4 t -55.72 -41.96 74.61 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-N 116.077 -0.51 . . . . 1.41 110.468 179.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -48.81 -55.36 11.5 Favored Glycine 0 N--CA 1.45 -0.378 0 CA-C-N 115.462 -0.79 . . . . 0.41 111.952 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.417 ' HA ' ' HG2' ' A' ' 74' ' ' LYS . 9.3 mt -64.41 -36.9 78.57 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 CA-C-O 120.897 0.379 . . . . 1.13 110.422 179.386 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' MET . . . . . 0.458 ' HG3' ' O ' ' A' ' 68' ' ' PHE . 42.4 mtp -60.57 -28.67 68.64 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.87 -0.604 . . . . 1.24 110.055 179.27 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.31 -47.23 62.06 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.672 -0.694 . . . . 1.17 110.433 179.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.417 ' HG2' ' HA ' ' A' ' 71' ' ' ILE . 54.2 pttt -75.14 -24.71 58.02 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.196 -0.457 . . . . 1.91 111.203 179.671 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -80.13 -55.39 4.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.18 -0.464 . . . . 2.03 111.452 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' MET . . . . . 0.439 ' HE2' HD13 ' A' ' 4' ' ' LEU . 11.5 mtm . . . . . 0 N--CA 1.449 -0.495 0 CA-C-N 116.296 -0.411 . . . . 1.52 111.16 -179.754 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.612 ' O ' ' HG3' ' A' ' 85' ' ' MET . 96.7 m . . . . . 0 C--O 1.226 -0.156 0 N-CA-C 110.249 -0.278 . . . . 7.48 110.249 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.505 ' HA ' ' SD ' ' A' ' 85' ' ' MET . 11.8 pt-20 -76.9 -20.65 55.97 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 113.362 0.875 . . . . 9.74 113.362 -177.895 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.408 ' HG3' ' N ' ' A' ' 84' ' ' GLU . 10.9 pt-20 -59.61 -54.8 42.31 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.949 -0.3 . . . . 12.11 111.579 -179.245 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.474 ' HG2' HG23 ' A' ' 81' ' ' THR . 13.0 pt-20 -68.21 -14.39 62.95 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.772 0.32 . . . . 10.87 111.099 -179.678 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' MET . . . . . 0.612 ' HG3' ' O ' ' A' ' 81' ' ' THR . 20.2 mtt -77.66 -52.66 8.62 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.224 -0.444 . . . . 11.09 110.75 -179.5 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 28.2 ttp180 -58.48 -46.92 85.65 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.961 -0.563 . . . . 16.05 110.402 179.862 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.433 ' HA ' ' HE2' ' A' ' 90' ' ' LYS . 1.4 tm-20 -55.78 -48.97 74.41 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 121.146 0.498 . . . . 14.85 109.976 178.917 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -63.76 -28.3 69.78 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.823 -0.626 . . . . 14.11 110.984 179.631 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 70.6 t80 -67.97 -38.02 82.24 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.018 0.437 . . . . 16.42 110.315 179.586 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . 0.433 ' HE2' ' HA ' ' A' ' 87' ' ' GLU . 44.1 mtmt -64.05 -43.77 94.53 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.837 -0.62 . . . . 17.66 110.496 179.583 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 58.2 mt -63.76 -45.59 96.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.172 -0.467 . . . . 18.15 111.254 -179.922 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.519 ' HA ' HG22 ' A' ' 108' ' ' VAL . 6.3 m-85 -70.82 -14.7 62.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.473 -0.33 . . . . 18.34 111.449 -179.688 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -105.8 106.3 16.73 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.897 0.379 . . . . 19.29 110.868 179.791 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.67 -49.56 18.0 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.006 -0.543 . . . . 22.47 111.106 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -74.36 167.52 21.49 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.206 -0.452 . . . . 23.34 110.907 -179.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -94.19 5.16 71.42 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.886 -0.673 . . . . 22.77 112.033 179.609 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -67.89 -27.23 66.48 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.757 0.313 . . . . 23.0 111.189 -179.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 87.43 34.41 10.49 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.796 -0.716 . . . . 20.02 112.506 179.658 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . 0.49 ' HA ' ' O ' ' A' ' 136' ' ' ILE . 96.4 m-85 -141.08 147.46 38.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.663 0.268 . . . . 20.56 110.982 -179.954 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.504 ' HB ' ' HB ' ' A' ' 136' ' ' ILE . 58.3 mt -114.48 122.44 68.6 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 CA-C-N 116.24 -0.436 . . . . 19.37 111.265 -179.904 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 23.3 m -115.04 156.7 44.93 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 115.781 -0.645 . . . . 22.65 110.338 179.796 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 92.1 Cg_exo -41.18 -33.16 1.26 Allowed 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.408 2.072 . . . . 23.78 112.764 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.76 -41.73 87.29 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.249 -0.432 . . . . 25.0 111.498 -179.776 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -79.87 -49.53 11.81 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.863 -0.608 . . . . 22.31 110.114 -179.482 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.489 HD22 ' HE2' ' A' ' 124' ' ' MET . 49.3 tp -51.95 -32.56 33.78 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.274 -0.875 . . . . 20.62 110.922 179.515 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 7.3 tmm_? -77.39 -48.23 17.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.754 -0.657 . . . . 27.9 110.987 -179.747 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 66.2 t80 -58.82 -34.41 71.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.215 -0.448 . . . . 25.96 111.557 -179.636 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.519 HG22 ' HA ' ' A' ' 92' ' ' PHE . 46.5 t -80.26 -53.71 12.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 N-CA-C 112.352 0.501 . . . . 21.06 112.352 -178.719 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.403 ' SD ' HG21 ' A' ' 116' ' ' VAL . 1.5 mtt -47.06 -37.44 9.47 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 111.858 0.318 . . . . 20.93 111.858 -179.333 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 89.2 mt -64.7 -35.02 73.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.773 0.32 . . . . 25.52 110.928 179.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -67.61 -39.1 84.77 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.185 -0.461 . . . . 23.32 110.598 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.4 HD13 ' N ' ' A' ' 112' ' ' LEU . 8.6 mp -67.29 -43.25 82.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.987 -0.551 . . . . 21.07 110.822 -179.971 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 117.98 21.16 4.26 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.771 -0.728 . . . . 23.25 112.617 179.636 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -83.16 -23.01 33.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.566 0.222 . . . . 22.59 111.352 -179.841 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp 50.21 85.39 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.278 -0.419 . . . . 28.21 110.994 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . 0.415 HG11 ' OE1' ' A' ' 120' ' ' GLU . 8.8 m -129.17 155.79 41.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.138 -0.483 . . . . 24.75 111.844 -179.545 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' THR . . . . . 0.447 ' O ' HG12 ' A' ' 121' ' ' ILE . 57.8 p -100.62 148.48 24.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.673 -0.694 . . . . 27.5 110.084 179.072 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . 0.442 ' HA ' HD11 ' A' ' 121' ' ' ILE . 9.2 m-20 -51.83 -19.48 1.72 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.363 -0.38 . . . . 27.03 111.727 -179.37 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -78.95 -55.43 5.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.441 -0.345 . . . . 29.14 111.755 -179.443 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . 0.415 ' OE1' HG11 ' A' ' 116' ' ' VAL . 14.5 pt-20 -60.84 -39.33 88.7 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.569 -0.287 . . . . 24.7 111.754 -179.245 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.553 HG13 ' N ' ' A' ' 122' ' ' ASP . 9.5 pt -69.86 -46.69 73.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 120.918 -0.313 . . . . 22.9 111.517 -179.69 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . 0.553 ' N ' HG13 ' A' ' 121' ' ' ILE . 13.7 t70 -50.95 -41.11 58.83 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.835 0.35 . . . . 24.29 110.529 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -61.84 -54.37 43.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.045 -0.525 . . . . 24.74 110.131 179.189 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' MET . . . . . 0.489 ' HE2' HD22 ' A' ' 105' ' ' LEU . 5.4 tmm? -51.2 -34.26 31.04 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 115.817 -0.629 . . . . 20.15 110.745 179.357 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.453 HD11 HD21 ' A' ' 105' ' ' LEU . 69.9 mt -65.01 -41.3 91.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.0 -0.546 . . . . 20.23 110.448 179.519 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 55.3 ttt180 -57.62 -38.26 74.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.745 -0.661 . . . . 25.57 110.402 179.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -61.69 -48.21 81.81 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.647 -0.706 . . . . 19.18 111.186 179.622 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.54 ' HB3' ' HB3' ' A' ' 144' ' ' MET . . . -81.73 -7.38 59.59 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.097 -0.502 . . . . 16.88 111.167 -179.674 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -100.42 107.23 18.92 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.221 -0.445 . . . . 20.4 110.857 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 68.9 m-85 -94.06 -42.76 8.84 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.684 -0.689 . . . . 21.43 111.128 -179.748 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -55.9 -34.48 65.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.053 -0.521 . . . . 23.37 111.048 -179.627 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 81.17 72.24 1.24 Allowed Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.858 -0.686 . . . . 24.32 112.589 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -143.08 -5.54 0.87 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.717 0.294 . . . . 24.4 111.305 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 77.47 8.8 87.1 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.795 -0.717 . . . . 23.47 112.536 179.839 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 61.9 mtp -121.34 155.33 34.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.752 0.311 . . . . 22.91 110.516 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.514 HG21 ' N ' ' A' ' 137' ' ' ASN . 38.7 mm -115.61 142.33 29.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 121.217 0.532 . . . . 18.67 112.092 -179.434 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . 0.514 ' N ' HG21 ' A' ' 136' ' ' ILE . 54.3 t30 -115.71 157.54 24.12 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.323 -0.853 . . . . 16.97 108.985 178.431 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 45.7 t80 -39.7 -24.62 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 120.628 0.251 . . . . 15.28 111.604 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . 0.443 ' N ' ' O ' ' A' ' 137' ' ' ASN . 46.7 mt-10 -80.79 -55.42 4.82 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.724 0.297 . . . . 14.82 110.803 -179.871 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . 0.506 ' HB2' HG21 ' A' ' 136' ' ' ILE . 29.6 mt-10 -58.66 -35.64 72.87 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.152 0.501 . . . . 17.46 110.256 179.614 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.594 ' HA ' ' HE3' ' A' ' 144' ' ' MET . 86.9 t80 -65.39 -55.43 18.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.658 -0.701 . . . . 13.65 110.296 179.484 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . 0.522 ' HA ' HD13 ' A' ' 145' ' ' ILE . 2.6 t -48.53 -34.18 5.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.55 -0.75 . . . . 11.12 111.78 179.366 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 143' ' ' TRP . . . . . 0.487 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 92.5 t90 -71.53 -55.51 7.69 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.577 0.584 . . . . 14.4 112.577 -178.79 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 144' ' ' MET . . . . . 0.594 ' HE3' ' HA ' ' A' ' 141' ' ' PHE . 21.5 ptt? -63.33 -26.53 68.8 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 112.819 0.674 . . . . 14.63 112.819 -177.675 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 145' ' ' ILE . . . . . 0.522 HD13 ' HA ' ' A' ' 142' ' ' VAL . 47.4 pt -81.01 -37.67 16.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 112.318 0.488 . . . . 11.62 112.318 -179.525 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 146' ' ' SER . . . . . 0.507 ' N ' HG13 ' A' ' 145' ' ' ILE . 33.2 t -59.32 -14.25 10.92 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.32 0.581 . . . . 8.66 110.583 -179.537 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 147' ' ' GLN . . . . . 0.487 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 3.5 mm-40 -100.58 -20.5 15.66 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.298 -0.865 . . . . 11.87 111.245 -178.993 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 68.5 mttm . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.179 -0.915 . . . . 13.97 110.87 179.744 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 15.6 mt . . . . . 0 C--O 1.232 0.135 0 CA-C-O 120.843 0.354 . . . . 2.0 111.051 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 75.0 p -69.41 -169.11 0.19 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.103 -0.499 . . . . 1.72 111.44 -179.65 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -76.25 -38.26 56.54 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.35 -0.386 . . . . 2.2 111.025 -179.565 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -72.75 -42.45 64.04 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.143 -0.48 . . . . 1.35 110.928 -179.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -60.16 -47.81 84.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.144 -0.48 . . . . 2.34 110.645 179.758 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . 0.554 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 82.4 mt -57.38 -52.23 59.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.863 -0.608 . . . . 1.27 111.195 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.91 -23.67 65.41 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.276 -0.42 . . . . 1.22 112.024 -179.411 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -71.42 -57.36 4.51 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 111.865 0.32 . . . . 2.27 111.865 -179.124 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.554 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 17.2 p90 -77.52 -23.43 50.19 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 120.47 -0.492 . . . . 0.46 110.645 -179.546 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.437 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 19.9 tptm -66.94 -36.07 81.4 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 109.229 -0.656 . . . . 1.85 109.229 178.528 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -67.89 -46.3 72.02 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 108.75 -0.833 . . . . 0.44 108.75 178.081 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.03 -14.46 61.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.488 -0.778 . . . . 1.08 110.188 178.628 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.437 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 49.9 t80 -80.0 -52.16 8.18 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.819 -0.628 . . . . 0.56 110.683 -179.839 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 24.6 m -63.43 -24.95 37.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.118 -0.492 . . . . 1.69 110.516 -179.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 61.3 mm-40 -57.7 -28.67 64.04 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.671 -0.695 . . . . 2.23 111.331 179.544 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -105.23 36.53 2.45 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.665 0.269 . . . . 0.69 111.472 -179.692 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -129.69 68.9 1.42 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.157 0.503 . . . . 0.46 110.396 179.398 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -83.07 5.14 23.4 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.655 -0.702 . . . . 2.55 111.222 -179.727 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -103.0 -2.77 27.03 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.367 -0.379 . . . . 1.8 111.193 -179.519 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 63.23 17.89 59.85 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.828 -0.701 . . . . 0.54 112.812 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 37.5 p -92.18 8.39 38.24 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.71 0.291 . . . . 1.1 111.242 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 54.14 21.45 18.26 Favored Glycine 0 C--N 1.333 0.383 0 C-N-CA 120.732 -0.747 . . . . 0.37 111.79 -179.445 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.639 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 36.5 mtpt -133.96 155.76 49.37 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.549 -0.326 . . . . 1.75 110.551 -179.295 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.457 ' N ' HE22 ' A' ' 62' ' ' GLN . 49.1 pt -118.73 130.89 72.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 120.901 0.382 . . . . 1.2 111.684 -179.781 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -54.1 135.68 43.1 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.226 -0.443 . . . . 1.04 111.025 179.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.3 t -63.11 -22.2 66.7 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.047 -0.524 . . . . 1.71 111.223 -179.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 41.1 mtp180 -77.74 -3.89 43.56 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.082 -0.508 . . . . 3.53 110.459 179.774 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -113.53 -5.43 13.45 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.942 -0.572 . . . . 2.26 111.142 -179.804 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.57 -44.76 95.84 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 110.15 -0.315 . . . . 1.95 110.15 179.65 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -58.43 -43.39 95.86 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.332 -0.937 . . . . 0.32 110.976 178.828 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 44.8 m -65.16 -30.72 71.66 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.494 -0.558 . . . . 1.01 109.494 178.544 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 13.7 tp -64.21 -35.4 80.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.382 -0.826 . . . . 1.85 109.506 179.247 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.516 ' HG3' ' HG3' ' A' ' 43' ' ' PRO . 20.3 mmt -66.4 -41.28 89.56 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 115.535 -0.757 . . . . 1.43 109.895 178.852 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 59.8 mtp180 -63.5 -26.95 68.95 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.628 -0.715 . . . . 3.27 109.93 179.075 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.498 HG21 HD12 ' A' ' 39' ' ' LEU . 2.5 m -79.32 -16.56 56.16 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.536 -0.757 . . . . 1.54 110.025 179.322 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.498 HD12 HG21 ' A' ' 38' ' ' THR . 10.3 mp -113.99 157.74 22.07 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.261 -0.881 . . . . 1.94 110.225 179.861 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -74.03 36.33 0.91 Allowed Glycine 0 CA--C 1.519 0.319 0 C-N-CA 120.498 -0.858 . . . . 0.69 112.439 179.485 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.459 ' H ' ' C ' ' A' ' 39' ' ' LEU . 4.5 mm100 -89.29 -70.57 0.65 Allowed 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.831 0.348 . . . . 1.97 111.306 -179.88 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 60.24 67.48 1.64 Allowed Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 115.945 -0.57 . . . . 3.44 110.488 -179.189 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . 0.516 ' HG3' ' HG3' ' A' ' 36' ' ' MET . 69.3 Cg_endo -72.8 -172.86 1.04 Allowed 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.68 2.253 . . . . 0.59 112.466 -179.88 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -93.01 150.35 20.6 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.936 -0.574 . . . . 1.28 111.003 179.684 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.474 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 15.6 mt-10 -54.6 -46.13 73.77 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.524 -0.307 . . . . 2.7 110.645 179.685 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -55.69 -52.94 62.16 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.302 -0.408 . . . . 1.15 111.067 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -54.62 -47.26 73.65 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.182 -0.463 . . . . 2.23 110.893 -179.884 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.461 HD21 HD13 ' A' ' 52' ' ' ILE . 15.3 mt -60.39 -45.29 94.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.323 -0.399 . . . . 2.01 110.971 179.746 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.474 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 33.0 mm-40 -63.08 -33.67 75.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.693 0.282 . . . . 1.68 111.145 -179.717 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -72.12 -54.03 10.97 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.214 0.45 . . . . 0.62 112.214 -179.299 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 3.2 pp -69.99 -41.26 74.63 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.127 0.417 . . . . 1.11 112.127 -178.768 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.461 HD13 HD21 ' A' ' 48' ' ' LEU . 86.6 mt -65.3 -38.72 83.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-O 120.485 0.183 . . . . 1.25 111.093 -179.654 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.65 -37.91 83.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.89 0.376 . . . . 1.24 110.516 179.487 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -64.38 -40.89 96.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.069 -0.514 . . . . 2.54 109.994 179.164 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -80.16 -14.76 58.22 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.968 -0.56 . . . . 1.19 111.021 179.241 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -66.57 -49.96 64.69 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.262 -0.426 . . . . 1.95 110.948 -179.885 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 34.9 m-80 -85.88 34.85 0.61 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.151 -0.477 . . . . 3.19 110.806 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -157.41 151.57 24.73 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.165 -0.47 . . . . 2.69 110.757 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 4.1 m120 63.25 10.3 4.57 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.981 -0.554 . . . . 2.05 111.404 179.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 15.2 m120 62.74 13.33 6.34 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.336 -0.393 . . . . 1.67 111.845 179.702 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 104.67 38.5 2.55 Favored Glycine 0 C--N 1.33 0.247 0 C-N-CA 120.551 -0.833 . . . . 0.86 112.763 179.419 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.639 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -142.5 155.61 45.06 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.991 0.424 . . . . 0.49 110.886 179.688 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 29.0 mt -127.19 154.22 45.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.233 -0.44 . . . . 2.05 110.92 -179.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . 0.493 ' OD1' ' HE3' ' A' ' 26' ' ' LYS . 0.3 OUTLIER -114.37 157.33 22.98 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.665 -0.494 . . . . 1.52 109.665 179.113 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 90.6 t80 -41.19 -33.88 0.41 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.578 0.228 . . . . 0.46 111.361 179.871 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 8.2 m -70.78 -39.84 72.95 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.505 -0.316 . . . . 1.41 111.622 -179.766 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -59.71 -55.75 30.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.126 0.489 . . . . 1.36 110.804 179.668 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 25.3 t80 -63.77 -52.26 61.15 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.649 -0.705 . . . . 0.61 111.145 -179.646 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 19.4 t -53.87 -40.85 66.92 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-O 121.378 0.609 . . . . 1.41 109.886 179.577 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -53.38 -46.6 64.09 Favored Glycine 0 CA--C 1.503 -0.704 0 CA-C-N 114.909 -1.041 . . . . 0.41 111.719 179.523 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.513 ' HA ' ' HG2' ' A' ' 74' ' ' LYS . 44.8 mt -73.42 -45.86 50.89 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.93 0 CA-C-O 120.863 0.364 . . . . 1.13 111.44 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' MET . . . . . 0.416 ' O ' ' HB2' ' A' ' 76' ' ' MET . 0.1 OUTLIER -52.18 -33.45 40.73 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.816 -0.629 . . . . 1.24 110.181 179.235 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.91 -51.07 43.88 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.729 -0.669 . . . . 1.17 110.874 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.513 ' HG2' ' HA ' ' A' ' 71' ' ' ILE . 63.6 pttt -69.63 -27.27 64.92 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 120.85 0.357 . . . . 1.91 111.622 -179.82 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . 0.448 ' NE2' ' HB3' ' A' ' 43' ' ' PRO . 30.8 tt0 -80.63 -55.11 5.07 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.24 -0.436 . . . . 2.03 111.816 -179.141 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' MET . . . . . 0.416 ' HB2' ' O ' ' A' ' 72' ' ' MET . 31.6 mtm . . . . . 0 N--CA 1.451 -0.42 0 CA-C-N 116.313 -0.403 . . . . 1.52 111.166 -179.514 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.429 ' O ' ' HG3' ' A' ' 85' ' ' MET . 75.4 m . . . . . 0 N--CA 1.461 0.105 0 CA-C-O 120.644 0.259 . . . . 7.48 110.571 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.536 ' HA ' ' SD ' ' A' ' 85' ' ' MET . 44.9 mt-10 -79.78 -16.69 55.07 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 112.534 0.568 . . . . 9.74 112.534 -178.713 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -69.18 -55.85 9.38 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.697 0.284 . . . . 12.11 111.638 -179.402 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -63.42 -15.23 56.99 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.922 0.392 . . . . 10.87 111.061 -179.798 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' MET . . . . . 0.536 ' SD ' ' HA ' ' A' ' 82' ' ' GLU . 19.0 mtt -80.18 -53.81 6.33 Favored 'General case' 0 CA--C 1.514 -0.405 0 CA-C-N 116.087 -0.506 . . . . 11.09 110.224 -179.65 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.497 ' HE ' ' HZ1' ' A' ' 90' ' ' LYS . 38.4 ttt180 -51.56 -41.04 60.84 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.28 -0.873 . . . . 16.05 110.378 179.362 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -72.15 -35.17 69.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.122 -0.49 . . . . 14.85 110.423 179.274 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -69.17 -28.3 66.29 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.123 -0.49 . . . . 14.11 111.051 179.713 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 86.3 t80 -73.82 -46.21 46.6 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.322 -0.399 . . . . 16.42 110.445 179.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . 0.497 ' HZ1' ' HE ' ' A' ' 86' ' ' ARG . 90.5 mttt -58.25 -38.14 76.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.015 -0.539 . . . . 17.66 110.309 179.32 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 86.2 mt -75.69 -38.63 38.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.697 -0.683 . . . . 18.15 111.314 -179.782 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.4 ' O ' ' NE ' ' A' ' 94' ' ' ARG . 0.2 OUTLIER -66.14 -56.85 9.37 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.494 -0.321 . . . . 18.34 111.108 -179.621 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . 0.561 ' HA ' HH21 ' A' ' 94' ' ' ARG . 44.1 t0 -49.11 123.44 7.25 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-O 120.789 0.328 . . . . 19.29 110.253 -179.884 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.671 ' H ' ' HE ' ' A' ' 94' ' ' ARG . 0.0 OUTLIER -91.84 -7.44 49.41 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.209 -0.45 . . . . 22.47 111.848 -178.513 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -126.55 -176.68 3.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.921 0.391 . . . . 23.34 110.904 179.788 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.45 0.7 55.71 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.916 -0.659 . . . . 22.77 112.229 179.643 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.93 -37.98 89.44 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.758 0.313 . . . . 23.0 111.239 -179.86 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 95.55 20.53 26.71 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.853 -0.689 . . . . 20.02 112.6 179.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . 0.407 ' HA ' ' O ' ' A' ' 136' ' ' ILE . 95.7 m-85 -136.32 151.77 49.96 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.702 0.286 . . . . 20.56 110.803 179.855 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.477 ' HB ' ' HB ' ' A' ' 136' ' ' ILE . 45.7 mt -114.96 133.04 62.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-O 121.096 0.474 . . . . 19.37 111.66 -179.606 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 75.7 m -114.57 156.06 45.19 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 115.576 -0.738 . . . . 22.65 110.119 179.2 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_exo -42.45 -47.53 7.38 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.529 2.153 . . . . 23.78 112.699 -179.454 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -59.61 -42.89 93.66 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.199 0.523 . . . . 25.0 111.045 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -65.51 -55.13 19.49 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.655 -0.702 . . . . 22.31 109.796 -179.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.568 HD22 ' HE2' ' A' ' 124' ' ' MET . 40.6 tp -49.26 -34.63 15.6 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.002 -0.999 . . . . 20.62 110.325 179.443 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.406 ' O ' HG13 ' A' ' 110' ' ' ILE . 2.4 tmm_? -69.86 -35.99 75.15 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.591 -0.732 . . . . 27.9 110.873 -179.781 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 68.0 t80 -67.0 -48.53 68.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.064 -0.516 . . . . 25.96 112.213 -179.389 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.432 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 99.3 t -67.92 -48.79 73.65 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 N-CA-C 112.103 0.408 . . . . 21.06 112.103 -179.045 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.481 ' HE2' HD13 ' A' ' 112' ' ' LEU . 2.2 mmt -45.23 -33.92 2.57 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 120.839 0.352 . . . . 20.93 110.833 179.987 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.406 HG13 ' O ' ' A' ' 106' ' ' ARG . 67.2 mt -74.05 -44.38 50.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.105 -0.498 . . . . 25.52 110.766 179.501 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 81.2 m-20 -59.56 -24.97 64.16 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.947 -0.57 . . . . 23.32 110.699 179.641 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.481 HD13 ' HE2' ' A' ' 109' ' ' MET . 64.0 mt -75.67 -32.52 60.19 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.94 -0.573 . . . . 21.07 110.626 179.997 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 121.71 -2.77 11.03 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.821 -0.704 . . . . 23.25 112.847 179.596 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -109.87 122.5 47.67 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.896 0.379 . . . . 22.59 111.379 -179.76 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 63.8 tttm -80.24 142.71 34.37 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.073 -0.512 . . . . 28.21 110.601 179.65 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . 0.455 ' HB ' HG21 ' A' ' 121' ' ' ILE . 1.9 m -150.09 155.51 7.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 121.074 0.464 . . . . 24.75 111.791 -179.697 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' THR . . . . . 0.413 ' O ' HG12 ' A' ' 121' ' ' ILE . 61.5 p -100.03 144.13 29.43 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.706 -0.679 . . . . 27.5 110.153 179.169 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -51.38 -18.98 1.16 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.265 -0.425 . . . . 27.03 111.698 -179.449 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -78.23 -54.08 6.63 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.575 -0.284 . . . . 29.14 111.647 -179.579 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -63.86 -40.34 96.35 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 111.808 0.299 . . . . 24.7 111.808 -179.146 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.52 HG13 ' N ' ' A' ' 122' ' ' ASP . 11.4 pt -70.64 -41.65 77.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 C-N-CA 121.025 -0.27 . . . . 22.9 111.588 -179.524 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . 0.52 ' N ' HG13 ' A' ' 121' ' ' ILE . 21.4 t70 -58.7 -37.36 75.92 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.975 0.417 . . . . 24.29 110.161 179.568 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -65.82 -41.87 91.32 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.973 -0.558 . . . . 24.74 110.067 179.285 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' MET . . . . . 0.568 ' HE2' HD22 ' A' ' 105' ' ' LEU . 67.7 ttp -57.97 -36.56 72.76 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.069 -0.514 . . . . 20.15 110.057 178.969 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.417 HG23 HD13 ' A' ' 136' ' ' ILE . 84.1 mt -63.21 -42.64 97.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.799 -0.637 . . . . 20.23 109.822 179.203 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 1.8 tmm_? -58.06 -52.0 67.35 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.512 -0.767 . . . . 25.57 110.335 179.406 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -54.59 -23.57 17.5 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.124 -0.944 . . . . 19.18 111.78 -179.894 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.614 ' HB1' ' HB3' ' A' ' 144' ' ' MET . . . -107.53 -10.58 15.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.839 0.352 . . . . 16.88 111.497 -179.776 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 27.6 t0 -98.36 106.14 18.38 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.218 -0.446 . . . . 20.4 110.932 -179.529 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 34.5 m-85 -85.41 -48.47 8.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.845 -0.616 . . . . 21.43 111.287 -179.59 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -60.14 -21.9 62.17 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.174 -0.466 . . . . 23.37 111.38 -179.656 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 60.75 77.01 0.2 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.654 -0.784 . . . . 24.32 112.614 179.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 13.1 p-10 -133.82 -15.83 2.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.848 0.356 . . . . 24.4 110.786 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 93.14 10.43 59.67 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.854 -0.688 . . . . 23.47 112.391 -179.887 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 38.1 mtp -131.31 154.52 48.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.606 0.241 . . . . 22.91 110.551 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.514 HG22 ' HB2' ' A' ' 140' ' ' GLU . 36.9 mm -114.86 144.23 22.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 121.331 0.586 . . . . 18.67 111.992 -179.256 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . 0.48 ' N ' HG22 ' A' ' 136' ' ' ILE . 48.9 t30 -114.8 157.06 23.77 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.069 -0.969 . . . . 16.97 108.94 178.364 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 7.9 t80 -41.71 -23.14 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 120.663 0.268 . . . . 15.28 111.524 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . 0.425 ' N ' ' O ' ' A' ' 137' ' ' ASN . 44.5 mt-10 -80.22 -56.01 4.52 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.684 0.278 . . . . 14.82 110.946 -179.806 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . 0.514 ' HB2' HG22 ' A' ' 136' ' ' ILE . 34.1 mt-10 -59.23 -31.39 69.01 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.155 0.502 . . . . 17.46 110.23 179.629 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.599 ' HA ' ' HE2' ' A' ' 144' ' ' MET . 89.0 t80 -69.34 -55.48 10.29 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.503 -0.771 . . . . 13.65 110.271 179.568 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . 0.524 HG23 ' HB3' ' A' ' 85' ' ' MET . 2.4 t -44.43 -42.38 2.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.569 -0.741 . . . . 11.12 112.036 179.075 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 143' ' ' TRP . . . . . 0.479 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 92.6 t90 -69.94 -56.09 7.94 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.329 0.492 . . . . 14.4 112.329 -178.849 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 144' ' ' MET . . . . . 0.614 ' HB3' ' HB1' ' A' ' 128' ' ' ALA . 20.3 ptt? -61.72 -21.17 64.26 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 113.27 0.841 . . . . 14.63 113.27 -177.723 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 145' ' ' ILE . . . . . 0.591 ' HA ' ' HB2' ' A' ' 148' ' ' LYS . 38.0 pt -80.79 -43.9 21.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 C-N-CA 120.619 -0.432 . . . . 11.62 111.813 -179.939 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 146' ' ' SER . . . . . 0.467 ' N ' HG13 ' A' ' 145' ' ' ILE . 31.2 t -63.07 -14.69 51.33 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.297 0.57 . . . . 8.66 109.933 179.602 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 147' ' ' GLN . . . . . 0.479 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 2.4 mm-40 -119.52 2.8 11.25 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.171 -0.922 . . . . 11.87 110.488 -179.232 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . 0.591 ' HB2' ' HA ' ' A' ' 145' ' ' ILE . 26.3 ttpp . . . . . 0 C--O 1.25 1.084 0 CA-C-O 118.249 -0.882 . . . . 13.97 110.987 -179.793 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.415 ' HG ' ' HE2' ' A' ' 12' ' ' PHE . 7.9 mp . . . . . 0 CA--C 1.528 0.134 0 CA-C-O 120.764 0.316 . . . . 2.0 110.896 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 36.9 p -78.63 -173.39 3.38 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.208 -0.451 . . . . 1.72 111.538 -179.77 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -63.68 -42.91 97.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.272 -0.422 . . . . 2.2 111.515 -179.664 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -69.83 -42.44 73.6 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.082 0.467 . . . . 1.35 110.51 -179.615 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 28.0 mt-30 -63.84 -41.39 97.83 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.564 -0.744 . . . . 2.34 110.671 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . 0.483 ' HA ' ' CZ ' ' A' ' 12' ' ' PHE . 45.8 mt -60.71 -51.95 67.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.034 -0.53 . . . . 1.27 110.57 179.592 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.94 -23.19 66.2 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.022 -0.535 . . . . 1.22 111.376 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -69.8 -56.64 6.6 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 111.903 0.334 . . . . 2.27 111.903 -179.224 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.483 ' CZ ' ' HA ' ' A' ' 9' ' ' ILE . 11.0 p90 -78.83 -26.92 44.2 Favored 'General case' 0 C--N 1.332 -0.187 0 C-N-CA 120.491 -0.484 . . . . 0.46 110.879 -179.78 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 19.4 tptm -63.67 -34.68 78.4 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.208 -0.664 . . . . 1.85 109.208 178.701 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.414 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 18.2 t70 -70.23 -53.34 17.4 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.644 -0.707 . . . . 0.44 109.206 178.384 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.0 -14.29 22.03 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.535 -0.757 . . . . 1.08 110.749 179.165 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 41.8 t80 -80.34 -52.84 7.21 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.957 -0.565 . . . . 0.56 110.961 -179.746 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 23.3 m -66.97 -17.92 23.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.076 -0.511 . . . . 1.69 110.787 -179.595 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.414 ' HG2' ' O ' ' A' ' 14' ' ' ASP . 74.0 mm-40 -65.95 -29.52 69.93 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.81 -0.632 . . . . 2.23 111.636 179.857 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 36.4 m-85 -101.24 18.34 20.19 Favored 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 111.818 0.303 . . . . 0.69 111.818 -179.665 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -115.23 80.37 1.42 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.966 0.413 . . . . 0.46 110.798 179.424 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 14.1 tppt? -87.82 -29.39 20.99 Favored 'General case' 0 N--CA 1.441 -0.918 0 CA-C-N 115.878 -0.601 . . . . 2.55 110.66 -179.872 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -68.07 -16.72 64.14 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.116 -0.493 . . . . 1.8 111.404 -179.473 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.39 9.67 86.82 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.731 -0.747 . . . . 0.54 112.937 179.703 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 34.6 p -79.65 8.18 7.04 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.619 0.247 . . . . 1.1 111.012 179.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 55.43 21.43 27.12 Favored Glycine 0 C--N 1.333 0.379 0 C-N-CA 120.733 -0.746 . . . . 0.37 111.707 -179.58 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.636 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 53.9 mtpt -134.88 155.13 51.22 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.577 -0.311 . . . . 1.75 110.775 -179.091 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.626 HG13 ' HB2' ' A' ' 63' ' ' LEU . 20.5 pt -115.52 127.7 73.01 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.317 0 CA-C-O 120.921 0.391 . . . . 1.2 111.964 -178.963 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -53.09 139.84 27.32 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.1 -0.5 . . . . 1.04 111.427 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.401 ' HA ' HD11 ' A' ' 63' ' ' LEU . 7.3 t -65.72 -20.9 66.45 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.992 -0.549 . . . . 1.71 111.454 -179.749 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.478 ' H ' ' HD3' ' A' ' 30' ' ' ARG . 0.0 OUTLIER -83.6 5.08 25.59 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.881 0.372 . . . . 3.53 110.48 179.64 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -120.29 -6.65 9.85 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.845 -0.616 . . . . 2.26 111.006 -179.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.484 HD13 HD12 ' A' ' 51' ' ' LEU . 10.3 tt -58.46 -51.5 69.57 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 116.482 -0.326 . . . . 1.95 110.791 179.751 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.4 ' HA2' HD21 ' A' ' 48' ' ' LEU . . . -52.7 -48.07 57.07 Favored Glycine 0 C--N 1.332 0.331 0 C-N-CA 120.33 -0.938 . . . . 0.32 111.335 179.405 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.468 ' HA ' ' HG2' ' A' ' 37' ' ' ARG . 88.6 m -57.94 -36.65 72.81 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.394 0.616 . . . . 1.01 109.54 178.493 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.5 -32.1 73.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.087 -0.961 . . . . 1.85 110.297 179.532 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 23.7 mmt -73.83 -26.72 60.74 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.891 -0.595 . . . . 1.43 110.316 179.388 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.468 ' HG2' ' HA ' ' A' ' 34' ' ' THR . 17.9 mmt180 -66.78 -50.86 61.33 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.818 -0.628 . . . . 3.27 110.271 179.566 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.428 HG23 ' HG ' ' A' ' 39' ' ' LEU . 7.9 t -65.05 -12.62 52.55 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.772 -0.649 . . . . 1.54 111.313 179.833 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.451 ' C ' ' H ' ' A' ' 41' ' ' GLN . 64.8 mt -112.77 156.32 23.05 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.205 -0.452 . . . . 1.94 110.614 -179.825 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -67.45 10.68 0.94 Allowed Glycine 0 CA--C 1.521 0.441 0 C-N-CA 121.022 -0.608 . . . . 0.69 113.141 -179.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.451 ' H ' ' C ' ' A' ' 39' ' ' LEU . 15.8 mm-40 -67.4 -79.03 0.05 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.92 0.39 . . . . 1.97 111.122 179.798 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 56.44 68.7 2.09 Favored Pre-proline 0 C--N 1.331 -0.217 0 CA-C-N 115.923 -0.581 . . . . 3.44 111.065 -179.628 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . 0.555 ' HG2' HD23 ' A' ' 48' ' ' LEU . 61.5 Cg_endo -71.9 -171.53 0.69 Allowed 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.687 2.258 . . . . 0.59 112.346 179.86 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 38.1 m -94.87 152.42 18.39 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.161 -0.472 . . . . 1.28 110.639 179.716 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.406 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 37.4 tt0 -48.85 -53.07 20.91 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.574 -0.285 . . . . 2.7 111.28 -179.651 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -46.92 -54.69 9.49 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.298 -0.41 . . . . 1.15 111.424 -179.752 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -54.91 -50.29 69.17 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.358 -0.383 . . . . 2.23 110.82 179.876 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.555 HD23 ' HG2' ' A' ' 43' ' ' PRO . 0.1 OUTLIER -55.82 -36.09 67.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.115 -0.493 . . . . 2.01 111.032 -179.879 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.406 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 28.5 mm-40 -75.88 -32.16 59.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.256 -0.429 . . . . 1.68 111.247 -179.707 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 64.7 m-20 -70.1 -55.42 9.5 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.464 -0.334 . . . . 0.62 111.09 -179.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.495 HD22 ' HA ' ' A' ' 48' ' ' LEU . 1.9 pp -59.19 -39.44 82.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.314 -0.403 . . . . 1.11 111.116 -179.923 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 35.8 mt -64.52 -40.8 90.31 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-O 120.636 0.255 . . . . 1.25 110.594 179.429 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.89 -30.92 71.2 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.383 -0.371 . . . . 1.24 111.003 179.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -80.46 -47.33 14.49 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.105 -0.498 . . . . 2.54 111.394 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -75.49 -14.86 60.45 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.351 0.5 . . . . 1.19 112.351 -179.16 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -69.31 -38.71 78.37 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.705 0.288 . . . . 1.95 111.065 -179.486 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 30.6 m-80 -95.25 28.79 2.71 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.346 -0.388 . . . . 3.19 110.563 179.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.588 HD21 ' N ' ' A' ' 59' ' ' ASN . 0.2 OUTLIER -148.92 138.43 21.8 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.109 -0.496 . . . . 2.69 110.542 -179.679 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . 0.588 ' N ' HD21 ' A' ' 58' ' ' ASN . 77.4 m-20 62.68 14.58 7.33 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.181 -0.463 . . . . 2.05 111.118 179.909 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 22.3 m-80 58.47 13.62 2.58 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.034 -0.53 . . . . 1.67 111.711 179.469 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 113.78 48.22 0.59 Allowed Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.564 -0.827 . . . . 0.86 113.045 179.483 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.636 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -146.22 153.8 41.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.109 0.48 . . . . 0.49 111.198 179.513 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.626 ' HB2' HG13 ' A' ' 27' ' ' ILE . 16.3 mt -126.6 156.71 40.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.631 -0.713 . . . . 2.05 110.549 -179.623 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . 0.437 ' OD1' ' HE3' ' A' ' 26' ' ' LYS . 0.1 OUTLIER -112.68 156.6 22.48 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 121.023 -0.271 . . . . 1.52 110.447 179.674 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.413 ' O ' ' HB2' ' A' ' 69' ' ' CYS . 83.9 t80 -45.59 -32.51 2.35 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.751 0.31 . . . . 0.46 110.998 179.639 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -80.39 -36.86 33.28 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 112.16 0.43 . . . . 1.41 112.16 -179.555 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -62.71 -51.54 66.79 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.473 0.654 . . . . 1.36 109.802 179.478 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.424 ' O ' ' HG3' ' A' ' 72' ' ' MET . 35.3 t80 -61.66 -48.13 82.23 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.999 -1.0 . . . . 0.61 110.578 179.378 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.413 ' HB2' ' O ' ' A' ' 65' ' ' PHE . 7.8 t -57.96 -48.36 80.18 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.156 -0.475 . . . . 1.41 110.528 179.86 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -48.47 -48.6 27.81 Favored Glycine 0 N--CA 1.45 -0.415 0 CA-C-N 115.72 -0.673 . . . . 0.41 112.03 179.863 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.538 HG23 ' HE2' ' A' ' 74' ' ' LYS . 15.3 mt -63.49 -43.65 98.46 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.362 0 CA-C-O 121.153 0.502 . . . . 1.13 110.504 179.41 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' MET . . . . . 0.424 ' HG3' ' O ' ' A' ' 68' ' ' PHE . 49.6 mtp -58.34 -26.67 63.38 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.637 -0.71 . . . . 1.24 110.076 179.535 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -72.55 -43.66 63.18 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.003 -0.544 . . . . 1.17 110.704 179.557 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.538 ' HE2' HG23 ' A' ' 71' ' ' ILE . 48.7 pttt -73.9 -30.29 62.52 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.234 -0.439 . . . . 1.91 111.125 -179.877 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -80.45 -47.19 14.7 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.112 0.412 . . . . 2.03 112.112 -179.694 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' MET . . . . . 0.41 ' HB2' ' O ' ' A' ' 72' ' ' MET . 48.2 mtp . . . . . 0 N--CA 1.453 -0.279 0 N-CA-C 112.065 0.395 . . . . 1.52 112.065 -179.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.454 ' HG1' ' H ' ' A' ' 83' ' ' GLU . 5.7 t . . . . . 0 CA--C 1.528 0.099 0 CA-C-O 121.073 0.463 . . . . 7.48 111.042 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -55.87 -17.65 6.91 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.917 -0.583 . . . . 9.74 112.232 -179.034 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.454 ' H ' ' HG1' ' A' ' 81' ' ' THR . 13.6 mm-40 -68.43 -56.37 8.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.917 0.389 . . . . 12.11 111.264 -179.583 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -72.99 -15.29 61.54 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.114 0.483 . . . . 10.87 110.379 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' MET . . . . . 0.54 ' HB3' HG22 ' A' ' 142' ' ' VAL . 15.0 mtt -76.37 -48.4 20.04 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.83 -0.623 . . . . 11.09 110.393 -179.779 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.417 ' O ' ' HG3' ' A' ' 90' ' ' LYS . 19.9 ttt180 -62.82 -41.95 99.52 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.546 -0.539 . . . . 16.05 109.546 179.354 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -55.16 -43.47 74.29 Favored 'General case' 0 C--O 1.233 0.214 0 N-CA-C 109.402 -0.592 . . . . 14.85 109.402 178.525 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.54 -28.37 67.74 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.541 -0.754 . . . . 14.11 110.667 179.132 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 82.4 t80 -66.84 -39.12 87.53 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 116.231 -0.44 . . . . 16.42 110.472 179.638 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . 0.44 ' HZ1' ' HB3' ' A' ' 90' ' ' LYS . 2.7 mtpm? -64.48 -49.14 72.57 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.27 0.557 . . . . 17.66 110.269 179.327 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 60.6 mt -62.96 -45.13 99.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.255 -0.884 . . . . 18.15 111.479 -179.228 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . 0.409 ' CG ' HG11 ' A' ' 108' ' ' VAL . 0.6 OUTLIER -68.28 -18.65 64.59 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.252 -0.431 . . . . 18.34 111.59 -179.378 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 48.2 t0 -99.01 103.9 15.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.049 0.452 . . . . 19.29 110.702 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.516 ' HB2' ' HG2' ' A' ' 104' ' ' GLU . 0.0 OUTLIER -67.68 -11.63 58.72 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.773 -0.649 . . . . 22.47 111.681 -179.461 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . 0.446 ' HB2' ' OD1' ' A' ' 97' ' ' ASP . 28.2 m-20 -116.65 166.98 11.49 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.986 0.422 . . . . 23.34 111.193 -179.789 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.61 5.15 56.81 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.973 -0.632 . . . . 22.77 112.375 179.498 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . 0.446 ' OD1' ' HB2' ' A' ' 95' ' ' ASP . 7.6 p-10 -61.68 -38.13 86.67 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.665 0.269 . . . . 23.0 111.13 -179.691 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 111.34 18.73 7.93 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.738 -0.744 . . . . 20.02 112.749 179.843 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . 0.431 ' HA ' ' O ' ' A' ' 136' ' ' ILE . 92.3 m-85 -145.35 153.48 41.28 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 120.622 0.249 . . . . 20.56 110.854 179.803 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 63.9 mt -114.01 139.76 38.09 Favored 'Isoleucine or valine' 0 C--O 1.231 0.107 0 CA-C-O 121.014 0.435 . . . . 19.37 111.312 -179.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 16.5 m -121.77 156.22 59.25 Favored Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 115.747 -0.66 . . . . 22.65 110.434 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_exo -43.56 -32.95 4.11 Favored 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.498 2.132 . . . . 23.78 112.508 -179.753 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -62.55 -48.75 78.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.095 0.474 . . . . 25.0 111.248 179.91 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . 0.516 ' HG2' ' HB2' ' A' ' 94' ' ' ARG . 33.5 mt-10 -73.08 -42.15 63.33 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.652 -0.704 . . . . 22.31 110.193 -179.662 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -48.89 -54.33 15.82 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.425 -0.807 . . . . 20.62 109.624 179.794 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.48 ' HB2' HD11 ' A' ' 121' ' ' ILE . 17.1 ttp180 -58.29 -51.11 71.15 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.19 -0.914 . . . . 27.9 110.844 179.851 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 50.3 t80 -56.23 -26.35 50.91 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.029 -0.532 . . . . 25.96 112.012 -179.147 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.469 HG23 ' O ' ' A' ' 104' ' ' GLU . 58.8 t -80.55 -55.38 8.67 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.16 0 N-CA-C 112.549 0.574 . . . . 21.06 112.549 -179.063 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' MET . . . . . 0.487 ' SD ' HG23 ' A' ' 116' ' ' VAL . 0.1 OUTLIER -48.58 -47.42 39.68 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.277 0.561 . . . . 20.93 110.48 -179.347 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.415 HD13 ' HG3' ' A' ' 106' ' ' ARG . 27.7 mt -60.27 -30.79 46.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.257 -0.883 . . . . 25.52 111.187 -179.806 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . 0.415 HD21 HH21 ' A' ' 94' ' ' ARG . 92.6 m-20 -72.9 -28.99 62.81 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.22 -0.445 . . . . 23.32 110.846 179.29 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 6.5 mt -76.06 -27.64 57.33 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.159 -0.473 . . . . 21.07 110.695 -179.889 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 121.77 12.1 5.64 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.865 -0.683 . . . . 23.25 112.441 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -117.51 135.21 54.09 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.86 0.362 . . . . 22.59 111.133 -179.843 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -93.54 134.99 35.25 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.114 -0.494 . . . . 28.21 110.6 179.783 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . 0.487 HG23 ' SD ' ' A' ' 109' ' ' MET . 8.6 m -144.58 155.44 14.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 121.116 0.484 . . . . 24.75 111.986 -179.562 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 45.1 p -100.9 150.38 22.91 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.486 -0.779 . . . . 27.5 109.939 178.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -54.65 -19.74 6.72 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.736 0.303 . . . . 27.03 111.361 -179.66 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -78.73 -54.19 6.35 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.28 -0.418 . . . . 29.14 111.824 -179.364 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . 0.44 ' OE1' HG12 ' A' ' 116' ' ' VAL . 13.5 pt-20 -61.34 -36.52 80.39 Favored 'General case' 0 C--O 1.233 0.237 0 N-CA-C 111.612 0.227 . . . . 24.7 111.612 -179.171 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.5 HG13 ' N ' ' A' ' 122' ' ' ASP . 22.0 pt -73.47 -37.61 51.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 C-N-CA 121.041 -0.264 . . . . 22.9 111.017 179.86 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . 0.5 ' N ' HG13 ' A' ' 121' ' ' ILE . 17.4 t70 -59.36 -38.36 80.23 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.991 0.425 . . . . 24.29 110.179 179.27 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -65.35 -49.97 67.36 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.863 -0.608 . . . . 24.74 110.474 179.542 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' MET . . . . . 0.415 ' SD ' ' HE2' ' A' ' 148' ' ' LYS . 56.3 ttp -52.44 -46.01 66.23 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.375 -0.375 . . . . 20.15 110.717 179.641 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.504 HG22 HD12 ' A' ' 136' ' ' ILE . 79.2 mt -61.6 -33.48 57.43 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 CA-C-N 116.072 -0.513 . . . . 20.23 110.742 179.476 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 16.7 tpt85 -65.74 -36.14 82.73 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.261 -0.427 . . . . 25.57 110.994 -179.613 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -62.48 -43.5 98.67 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.939 -0.573 . . . . 19.18 111.663 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.661 ' HB1' ' HB3' ' A' ' 144' ' ' MET . . . -87.75 -18.64 28.97 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.303 -0.408 . . . . 16.88 111.756 -179.301 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . 0.447 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 22.3 t70 -93.75 106.65 18.61 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.027 0.441 . . . . 20.4 111.124 -179.627 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 79.1 m-85 -91.6 -33.0 15.29 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.824 -0.626 . . . . 21.43 110.669 179.839 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -64.12 -18.74 64.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.12 -0.491 . . . . 23.37 110.555 179.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 64.98 19.1 65.36 Favored Glycine 0 N--CA 1.45 -0.388 0 CA-C-N 115.632 -0.713 . . . . 24.32 112.467 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 7.8 p30 -86.29 3.89 41.35 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.608 0.242 . . . . 24.4 111.458 -179.749 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 62.09 23.28 63.74 Favored Glycine 0 N--CA 1.453 -0.221 0 C-N-CA 120.653 -0.785 . . . . 23.47 112.369 -179.854 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 92.8 mmm -130.73 145.54 51.97 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 110.36 -0.237 . . . . 22.91 110.36 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.504 HD12 HG22 ' A' ' 125' ' ' ILE . 50.4 mm -115.44 145.36 21.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.325 0.583 . . . . 18.67 112.104 -179.555 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . 0.471 ' O ' ' N ' ' A' ' 139' ' ' GLU . 29.1 p-10 -122.99 158.43 30.51 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.157 -0.929 . . . . 16.97 108.753 178.239 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 18.0 t80 -38.5 -23.72 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 112.193 0.442 . . . . 15.28 112.193 -179.746 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . 0.471 ' N ' ' O ' ' A' ' 137' ' ' ASN . 45.0 mt-10 -80.46 -56.14 4.39 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.678 0.275 . . . . 14.82 111.517 -179.454 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . 0.459 ' HB2' HG22 ' A' ' 136' ' ' ILE . 34.3 mt-10 -63.13 -34.94 78.69 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.077 0.465 . . . . 17.46 110.506 179.944 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.511 ' HA ' ' HE1' ' A' ' 144' ' ' MET . 88.0 t80 -63.74 -55.51 22.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.746 -0.661 . . . . 13.65 110.51 179.725 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . 0.54 HG22 ' HB3' ' A' ' 85' ' ' MET . 4.6 t -48.28 -42.54 11.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.79 -0.641 . . . . 11.12 111.732 179.353 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 143' ' ' TRP . . . . . 0.463 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 83.4 t90 -61.76 -55.32 31.36 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.53 0.567 . . . . 14.4 112.53 -178.704 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 144' ' ' MET . . . . . 0.661 ' HB3' ' HB1' ' A' ' 128' ' ' ALA . 11.9 ptt? -64.02 -40.04 95.45 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 112.797 0.666 . . . . 14.63 112.797 -177.653 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 145' ' ' ILE . . . . . 0.455 HG21 ' CZ ' ' A' ' 141' ' ' PHE . 37.2 pt -65.42 -29.09 46.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 N-CA-C 111.931 0.345 . . . . 11.62 111.931 -179.268 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 146' ' ' SER . . . . . 0.466 ' HB3' ' NE2' ' A' ' 147' ' ' GLN . 41.7 t -69.09 -32.98 72.8 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.901 0.381 . . . . 8.66 110.459 -179.751 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 147' ' ' GLN . . . . . 0.466 ' NE2' ' HB3' ' A' ' 146' ' ' SER . 8.6 mm-40 -95.98 -16.04 21.94 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.912 -0.585 . . . . 11.87 111.478 -179.895 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . 0.447 ' HG3' ' O ' ' A' ' 144' ' ' MET . 68.9 mttt . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.293 -0.861 . . . . 13.97 111.183 179.661 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.43 ' HA ' ' NE2' ' A' ' 8' ' ' GLN . 39.3 mt . . . . . 0 CA--C 1.528 0.117 0 CA-C-O 120.918 0.39 . . . . 2.0 110.602 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 66.4 p -66.49 -159.94 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.81 -0.632 . . . . 1.72 111.651 -179.635 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -76.78 -45.22 29.77 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.345 -0.389 . . . . 2.2 110.948 -179.508 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.409 ' HG3' ' H ' ' A' ' 8' ' ' GLN . 0.0 OUTLIER -71.79 -39.26 70.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.99 -0.55 . . . . 1.35 110.687 -179.782 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . 0.43 ' NE2' ' HA ' ' A' ' 4' ' ' LEU . 29.1 mt-30 -60.94 -47.33 86.93 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.961 -0.563 . . . . 2.34 110.659 179.696 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . 0.437 ' HA ' ' CZ ' ' A' ' 12' ' ' PHE . 66.8 mt -59.7 -54.3 36.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.087 -0.506 . . . . 1.27 110.897 179.712 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.31 -18.7 51.43 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.253 -0.43 . . . . 1.22 111.682 -179.707 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -74.21 -56.87 4.4 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.617 0.246 . . . . 2.27 111.65 -179.491 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.437 ' CZ ' ' HA ' ' A' ' 9' ' ' ILE . 9.5 p90 -79.4 -20.85 46.6 Favored 'General case' 0 C--N 1.332 -0.158 0 C-N-CA 120.598 -0.441 . . . . 0.46 110.747 -179.9 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.409 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 19.7 tptm -70.28 -39.32 74.98 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.204 -0.665 . . . . 1.85 109.204 178.644 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -64.93 -47.53 77.4 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 108.735 -0.839 . . . . 0.44 108.735 177.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.45 -28.88 70.12 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.429 -0.805 . . . . 1.08 110.02 178.581 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.409 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 30.1 t80 -67.33 -40.98 85.97 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.546 -0.752 . . . . 0.56 110.238 179.364 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -68.83 -28.27 39.11 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.784 0 CA-C-N 115.73 -0.668 . . . . 1.69 110.972 -179.82 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 83.7 mm-40 -61.5 -33.11 73.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.597 -0.729 . . . . 2.23 111.332 -179.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -93.74 -5.83 47.48 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.497 -0.319 . . . . 0.69 111.45 -179.617 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -95.14 78.39 3.51 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.901 0.382 . . . . 0.46 110.467 179.301 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 29.7 mmmt -90.94 -33.24 15.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.945 -0.57 . . . . 2.55 111.19 -179.636 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -62.43 -23.98 67.16 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.226 -0.443 . . . . 1.8 111.177 -179.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 87.09 11.41 69.88 Favored Glycine 0 N--CA 1.453 -0.213 0 C-N-CA 120.758 -0.734 . . . . 0.54 112.627 179.774 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 30.3 p -86.1 11.26 12.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.778 0.323 . . . . 1.1 111.139 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 55.26 25.11 39.14 Favored Glycine 0 C--N 1.332 0.327 0 C-N-CA 120.813 -0.708 . . . . 0.37 112.227 -179.824 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.598 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 42.5 mtpt -134.09 155.8 49.4 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.788 0.327 . . . . 1.75 111.032 -179.58 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.501 HG13 ' HB2' ' A' ' 63' ' ' LEU . 30.8 pt -114.96 136.18 52.47 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.325 0 N-CA-C 112.27 0.47 . . . . 1.2 112.27 -178.825 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.92 135.35 57.55 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.262 -0.426 . . . . 1.04 111.343 179.734 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 9.9 t -65.75 -23.35 66.72 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.996 -0.547 . . . . 1.71 111.179 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 29.9 mtp180 -77.79 -2.57 37.02 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.069 -0.514 . . . . 3.53 110.372 179.556 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -111.79 -6.18 14.33 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.759 -0.655 . . . . 2.26 110.872 179.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -51.78 -50.94 59.73 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.944 -0.571 . . . . 1.95 110.46 179.675 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -58.78 -43.02 96.73 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.63 -0.795 . . . . 0.32 111.828 179.515 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 31.1 m -59.15 -32.24 69.7 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.989 0.424 . . . . 1.01 110.516 179.428 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.3 mt -67.51 -41.23 84.76 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 115.851 -0.613 . . . . 1.85 110.643 179.771 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' MET . . . . . 0.55 ' HG3' ' HG3' ' A' ' 43' ' ' PRO . 14.6 mmt -66.91 -25.66 66.48 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.013 -0.539 . . . . 1.43 110.741 179.894 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -74.85 -47.82 28.27 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.855 -0.611 . . . . 3.27 110.954 179.453 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.493 HG21 ' HG ' ' A' ' 39' ' ' LEU . 9.9 t -70.52 -13.69 62.21 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.98 0.419 . . . . 1.54 111.033 179.758 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.493 ' HG ' HG21 ' A' ' 38' ' ' THR . 57.4 mt -113.85 156.65 23.53 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.92 -0.582 . . . . 1.94 110.626 -179.798 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -52.92 -11.44 1.36 Allowed Glycine 0 CA--C 1.521 0.45 0 C-N-CA 121.178 -0.534 . . . . 0.69 113.269 -179.764 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -58.63 166.03 1.99 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.931 0.396 . . . . 1.97 111.181 179.673 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 46.3 t30 -172.55 73.72 0.44 Allowed Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 115.884 -0.598 . . . . 3.44 110.513 179.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . 0.55 ' HG3' ' HG3' ' A' ' 36' ' ' MET . 83.1 Cg_endo -80.18 158.34 23.33 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.741 2.294 . . . . 0.59 112.712 -179.779 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.0 p -67.83 146.32 53.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.98 -0.555 . . . . 1.28 110.932 179.55 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.1 tt0 -48.38 -49.23 35.51 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.86 0.362 . . . . 2.7 110.791 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.22 -44.81 88.37 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.998 -0.546 . . . . 1.15 111.127 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -54.28 -46.42 72.7 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.248 -0.433 . . . . 2.23 110.935 -179.939 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 37.8 mt -60.84 -45.16 95.59 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.337 -0.392 . . . . 2.01 110.826 179.702 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 81.7 mm-40 -64.67 -27.51 68.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.455 -0.339 . . . . 1.68 111.161 -179.674 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 43.5 m-20 -74.8 -55.07 6.21 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.477 -0.328 . . . . 0.62 111.633 -179.652 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 2.4 pp -67.38 -41.12 85.55 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.468 -0.333 . . . . 1.11 111.701 -179.316 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 76.9 mt -62.77 -45.88 97.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 120.637 0.256 . . . . 1.25 110.853 -179.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.89 -33.68 75.19 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.886 0.374 . . . . 1.24 110.516 179.53 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -63.6 -44.31 94.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.985 -0.552 . . . . 2.54 110.004 179.302 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -79.7 -16.89 54.85 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.915 -0.584 . . . . 1.19 110.871 179.253 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -73.55 -43.0 60.95 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.122 -0.49 . . . . 1.95 111.035 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -102.87 47.83 0.88 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.143 -0.48 . . . . 3.19 111.118 -179.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -167.55 -55.17 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.2 -0.454 . . . . 2.69 110.927 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 38.2 m-80 -97.4 24.85 6.12 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.171 -0.468 . . . . 2.05 110.751 179.846 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 8.0 m120 64.81 -80.08 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 115.89 -0.595 . . . . 1.67 111.239 179.904 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -165.88 18.97 0.1 OUTLIER Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.804 -0.712 . . . . 0.86 112.418 179.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.598 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -128.31 155.49 44.55 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.96 0.409 . . . . 0.49 111.373 -179.837 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.501 ' HB2' HG13 ' A' ' 27' ' ' ILE . 14.8 mt -126.09 155.46 41.56 Favored 'General case' 0 C--O 1.222 -0.361 0 CA-C-N 115.834 -0.621 . . . . 2.05 110.7 -179.631 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . 0.467 ' HB2' ' HG3' ' A' ' 67' ' ' GLU . 1.4 m-20 -111.68 156.51 21.75 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.652 -0.249 . . . . 1.52 110.552 -179.607 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 90.0 t80 -43.86 -39.53 3.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.427 -0.351 . . . . 0.46 111.399 -179.524 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -70.48 -39.07 74.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.528 -0.306 . . . . 1.41 111.67 -179.878 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.467 ' HG3' ' HB2' ' A' ' 64' ' ' ASN . 14.0 mt-10 -62.06 -53.64 52.66 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.426 0.631 . . . . 1.36 109.695 179.523 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.425 ' O ' ' HG2' ' A' ' 72' ' ' MET . 31.3 t80 -59.69 -54.98 40.05 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.934 -1.03 . . . . 0.61 110.497 179.309 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 36.2 t -51.02 -53.97 28.81 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-N 116.169 -0.469 . . . . 1.41 110.458 179.506 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -41.82 -54.71 4.22 Favored Glycine 0 N--CA 1.451 -0.305 0 CA-C-N 115.281 -0.872 . . . . 0.41 112.462 179.702 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.494 HG22 ' HE2' ' A' ' 74' ' ' LYS . 14.0 mt -64.84 -48.91 82.41 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.26 0 CA-C-O 121.037 0.446 . . . . 1.13 110.946 179.692 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' MET . . . . . 0.425 ' HG2' ' O ' ' A' ' 68' ' ' PHE . 81.2 mmm -47.79 -36.82 12.32 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.833 -0.622 . . . . 1.24 110.042 179.289 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -63.73 -55.34 23.99 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.415 -0.812 . . . . 1.17 110.974 179.407 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.494 ' HE2' HG22 ' A' ' 71' ' ' ILE . 61.1 pttt -60.17 -33.32 72.03 Favored 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 112.017 0.377 . . . . 1.91 112.017 -179.199 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 65.1 mt-30 -78.82 -51.96 9.0 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 111.77 0.285 . . . . 2.03 111.77 -179.873 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 2.2 mmm . . . . . 0 N--CA 1.45 -0.467 0 CA-C-N 116.336 -0.393 . . . . 1.52 111.68 -179.431 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.595 ' O ' ' HG3' ' A' ' 85' ' ' MET . 13.5 m . . . . . 0 N--CA 1.455 -0.194 0 CA-C-O 120.799 0.333 . . . . 7.48 110.692 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -39.54 -49.51 2.14 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 115.381 -0.827 . . . . 9.74 112.973 -178.589 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -56.7 -43.62 80.71 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.86 0.362 . . . . 12.11 111.199 -179.463 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -75.25 -14.53 60.53 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.058 -0.519 . . . . 10.87 111.248 -179.596 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' MET . . . . . 0.595 ' HG3' ' O ' ' A' ' 81' ' ' THR . 4.5 mtt -80.55 -30.69 37.06 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 121.181 0.515 . . . . 11.09 110.081 -179.889 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 20.9 ttt180 -78.81 -45.44 20.91 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.383 -0.826 . . . . 16.05 110.6 -179.697 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -66.14 -42.58 88.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.125 -0.489 . . . . 14.85 110.872 179.63 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.1 -39.26 86.7 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.24 -0.436 . . . . 14.11 111.257 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -59.2 -42.24 90.44 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.043 0.449 . . . . 16.42 110.61 179.86 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' LYS . . . . . 0.542 ' HZ1' ' HB3' ' A' ' 90' ' ' LYS . 5.5 mtpm? -63.32 -43.15 98.62 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.707 -0.679 . . . . 17.66 111.274 179.798 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 83.4 mt -62.67 -50.58 79.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.188 -0.46 . . . . 18.15 111.624 -179.531 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -64.67 -38.74 92.03 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.559 -0.291 . . . . 18.34 111.332 -179.504 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 29.3 t0 -66.27 91.97 0.18 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.046 0.45 . . . . 19.29 110.27 179.597 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 2.7 mmp_? -62.05 -2.31 0.89 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.692 -0.686 . . . . 22.47 112.156 -179.316 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 40.8 m-20 -124.78 177.95 5.73 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.942 0.401 . . . . 23.34 110.968 179.66 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.55 -4.41 54.81 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.947 -0.644 . . . . 22.77 111.947 179.29 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.88 -39.25 87.44 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.76 0.314 . . . . 23.0 111.324 -179.919 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 104.2 40.72 2.21 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.741 -0.742 . . . . 20.02 112.312 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . 0.44 ' HA ' ' O ' ' A' ' 136' ' ' ILE . 95.6 m-85 -143.62 142.04 30.87 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.675 0.274 . . . . 20.56 110.86 -179.96 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.491 ' HB ' ' HB ' ' A' ' 136' ' ' ILE . 56.6 mt -114.22 120.94 65.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.196 0 CA-C-O 121.069 0.462 . . . . 19.37 111.1 -179.937 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 31.8 p -114.38 156.18 44.81 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 115.799 -0.637 . . . . 22.65 110.564 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -40.58 -36.06 1.69 Allowed 'Trans proline' 0 C--N 1.349 0.589 0 C-N-CA 122.592 2.195 . . . . 23.78 112.66 -179.6 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.436 ' O ' ' HG3' ' A' ' 106' ' ' ARG . . . -68.04 -55.41 12.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.078 0.466 . . . . 25.0 111.172 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -62.49 -31.1 71.79 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.924 -0.58 . . . . 22.31 110.956 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.542 HD22 ' HB ' ' A' ' 121' ' ' ILE . 37.2 tp -68.42 -55.28 12.44 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.715 -0.675 . . . . 20.62 112.004 -178.45 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.441 ' HB3' HD11 ' A' ' 121' ' ' ILE . 0.3 OUTLIER -57.07 -40.22 76.46 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.758 0.313 . . . . 27.9 111.485 -179.003 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 21.1 t80 -58.02 -54.17 49.93 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.361 -0.381 . . . . 25.96 111.255 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 48.3 t -67.9 -40.73 83.98 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.197 0 CA-C-N 116.725 -0.216 . . . . 21.06 111.332 -179.764 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -50.8 -38.6 49.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.846 0.355 . . . . 20.93 110.791 179.972 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.717 ' HA ' ' HA ' ' A' ' 114' ' ' GLU . 88.0 mt -67.27 -24.12 31.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.044 -0.525 . . . . 25.52 111.244 179.648 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -72.56 -21.27 61.18 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.069 -0.514 . . . . 23.32 110.354 179.167 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 6.2 mp -93.76 -84.8 0.3 Allowed 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.168 -0.469 . . . . 21.07 111.415 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . 0.465 ' O ' ' HG2' ' A' ' 114' ' ' GLU . . . -117.49 -1.64 17.88 Favored Glycine 0 C--N 1.334 0.435 0 C-N-CA 120.702 -0.761 . . . . 23.25 112.696 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . 0.717 ' HA ' ' HA ' ' A' ' 110' ' ' ILE . 9.1 pt-20 42.62 -170.12 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 114.284 1.216 . . . . 22.59 114.284 179.137 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . 0.676 ' HB3' ' HZ3' ' A' ' 115' ' ' LYS . 3.4 mmmp? 66.11 54.64 0.96 Allowed 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 114.535 -1.212 . . . . 28.21 111.548 -179.81 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . 0.492 ' HB ' HG22 ' A' ' 121' ' ' ILE . 1.5 m -130.11 115.38 32.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.998 -0.546 . . . . 24.75 110.991 178.837 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' THR . . . . . 0.431 ' HG1' ' HG2' ' A' ' 120' ' ' GLU . 72.9 p -69.32 146.69 51.99 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.186 -0.461 . . . . 27.5 110.257 179.713 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . 0.459 ' HA ' HD12 ' A' ' 121' ' ' ILE . 9.2 m-20 -53.63 -17.46 2.19 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.244 -0.434 . . . . 27.03 111.102 -179.897 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -79.77 -55.48 4.97 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.299 -0.41 . . . . 29.14 111.81 -179.559 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . 0.445 ' OE1' HG11 ' A' ' 116' ' ' VAL . 13.5 pt-20 -58.07 -43.69 87.1 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 120.551 0.215 . . . . 24.7 111.395 -179.311 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.542 ' HB ' HD22 ' A' ' 105' ' ' LEU . 1.8 pt -68.68 -40.17 81.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 C-N-CA 121.037 -0.265 . . . . 22.9 111.127 179.795 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . 0.412 ' H ' HG13 ' A' ' 121' ' ' ILE . 16.9 t70 -61.41 -42.05 98.12 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.753 0.311 . . . . 24.29 110.5 179.583 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -57.71 -45.09 86.19 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.24 -0.436 . . . . 24.74 110.264 179.419 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 58.6 ttp -57.57 -37.15 72.66 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.068 -0.515 . . . . 20.15 110.292 179.1 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.46 HG23 HD13 ' A' ' 136' ' ' ILE . 64.4 mt -66.66 -42.3 89.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 115.858 -0.61 . . . . 20.23 110.414 179.386 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 66.0 ttt180 -59.6 -37.29 78.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.794 -0.639 . . . . 25.57 110.931 179.739 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -63.99 -33.16 75.11 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.054 -0.521 . . . . 19.18 111.344 -179.762 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.66 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -95.86 -17.55 21.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.474 -0.33 . . . . 16.88 111.305 -179.824 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . 0.412 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 14.4 t0 -94.31 100.51 12.54 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.211 -0.449 . . . . 20.4 110.761 -179.852 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 88.1 m-85 -85.34 -43.07 14.01 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.899 -0.591 . . . . 21.43 111.462 -179.446 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -60.05 -24.19 64.35 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.413 -0.358 . . . . 23.37 110.798 -179.714 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 66.17 78.02 0.25 Allowed Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.91 -0.662 . . . . 24.32 112.855 179.655 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -135.29 -27.1 1.23 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.769 0.318 . . . . 24.4 110.935 179.715 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 102.9 13.47 29.37 Favored Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.82 -0.705 . . . . 23.47 112.681 179.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 70.2 mtp -133.05 153.63 51.32 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.677 0.275 . . . . 22.91 110.586 179.805 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.542 HG23 ' HB2' ' A' ' 140' ' ' GLU . 42.3 mm -114.95 145.65 20.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 121.282 0.563 . . . . 18.67 111.987 -179.579 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 137' ' ' ASN . . . . . 0.425 ' O ' ' N ' ' A' ' 139' ' ' GLU . 1.0 OUTLIER -119.93 157.19 29.29 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.171 -0.922 . . . . 16.97 108.965 178.136 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 79.9 t80 -39.99 -23.96 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 112.06 0.393 . . . . 15.28 112.06 -179.6 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 139' ' ' GLU . . . . . 0.425 ' N ' ' O ' ' A' ' 137' ' ' ASN . 38.5 mt-10 -80.76 -56.13 4.35 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 120.697 0.284 . . . . 14.82 111.18 -179.223 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . 0.542 ' HB2' HG23 ' A' ' 136' ' ' ILE . 59.8 mt-10 -60.46 -34.8 74.53 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.341 -0.391 . . . . 17.46 110.353 -179.927 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.539 ' HA ' ' HE2' ' A' ' 144' ' ' MET . 85.3 t80 -63.96 -55.0 25.67 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.0 -0.545 . . . . 13.65 110.125 179.174 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 142' ' ' VAL . . . . . 0.493 HG22 ' HB3' ' A' ' 85' ' ' MET . 2.6 t -47.91 -36.82 5.89 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-N 115.464 -0.789 . . . . 11.12 111.79 179.306 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 143' ' ' TRP . . . . . 0.514 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 91.5 t90 -69.79 -55.96 8.43 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.824 0.675 . . . . 14.4 112.824 -178.737 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 144' ' ' MET . . . . . 0.66 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 18.7 ptt? -63.91 -23.57 67.4 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 113.175 0.805 . . . . 14.63 113.175 -177.521 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 145' ' ' ILE . . . . . 0.518 HG13 ' N ' ' A' ' 146' ' ' SER . 49.2 pt -80.49 -40.7 19.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 N-CA-C 112.399 0.518 . . . . 11.62 112.399 -179.28 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 146' ' ' SER . . . . . 0.518 ' N ' HG13 ' A' ' 145' ' ' ILE . 78.7 p -61.21 -13.79 20.88 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.181 0.515 . . . . 8.66 110.55 -179.71 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 147' ' ' GLN . . . . . 0.514 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 6.3 mm-40 -98.49 -19.11 17.84 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.377 -0.828 . . . . 11.87 111.289 -179.16 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 99.1 mttt . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.234 -0.889 . . . . 13.97 110.959 179.749 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.478 ' HB2' HD21 ' A' ' 4' ' ' LEU . 97.7 p . . . . . 0 N--CA 1.485 1.313 0 CA-C-O 120.559 0.218 . . . . 5.2 110.79 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -159.29 51.58 0.36 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.92 0.391 . . . . 3.26 111.806 -179.665 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.478 HD21 ' HB2' ' A' ' 2' ' ' SER . 0.6 OUTLIER -90.21 138.39 31.57 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.172 -0.467 . . . . 2.0 110.35 179.237 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.48 ' HG1' ' HG2' ' A' ' 7' ' ' GLU . 74.0 p -70.01 -177.63 1.39 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.42 -0.355 . . . . 1.72 111.341 -179.766 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -63.41 -48.02 79.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.435 -0.348 . . . . 2.2 111.492 -179.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.48 ' HG2' ' HG1' ' A' ' 5' ' ' THR . 12.4 pt-20 -67.14 -41.54 85.91 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.976 0.417 . . . . 1.35 110.906 -179.425 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . 0.54 ' HA ' HE21 ' A' ' 8' ' ' GLN . 0.0 OUTLIER -64.28 -45.63 87.2 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.822 -0.627 . . . . 2.34 111.037 179.948 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.52 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 56.5 mt -58.1 -51.16 74.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.432 -0.349 . . . . 1.27 110.543 179.526 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.87 -19.26 65.7 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.149 -0.478 . . . . 1.22 111.189 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -72.44 -56.57 5.21 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.275 -0.42 . . . . 2.27 111.777 -179.275 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.52 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 28.1 p90 -79.03 -24.41 43.67 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 120.532 -0.467 . . . . 0.46 110.625 -179.739 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 19.7 tptm -66.62 -37.13 84.23 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 109.174 -0.676 . . . . 1.85 109.174 178.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.513 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 27.4 t70 -66.97 -50.7 61.48 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 109.121 -0.696 . . . . 0.44 109.121 178.332 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.81 -14.51 59.43 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.679 -0.692 . . . . 1.08 110.612 179.042 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 75.5 t80 -80.08 -47.76 14.31 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.845 -0.616 . . . . 0.56 110.647 -179.677 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 26.8 m -69.65 -20.49 23.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.142 -0.481 . . . . 1.69 110.302 179.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.513 ' HG3' ' O ' ' A' ' 14' ' ' ASP . 74.5 mt-30 -58.97 -35.5 73.3 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.729 -0.669 . . . . 2.23 111.02 179.434 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 88.1 m-85 -105.91 44.16 1.07 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.276 -0.42 . . . . 0.69 111.509 -179.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -135.27 70.4 1.44 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.017 0.437 . . . . 0.46 110.72 179.463 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.423 ' HD2' ' N ' ' A' ' 21' ' ' LYS . 0.9 OUTLIER -78.24 -25.95 47.09 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.92 -0.582 . . . . 2.55 110.89 179.983 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -70.3 -11.75 61.12 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.011 -0.54 . . . . 1.8 111.213 -179.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.46 17.22 66.27 Favored Glycine 0 C--N 1.33 0.208 0 C-N-CA 120.857 -0.687 . . . . 0.54 112.898 179.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 60.0 p -90.39 8.24 34.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.751 0.31 . . . . 1.1 111.181 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 57.93 19.59 37.8 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.854 -0.688 . . . . 0.37 112.126 -179.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.508 ' HD3' ' OD1' ' A' ' 64' ' ' ASN . 20.7 mtmm -128.23 154.54 45.74 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.928 0.394 . . . . 1.75 111.205 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.413 ' O ' HG13 ' A' ' 27' ' ' ILE . 45.7 pt -120.64 129.27 75.79 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.111 -0.495 . . . . 1.2 110.823 179.567 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -53.24 134.88 39.17 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.803 0.335 . . . . 1.04 110.882 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 5.9 t -61.2 -17.19 51.89 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.096 -0.502 . . . . 1.71 110.869 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 59.1 mtt180 -78.79 -19.12 52.91 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.885 -0.598 . . . . 3.53 110.488 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 33.3 mm-40 -97.28 -2.05 43.42 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.656 -0.702 . . . . 2.26 110.9 179.813 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.475 HD23 HD23 ' A' ' 63' ' ' LEU . 0.4 OUTLIER -55.64 -54.79 39.84 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.908 -0.587 . . . . 1.95 110.956 -179.956 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -56.14 -39.4 80.57 Favored Glycine 0 C--N 1.331 0.274 0 C-N-CA 120.654 -0.784 . . . . 0.32 112.152 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 32.1 m -65.4 -35.96 82.51 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.995 0.426 . . . . 1.01 110.645 179.584 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 24.4 tp -68.52 -36.62 79.11 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.896 -0.593 . . . . 1.85 110.677 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.521 ' HG3' ' HG3' ' A' ' 43' ' ' PRO . 23.2 mmt -62.27 -42.0 98.96 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.273 -0.421 . . . . 1.43 109.925 179.098 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -63.92 -33.39 75.59 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.771 -0.65 . . . . 3.27 109.691 179.033 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.4 m -72.57 -16.92 61.75 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.315 -0.857 . . . . 1.54 110.385 179.352 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 95.1 mt -114.0 157.24 22.73 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.663 -0.698 . . . . 1.94 110.641 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -52.98 -9.88 0.93 Allowed Glycine 0 CA--C 1.521 0.434 0 C-N-CA 120.997 -0.62 . . . . 0.69 113.245 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 73.6 mm-40 -66.29 174.45 2.64 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.941 0.401 . . . . 1.97 111.314 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -173.01 67.91 0.37 Allowed Pre-proline 0 C--N 1.331 -0.231 0 CA-C-N 115.805 -0.634 . . . . 3.44 110.336 179.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.521 ' HG3' ' HG3' ' A' ' 36' ' ' MET . 47.0 Cg_endo -67.87 148.09 75.97 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.595 2.197 . . . . 0.59 112.332 -179.8 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 12.4 m -64.68 154.26 37.13 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.09 -0.505 . . . . 1.28 110.543 179.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -49.62 -55.07 14.96 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.681 0.276 . . . . 2.7 111.22 -179.404 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.63 -46.03 70.34 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.227 -0.442 . . . . 1.15 111.507 -179.726 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -51.38 -54.52 25.71 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.335 -0.393 . . . . 2.23 111.146 -179.8 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 47.3 mt -56.9 -40.91 77.17 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.731 0.3 . . . . 2.01 111.019 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 79.5 mm-40 -66.16 -27.56 68.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.885 0.374 . . . . 1.68 111.0 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 30.2 m-20 -76.73 -52.8 8.93 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.106 -0.497 . . . . 0.62 111.85 -179.397 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.4 pp -69.37 -35.45 75.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.481 -0.327 . . . . 1.11 111.879 -179.033 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 72.8 mt -69.36 -48.59 66.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.64 0.257 . . . . 1.25 111.138 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.99 -37.37 82.25 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.882 0.372 . . . . 1.24 110.757 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -66.58 -51.65 54.09 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.081 -0.509 . . . . 2.54 110.52 179.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -67.25 -14.9 63.34 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.01 -0.541 . . . . 1.19 111.055 179.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -74.34 -27.29 60.62 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.283 -0.417 . . . . 1.95 110.932 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -118.28 7.83 12.13 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.173 -0.467 . . . . 3.19 110.813 179.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -122.97 -12.68 7.95 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.196 -0.456 . . . . 2.69 110.977 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -140.46 27.18 2.1 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.218 -0.446 . . . . 2.05 110.886 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . 0.54 ' N ' HD21 ' A' ' 60' ' ' ASN . 0.8 OUTLIER 62.01 -85.18 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.917 -0.583 . . . . 1.67 111.118 179.984 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -151.85 -3.05 0.19 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.755 -0.736 . . . . 0.86 112.409 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -115.05 154.9 28.01 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.07 0.462 . . . . 0.49 111.071 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.57 ' HG ' ' HB2' ' A' ' 67' ' ' GLU . 0.8 OUTLIER -119.6 156.17 30.89 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.691 -0.686 . . . . 2.05 109.96 -179.795 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . 0.557 ' HB2' ' HG2' ' A' ' 67' ' ' GLU . 52.7 m-80 -111.26 156.4 21.55 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 121.098 0.475 . . . . 1.52 111.719 -178.674 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 84.0 t80 -48.11 -41.64 26.98 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.348 -0.842 . . . . 0.46 109.96 178.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.68 -36.22 82.01 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.483 -0.781 . . . . 1.41 111.337 179.421 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.57 ' HB2' ' HG ' ' A' ' 63' ' ' LEU . 8.8 mm-40 -64.69 -55.04 22.51 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.192 -0.458 . . . . 1.36 110.004 179.524 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.415 ' HE2' ' HB2' ' A' ' 12' ' ' PHE . 43.4 t80 -59.2 -54.18 49.89 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.829 -0.623 . . . . 0.61 110.541 179.378 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 35.2 t -52.77 -49.31 65.81 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 116.119 -0.491 . . . . 1.41 110.276 179.526 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -43.84 -50.72 7.23 Favored Glycine 0 N--CA 1.451 -0.342 0 CA-C-N 115.613 -0.721 . . . . 0.41 112.23 179.225 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.598 HG22 ' HE2' ' A' ' 74' ' ' LYS . 13.5 mt -66.81 -51.4 55.98 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.261 0 CA-C-O 120.912 0.386 . . . . 1.13 110.78 179.41 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' MET . . . . . 0.437 ' O ' ' HG3' ' A' ' 76' ' ' MET . 83.8 mmm -45.91 -36.47 5.45 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.932 -0.576 . . . . 1.24 109.766 179.192 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.459 ' HB3' ' HA ' ' A' ' 2' ' ' SER . . . -63.21 -55.03 28.4 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.253 -0.885 . . . . 1.17 110.622 179.312 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.598 ' HE2' HG22 ' A' ' 71' ' ' ILE . 58.6 pttt -61.0 -28.62 69.17 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.296 -0.411 . . . . 1.91 110.84 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -77.68 -42.17 35.49 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.233 -0.439 . . . . 2.03 111.266 179.438 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' MET . . . . . 0.437 ' HG3' ' O ' ' A' ' 72' ' ' MET . 2.8 mtt -62.12 -22.82 66.14 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 116.258 -0.428 . . . . 1.52 110.919 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . 0.406 HH11 ' HD2' ' A' ' 77' ' ' ARG . 13.4 mmm180 -51.44 -14.96 0.34 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.049 -0.523 . . . . 5.25 111.782 179.887 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -56.01 -16.67 5.24 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.772 0.32 . . . . 4.01 110.814 179.49 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 19.8 m -108.09 113.75 27.14 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.037 -0.529 . . . . 5.71 110.799 179.847 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -93.0 38.03 1.03 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.43 -0.35 . . . . 5.6 111.599 -179.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.561 ' O ' ' HG2' ' A' ' 85' ' ' MET . 9.7 t -63.52 135.12 56.63 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.57 -0.287 . . . . 7.48 110.503 179.699 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -66.55 -23.43 66.22 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 112.558 0.577 . . . . 9.74 112.558 -178.741 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -64.45 -56.05 16.79 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-O 121.102 0.477 . . . . 12.11 111.809 -179.137 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -59.21 -19.31 44.42 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.865 -0.607 . . . . 10.87 111.118 -179.458 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' MET . . . . . 0.561 ' HG2' ' O ' ' A' ' 81' ' ' THR . 2.0 mmt -74.71 -49.85 19.66 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.137 -0.483 . . . . 11.09 110.609 -179.574 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 46.5 ttt180 -54.85 -43.17 72.81 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.036 -0.529 . . . . 16.05 110.075 179.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 25.3 mm-40 -60.37 -42.42 95.79 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.139 0.495 . . . . 14.85 109.973 178.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -69.85 -23.08 63.23 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.749 -0.66 . . . . 14.11 111.075 179.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 88.5 t80 -68.98 -41.56 77.75 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.389 -0.369 . . . . 16.42 110.419 179.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 50.0 mtmt -68.7 -39.13 80.64 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.92 -0.582 . . . . 17.66 110.646 179.552 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 81.7 mt -68.23 -44.48 84.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.038 -0.528 . . . . 18.15 111.441 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -67.69 -55.66 12.33 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.526 -0.306 . . . . 18.34 111.366 -179.646 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 41.8 t0 -55.32 99.08 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.823 0.344 . . . . 19.29 110.409 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.517 ' HG2' ' HB3' ' A' ' 104' ' ' GLU . 21.9 mmm180 -55.86 -33.08 64.21 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.125 -0.488 . . . . 22.47 110.955 -179.399 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . 0.419 ' HB2' ' OD1' ' A' ' 97' ' ' ASP . 6.2 m-20 -101.71 170.13 8.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.189 -0.46 . . . . 23.34 110.929 -179.793 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.45 5.38 57.15 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.794 -0.717 . . . . 22.77 112.384 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.419 ' OD1' ' HB2' ' A' ' 95' ' ' ASP . 5.0 p-10 -58.7 -39.06 79.66 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.706 0.289 . . . . 23.0 111.307 -179.755 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 114.06 17.12 7.45 Favored Glycine 0 C--N 1.331 0.279 0 C-N-CA 120.698 -0.763 . . . . 20.02 112.91 179.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 99.2 m-85 -145.12 152.56 40.26 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 120.74 0.305 . . . . 20.56 110.829 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 61.2 mt -114.33 138.22 45.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 116.299 -0.41 . . . . 19.37 111.069 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 41.7 m -114.61 156.13 45.15 Favored Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 115.988 -0.551 . . . . 22.65 110.939 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_exo -41.76 -39.56 5.13 Favored 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 122.49 2.127 . . . . 23.78 112.281 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.71 -50.2 73.38 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.971 -0.559 . . . . 25.0 110.613 179.465 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . 0.517 ' HB3' ' HG2' ' A' ' 94' ' ' ARG . 44.3 mt-10 -64.53 -28.37 69.6 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.442 -0.799 . . . . 22.31 111.188 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.482 HD22 ' HE2' ' A' ' 124' ' ' MET . 38.0 tp -64.97 -55.5 18.7 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.285 -0.416 . . . . 20.62 111.429 -179.076 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.461 ' HB3' HD12 ' A' ' 121' ' ' ILE . 14.6 ptt180 -64.32 -38.76 92.2 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.852 0.358 . . . . 27.9 110.531 179.893 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . 0.452 ' N ' ' HG3' ' A' ' 106' ' ' ARG . 1.7 t80 -54.55 -39.37 67.64 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.957 -0.565 . . . . 25.96 111.022 -179.544 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.463 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 76.8 t -80.15 -49.65 18.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.521 -0.308 . . . . 21.06 111.37 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -50.03 -35.54 25.29 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.389 -0.369 . . . . 20.93 111.08 -179.835 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 78.1 mt -75.92 -31.22 21.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.333 -0.394 . . . . 25.52 110.565 179.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 95.2 m-20 -67.8 -43.34 79.9 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.07 -0.514 . . . . 23.32 110.812 179.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.463 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 6.2 mt -66.25 -45.33 80.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.069 -0.514 . . . . 21.07 110.826 -179.841 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 137.95 -0.15 2.61 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.922 -0.656 . . . . 23.25 112.278 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -88.61 104.63 17.02 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.734 0.302 . . . . 22.59 111.201 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -74.04 113.71 11.54 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.298 -0.41 . . . . 28.21 110.506 179.526 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . 0.407 HG13 ' OE1' ' A' ' 120' ' ' GLU . 5.3 m -138.35 155.2 28.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 121.004 0.431 . . . . 24.75 111.789 -179.574 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' THR . . . . . 0.401 ' O ' HG12 ' A' ' 121' ' ' ILE . 64.0 p -99.18 156.76 16.8 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.702 -0.681 . . . . 27.5 110.448 179.24 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -58.68 -21.4 54.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.41 -0.359 . . . . 27.03 111.507 -179.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -76.31 -55.38 5.61 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 111.874 0.324 . . . . 29.14 111.874 -179.269 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . 0.407 ' OE1' HG13 ' A' ' 116' ' ' VAL . 15.2 pt-20 -61.71 -39.44 91.5 Favored 'General case' 0 C--O 1.234 0.237 0 N-CA-C 111.679 0.251 . . . . 24.7 111.679 -179.33 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.48 HG13 ' N ' ' A' ' 122' ' ' ASP . 18.7 pt -71.19 -34.88 56.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 C-N-CA 120.959 -0.297 . . . . 22.9 111.251 -179.709 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.48 ' N ' HG13 ' A' ' 121' ' ' ILE . 15.0 t70 -59.01 -43.84 91.61 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.953 0.406 . . . . 24.29 110.292 179.583 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -63.85 -42.24 97.61 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.89 -0.596 . . . . 24.74 110.413 179.44 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.482 ' HE2' HD22 ' A' ' 105' ' ' LEU . 65.1 ttp -56.59 -34.04 66.79 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.15 -0.477 . . . . 20.15 110.825 179.663 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.485 HG22 HD11 ' A' ' 136' ' ' ILE . 87.0 mt -68.92 -46.09 79.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.237 -0.438 . . . . 20.23 110.371 179.592 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 27.9 tpt180 -59.57 -31.46 69.46 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.99 -0.55 . . . . 25.57 111.04 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -66.96 -40.58 87.52 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.17 -0.468 . . . . 19.18 111.302 -179.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.498 ' HB3' ' HB3' ' A' ' 144' ' ' MET . . . -91.19 -13.59 32.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.376 -0.374 . . . . 16.88 111.094 -179.865 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . 0.433 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 8.7 t70 -95.99 106.72 18.92 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.151 -0.477 . . . . 20.4 111.054 -179.697 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 87.3 m-85 -98.93 -32.91 11.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.033 -0.53 . . . . 21.43 111.533 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -69.3 -15.5 63.36 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.719 0.295 . . . . 23.37 110.981 -179.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . 0.418 ' HA2' ' OD2' ' A' ' 129' ' ' ASP . . . 58.45 84.95 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.835 -0.697 . . . . 24.32 112.874 179.615 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 12.3 p-10 -147.66 -9.64 0.41 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.768 0.318 . . . . 24.4 111.004 179.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 80.14 18.2 72.51 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.835 -0.698 . . . . 23.47 112.43 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 40.4 mtp -137.52 155.3 49.42 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.576 0.227 . . . . 22.91 110.454 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.491 HG21 ' N ' ' A' ' 137' ' ' ASN . 48.8 mm -114.79 142.8 26.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 121.404 0.621 . . . . 18.67 112.233 -179.242 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . 0.491 ' N ' HG21 ' A' ' 136' ' ' ILE . 1.6 p30 -115.45 157.76 23.51 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.006 -0.997 . . . . 16.97 109.108 178.129 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 29.0 t80 -39.12 -25.45 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 112.432 0.53 . . . . 15.28 112.432 -179.239 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.42 ' N ' ' O ' ' A' ' 137' ' ' ASN . 43.5 mt-10 -80.18 -55.75 4.7 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.692 0.282 . . . . 14.82 111.529 -179.149 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.491 ' HB2' HG22 ' A' ' 136' ' ' ILE . 53.3 mt-10 -61.12 -31.33 71.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.941 0.401 . . . . 17.46 110.519 -179.825 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.449 ' CZ ' HG22 ' A' ' 145' ' ' ILE . 88.9 t80 -67.67 -55.7 12.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.839 -0.619 . . . . 13.65 110.606 179.726 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . 0.411 HG13 ' HG3' ' A' ' 85' ' ' MET . 34.4 t -47.23 -43.39 7.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 115.833 -0.622 . . . . 11.12 111.964 179.523 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 82.8 t90 -65.29 -55.21 19.61 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.697 0.629 . . . . 14.4 112.697 -178.448 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' MET . . . . . 0.498 ' HB3' ' HB3' ' A' ' 128' ' ' ALA . 11.1 ptt? -61.78 -32.39 72.66 Favored 'General case' 0 N--CA 1.464 0.237 0 N-CA-C 112.55 0.574 . . . . 14.63 112.55 -177.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . 0.516 HD13 ' HB3' ' A' ' 85' ' ' MET . 25.3 pt -80.71 -20.87 11.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 C-N-CA 120.779 -0.368 . . . . 11.62 111.423 179.835 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 33.2 t -67.66 -32.8 73.73 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.104 0.478 . . . . 8.66 110.175 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 7.3 mm-40 -84.6 -23.65 29.49 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.595 -0.729 . . . . 11.87 111.1 180.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 63.9 mttm . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.289 -0.863 . . . . 13.97 110.989 179.503 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 149' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 151' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 68.1 m . . . . . 0 N--CA 1.486 1.343 0 CA-C-O 120.829 0.347 . . . . 5.2 110.932 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -59.7 153.38 20.38 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.0 -0.545 . . . . 3.26 110.881 179.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 21.4 mt -67.75 89.77 0.27 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.253 -0.43 . . . . 2.0 110.919 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.44 -171.23 0.94 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.178 -0.465 . . . . 1.72 110.869 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -69.94 -46.25 65.72 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.134 0.492 . . . . 2.2 110.442 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -72.03 -41.9 66.96 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.578 -0.737 . . . . 1.35 110.664 179.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -60.55 -45.84 92.41 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.1 -0.5 . . . . 2.34 110.603 179.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.521 ' HA ' ' CZ ' ' A' ' 12' ' ' PHE . 40.7 mt -57.92 -52.27 60.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.16 -0.473 . . . . 1.27 110.879 179.733 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.2 -21.4 65.09 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.068 -0.515 . . . . 1.22 111.716 -179.607 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -72.72 -56.78 4.76 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 111.991 0.367 . . . . 2.27 111.991 -178.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.521 ' CZ ' ' HA ' ' A' ' 9' ' ' ILE . 7.5 p90 -77.92 -26.18 48.83 Favored 'General case' 0 C--N 1.332 -0.178 0 C-N-CA 120.674 -0.41 . . . . 0.46 110.789 -179.764 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.47 ' HZ3' HG11 ' A' ' 17' ' ' VAL . 26.7 tptp -65.01 -38.47 91.04 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 109.383 -0.599 . . . . 1.85 109.383 178.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.469 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 20.1 t70 -66.65 -48.62 68.83 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 108.945 -0.761 . . . . 0.44 108.945 178.186 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.78 -14.59 59.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.411 -0.813 . . . . 1.08 110.723 179.184 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.419 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 88.3 t80 -77.14 -49.89 14.21 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.029 -0.532 . . . . 0.56 110.436 -179.579 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.47 HG11 ' HZ3' ' A' ' 13' ' ' LYS . 16.5 m -67.32 -22.6 29.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.215 -0.448 . . . . 1.69 110.26 179.67 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.469 ' HG2' ' O ' ' A' ' 14' ' ' ASP . 26.1 mm-40 -63.85 -20.82 66.1 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.829 -0.623 . . . . 2.23 111.379 179.444 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 45.2 m-85 -114.83 24.21 11.96 Favored 'General case' 0 C--N 1.332 -0.156 0 N-CA-C 111.903 0.335 . . . . 0.69 111.903 -179.36 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -112.26 81.45 1.47 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.965 0.412 . . . . 0.46 110.504 179.335 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -92.44 -25.52 18.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.832 -0.622 . . . . 2.55 111.286 -179.63 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -70.49 -15.33 62.79 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.102 -0.499 . . . . 1.8 111.355 -179.497 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.16 -0.08 68.84 Favored Glycine 0 CA--C 1.518 0.24 0 C-N-CA 120.749 -0.739 . . . . 0.54 112.708 179.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.41 ' HG1' ' HB2' ' A' ' 26' ' ' LYS . 40.4 p -82.48 11.9 5.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.632 0.253 . . . . 1.1 111.222 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 57.86 24.47 53.92 Favored Glycine 0 C--N 1.33 0.245 0 C-N-CA 120.676 -0.773 . . . . 0.37 111.724 -179.489 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.643 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 47.7 mtpt -129.61 155.49 45.75 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.725 0.298 . . . . 1.75 110.678 -179.516 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 36.3 pt -118.47 130.85 72.73 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.411 -0.359 . . . . 1.2 111.29 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -50.07 129.38 20.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.372 -0.376 . . . . 1.04 111.274 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.41 HG22 HD12 ' A' ' 63' ' ' LEU . 79.7 p -61.55 -21.37 64.22 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.118 -0.492 . . . . 1.71 110.722 179.819 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 51.8 mtp180 -80.91 4.08 20.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.742 -0.663 . . . . 3.53 110.201 179.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -119.05 -6.63 10.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.547 -0.751 . . . . 2.26 110.55 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.473 ' O ' ' HG2' ' A' ' 36' ' ' MET . 10.2 tt -55.2 -51.18 67.37 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.242 -0.436 . . . . 1.95 110.18 179.534 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -52.27 -48.88 52.77 Favored Glycine 0 C--N 1.331 0.288 0 C-N-CA 120.531 -0.842 . . . . 0.32 111.496 179.209 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 90.7 m -59.36 -34.44 72.39 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 121.319 0.58 . . . . 1.01 109.848 178.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 47.2 tp -70.36 -28.66 65.3 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.296 -0.865 . . . . 1.85 110.26 179.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.473 ' HG2' ' O ' ' A' ' 32' ' ' LEU . 23.9 mmm -76.12 -21.42 56.66 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.06 -0.518 . . . . 1.43 109.768 179.057 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -75.41 -44.74 42.98 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.651 -0.704 . . . . 3.27 110.326 179.071 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 7.9 t -71.51 -13.28 61.76 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.031 -0.531 . . . . 1.54 110.416 179.13 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.442 ' C ' ' H ' ' A' ' 41' ' ' GLN . 76.7 mt -112.83 157.4 21.43 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.727 -0.67 . . . . 1.94 110.187 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -71.84 34.85 0.61 Allowed Glycine 0 CA--C 1.521 0.449 0 C-N-CA 120.762 -0.733 . . . . 0.69 113.34 -179.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.442 ' H ' ' C ' ' A' ' 39' ' ' LEU . 12.8 mm-40 -93.58 -80.68 0.38 Allowed 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.791 0.329 . . . . 1.97 111.087 179.569 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 32.5 m-80 56.81 74.89 0.62 Allowed Pre-proline 0 C--N 1.332 -0.184 0 CA-C-N 115.943 -0.571 . . . . 3.44 111.05 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 92.1 Cg_endo -79.18 173.88 12.78 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.654 2.236 . . . . 0.59 112.446 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 19.9 m -69.07 152.71 44.86 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.172 -0.467 . . . . 1.28 110.778 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -55.09 -55.21 33.65 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.733 0.302 . . . . 2.7 111.128 -179.648 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -54.43 -47.92 72.26 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.092 -0.504 . . . . 1.15 111.804 -179.565 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.41 ' HG2' HD21 ' A' ' 51' ' ' LEU . 39.5 tt0 -57.99 -48.24 80.61 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.87 0.367 . . . . 2.23 110.456 -179.629 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.405 ' HA ' HD22 ' A' ' 51' ' ' LEU . 31.8 tp -57.07 -38.61 73.54 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.78 -0.645 . . . . 2.01 110.977 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 83.3 mm-40 -72.82 -31.04 64.52 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.303 -0.408 . . . . 1.68 111.551 -179.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 28.1 m-20 -73.78 -54.99 6.79 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.547 -0.297 . . . . 0.62 111.8 -179.44 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.427 HD12 HD23 ' A' ' 32' ' ' LEU . 2.2 pp -60.75 -38.57 85.64 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.611 -0.268 . . . . 1.11 111.516 -179.226 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 82.4 mt -68.81 -36.75 75.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.934 0.397 . . . . 1.25 110.744 179.595 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.96 -50.76 61.29 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.096 -0.502 . . . . 1.24 111.073 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -62.08 -38.53 89.17 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.283 -0.417 . . . . 2.54 110.603 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -73.58 -18.21 61.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.285 -0.416 . . . . 1.19 111.04 179.747 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -70.8 -55.02 9.48 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.272 -0.422 . . . . 1.95 110.612 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 7.9 p30 -89.65 43.68 1.16 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.183 -0.462 . . . . 3.19 110.988 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -155.16 -15.66 0.11 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.705 -0.68 . . . . 2.69 110.61 179.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -144.21 21.39 1.73 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.911 -0.586 . . . . 2.05 110.613 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 9.8 m120 64.49 -83.24 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.126 0 CA-C-N 115.861 -0.609 . . . . 1.67 111.314 179.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -154.69 19.54 0.59 Allowed Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.793 -0.718 . . . . 0.86 112.336 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.643 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -128.49 155.31 45.03 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.981 0.419 . . . . 0.49 111.156 -179.847 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.534 ' HG ' ' HB2' ' A' ' 67' ' ' GLU . 9.5 tp -124.45 154.09 41.0 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.901 -0.59 . . . . 2.05 110.482 -179.604 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . 0.414 ' CG ' ' HE3' ' A' ' 26' ' ' LYS . 7.6 m-80 -113.41 157.63 21.67 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-O 121.111 0.481 . . . . 1.52 111.548 -179.708 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 88.1 t80 -46.88 -43.52 18.85 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.281 -0.872 . . . . 0.46 111.02 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -67.62 -34.43 76.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 1.41 111.877 -179.82 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.534 ' HB2' ' HG ' ' A' ' 63' ' ' LEU . 22.4 mm-40 -64.39 -53.41 48.95 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.958 0.409 . . . . 1.36 110.245 179.682 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.447 ' O ' ' HG3' ' A' ' 72' ' ' MET . 28.0 t80 -59.91 -51.11 71.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.825 -0.625 . . . . 0.61 110.336 179.261 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 1.5 m -55.25 -49.67 71.45 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.821 -0.627 . . . . 1.41 111.085 179.727 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -47.51 -49.73 20.14 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.982 -0.627 . . . . 0.41 112.212 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.453 ' HA ' ' HG2' ' A' ' 74' ' ' LYS . 12.7 mt -64.19 -45.56 95.98 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.308 0 CA-C-O 121.015 0.436 . . . . 1.13 110.743 179.541 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' MET . . . . . 0.447 ' HG3' ' O ' ' A' ' 68' ' ' PHE . 38.0 mtp -54.84 -25.01 25.68 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.9 -0.591 . . . . 1.24 110.135 179.556 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.49 ' O ' ' HB3' ' A' ' 77' ' ' ARG . . . -76.04 -49.27 18.01 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.36 -0.382 . . . . 1.17 110.748 179.69 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.453 ' HG2' ' HA ' ' A' ' 71' ' ' ILE . 19.2 pttp -65.35 -35.4 80.86 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.516 -0.311 . . . . 1.91 111.081 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -81.41 -55.67 4.55 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.728 0.64 . . . . 2.03 112.728 -179.033 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 24.7 mtm -74.17 -56.28 5.09 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 113.066 0.765 . . . . 1.52 113.066 -178.321 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . 0.49 ' HB3' ' O ' ' A' ' 73' ' ' ALA . 29.5 ttt180 -67.99 -55.93 10.85 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 112.13 0.419 . . . . 5.25 112.13 -178.331 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 60.22 -80.7 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 O-C-N 123.093 0.246 . . . . 4.01 110.669 -179.12 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' THR . . . . . 0.416 ' N ' ' O ' ' A' ' 77' ' ' ARG . 19.0 p -147.25 40.53 1.04 Allowed 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.45 -0.341 . . . . 5.71 111.366 179.446 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -85.91 14.18 6.43 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 121.034 0.445 . . . . 5.6 110.801 -179.775 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.445 HG22 ' O ' ' A' ' 81' ' ' THR . 3.9 t -70.41 90.89 0.73 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.857 -0.61 . . . . 7.48 111.605 -179.876 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.416 ' HB2' ' OH ' ' A' ' 138' ' ' TYR . 11.2 pt-20 -50.25 -20.77 1.13 Allowed 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 112.793 0.664 . . . . 9.74 112.793 -178.876 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 25.9 mm-40 -68.78 -57.01 6.21 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.758 0.313 . . . . 12.11 111.644 -179.312 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -71.86 -27.34 62.81 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.106 0.479 . . . . 10.87 110.513 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' MET . . . . . 0.534 ' HB3' HD13 ' A' ' 145' ' ' ILE . 27.7 mtp -70.88 -36.09 72.63 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.629 -0.714 . . . . 11.09 110.47 -179.73 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 70.0 ttt180 -68.22 -43.56 77.72 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.973 -0.558 . . . . 16.05 110.2 179.575 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -55.21 -42.91 73.94 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.74 -0.467 . . . . 14.85 109.74 178.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -61.1 -38.44 86.29 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.776 -0.647 . . . . 14.11 110.688 179.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -58.17 -40.89 82.63 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.237 -0.438 . . . . 16.42 110.554 179.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 26.3 mtpp -63.96 -37.9 89.11 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.829 -0.623 . . . . 17.66 110.584 179.611 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 66.0 mt -62.32 -44.03 98.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.875 -0.602 . . . . 18.15 111.598 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.458 ' HA ' HG23 ' A' ' 108' ' ' VAL . 18.5 m-85 -80.31 -20.52 44.14 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 111.791 0.293 . . . . 18.34 111.791 -179.614 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -96.88 108.65 21.39 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.892 0.377 . . . . 19.29 111.047 -179.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.82 -58.9 3.33 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.941 -0.572 . . . . 22.47 111.295 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -74.82 158.86 32.72 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.151 -0.477 . . . . 23.34 111.347 -179.466 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -80.88 5.19 66.52 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.796 -0.716 . . . . 22.77 111.429 178.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 27.8 p-10 -55.52 -35.06 65.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.904 0.383 . . . . 23.0 111.384 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 89.86 30.95 11.78 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.867 -0.682 . . . . 20.02 112.167 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -146.78 146.79 30.39 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.639 0.257 . . . . 20.56 110.902 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 40.4 mt -114.17 125.3 71.44 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-O 120.846 0.355 . . . . 19.37 111.097 179.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' SER . . . . . 0.481 ' OG ' ' HD2' ' A' ' 102' ' ' PRO . 47.3 t -114.61 152.67 46.46 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.055 -0.52 . . . . 22.65 110.421 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . 0.481 ' HD2' ' OG ' ' A' ' 101' ' ' SER . 55.6 Cg_exo -40.05 -34.71 1.01 Allowed 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.564 2.176 . . . . 23.78 112.848 179.669 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.86 -46.57 81.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.292 -0.413 . . . . 25.0 111.132 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -74.37 -39.2 62.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.936 -0.574 . . . . 22.31 110.75 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.421 HD21 ' HB ' ' A' ' 121' ' ' ILE . 8.7 tp -54.86 -49.68 70.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.93 -0.577 . . . . 20.62 110.407 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.426 ' HG3' HD12 ' A' ' 110' ' ' ILE . 10.4 ttt180 -63.89 -47.85 78.96 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.899 -0.591 . . . . 27.9 110.582 179.424 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 68.4 t80 -49.91 -43.43 49.63 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.881 -0.6 . . . . 25.96 111.492 -179.387 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.498 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 53.9 t -72.16 -49.94 40.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.585 -0.28 . . . . 21.06 111.268 -179.785 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 18.6 mmt -49.13 -49.54 41.69 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.302 -0.408 . . . . 20.93 111.352 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.426 HD12 ' HG3' ' A' ' 106' ' ' ARG . 63.4 mt -59.84 -28.13 40.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.232 -0.44 . . . . 25.52 110.937 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -77.9 -29.49 50.18 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.122 -0.49 . . . . 23.32 110.937 179.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.498 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 14.8 mt -74.47 -41.35 60.92 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.387 -0.37 . . . . 21.07 110.836 -179.892 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 131.28 -0.04 5.12 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.879 -0.677 . . . . 23.25 112.422 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -101.55 109.27 21.05 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.882 0.372 . . . . 22.59 111.021 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -74.77 113.68 12.33 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.128 -0.487 . . . . 28.21 111.013 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . 0.437 HG13 ' OE1' ' A' ' 120' ' ' GLU . 4.9 m -131.21 146.39 33.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 121.006 0.432 . . . . 24.75 111.437 179.634 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 55.3 p -92.88 152.39 19.43 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.883 -0.599 . . . . 27.5 110.128 179.306 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -55.79 -19.05 9.97 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.328 -0.396 . . . . 27.03 111.118 -179.69 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -76.11 -55.48 5.55 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.356 -0.384 . . . . 29.14 111.709 -179.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . 0.437 ' OE1' HG13 ' A' ' 116' ' ' VAL . 14.5 pt-20 -62.59 -40.82 98.13 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 111.873 0.323 . . . . 24.7 111.873 -179.152 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.421 ' HB ' HD21 ' A' ' 105' ' ' LEU . 43.9 pt -70.09 -35.14 62.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 C-N-CA 120.853 -0.339 . . . . 22.9 111.242 -179.671 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -61.14 -38.83 87.8 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.833 0.349 . . . . 24.29 110.305 179.437 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -64.52 -46.35 83.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.055 -0.521 . . . . 24.74 110.446 179.461 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 53.0 ttp -56.58 -39.04 72.82 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 116.09 -0.505 . . . . 20.15 110.537 179.457 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 82.1 mt -65.36 -41.3 90.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.914 -0.585 . . . . 20.23 110.513 179.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 69.1 ttt180 -60.52 -32.17 71.2 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.664 -0.698 . . . . 25.57 110.821 179.666 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -67.79 -36.19 79.99 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.125 -0.489 . . . . 19.18 111.062 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.642 ' HB3' ' HB3' ' A' ' 144' ' ' MET . . . -90.93 -15.48 29.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.262 -0.426 . . . . 16.88 110.964 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . 0.425 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 19.1 t70 -98.39 106.67 18.98 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.978 -0.556 . . . . 20.4 110.902 -179.662 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -94.19 -33.34 13.33 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.805 -0.634 . . . . 21.43 111.448 -179.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -67.81 -15.97 63.88 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.87 0.367 . . . . 23.37 110.649 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 60.41 85.63 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.962 -0.637 . . . . 24.32 112.85 179.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -143.05 -35.4 0.4 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.753 0.311 . . . . 24.4 110.851 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 110.91 6.06 26.66 Favored Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.832 -0.699 . . . . 23.47 112.729 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 78.3 mtp -131.43 155.26 47.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.631 0.253 . . . . 22.91 110.627 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.519 HG23 ' HB2' ' A' ' 140' ' ' GLU . 48.1 mm -117.33 144.79 24.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 121.203 0.525 . . . . 18.67 111.851 -179.477 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . 0.451 ' O ' ' N ' ' A' ' 139' ' ' GLU . 29.8 p-10 -116.92 158.13 24.56 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.354 -0.839 . . . . 16.97 109.194 178.44 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.416 ' OH ' ' HB2' ' A' ' 82' ' ' GLU . 26.8 t80 -39.21 -23.72 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.368 0.507 . . . . 15.28 112.368 -179.534 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.451 ' N ' ' O ' ' A' ' 137' ' ' ASN . 45.4 mt-10 -80.45 -56.01 4.48 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 120.744 0.307 . . . . 14.82 111.401 -179.486 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.519 ' HB2' HG23 ' A' ' 136' ' ' ILE . 34.7 mt-10 -62.82 -31.02 71.93 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.908 0.385 . . . . 17.46 110.38 -179.961 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.553 ' HA ' ' HE1' ' A' ' 144' ' ' MET . 78.0 t80 -66.89 -54.51 21.44 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.976 -0.556 . . . . 13.65 109.689 178.892 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . 0.497 ' HA ' HD13 ' A' ' 145' ' ' ILE . 1.7 t -47.84 -35.44 4.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.306 -0.861 . . . . 11.12 111.286 179.101 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 79.8 t90 -69.71 -55.32 10.26 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.278 0.473 . . . . 14.4 112.278 -179.42 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' MET . . . . . 0.642 ' HB3' ' HB3' ' A' ' 128' ' ' ALA . 21.4 ptt? -65.32 -21.71 66.74 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 113.323 0.861 . . . . 14.63 113.323 -177.627 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . 0.598 ' HA ' ' HB2' ' A' ' 148' ' ' LYS . 44.0 pt -80.61 -43.77 21.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 C-N-CA 120.806 -0.357 . . . . 11.62 111.861 -179.821 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' SER . . . . . 0.515 ' N ' HG13 ' A' ' 145' ' ' ILE . 46.9 t -63.67 -13.89 46.98 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 121.472 0.653 . . . . 8.66 109.473 179.574 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 6.2 mm-40 -126.19 21.73 7.32 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 114.781 -1.099 . . . . 11.87 110.025 -179.272 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . 0.598 ' HB2' ' HA ' ' A' ' 145' ' ' ILE . 27.2 ttpp . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.203 -0.904 . . . . 13.97 110.931 -179.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 149' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 151' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 77.9 p . . . . . 0 N--CA 1.485 1.309 0 CA-C-O 120.836 0.351 . . . . 5.2 110.887 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -93.94 -58.27 2.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.153 -0.476 . . . . 3.26 111.094 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 11.0 mp 45.8 64.53 1.42 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.639 -0.71 . . . . 2.0 111.014 -179.476 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.408 ' O ' HG13 ' A' ' 9' ' ' ILE . 0.2 OUTLIER -59.1 177.32 0.17 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.917 -0.583 . . . . 1.72 111.181 -179.857 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -62.88 -42.87 99.93 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.294 0.568 . . . . 2.2 109.909 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -71.27 -39.0 71.83 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.309 -0.859 . . . . 1.35 110.521 179.488 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 18.3 mm-40 -62.9 -43.12 99.67 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.894 -0.593 . . . . 2.34 110.47 179.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.538 ' HA ' ' CZ ' ' A' ' 12' ' ' PHE . 83.6 mt -58.66 -54.35 34.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.139 -0.482 . . . . 1.27 110.362 179.572 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.26 -22.38 65.94 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.042 -0.527 . . . . 1.22 111.074 179.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -73.38 -56.31 5.22 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.228 -0.442 . . . . 2.27 112.186 -178.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.538 ' CZ ' ' HA ' ' A' ' 9' ' ' ILE . 4.7 p90 -78.69 -26.51 44.92 Favored 'General case' 0 C--N 1.332 -0.157 0 C-N-CA 120.542 -0.463 . . . . 0.46 111.255 -179.374 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.418 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 27.8 tptp -67.03 -38.38 85.79 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.649 -0.5 . . . . 1.85 109.649 179.116 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.422 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 16.8 t70 -66.62 -52.42 45.35 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 109.246 -0.65 . . . . 0.44 109.246 178.34 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.44 -13.66 52.71 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.603 -0.726 . . . . 1.08 110.726 179.198 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.418 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 83.0 t80 -76.96 -48.51 17.89 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.083 -0.508 . . . . 0.56 110.443 -179.741 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 30.8 m -68.73 -22.7 26.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.205 -0.452 . . . . 1.69 110.353 179.54 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.422 ' HG2' ' O ' ' A' ' 14' ' ' ASP . 26.3 mm-40 -59.48 -48.28 82.26 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.844 -0.616 . . . . 2.23 111.461 179.444 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -88.14 37.34 0.81 Allowed 'General case' 0 N--CA 1.462 0.14 0 CA-C-O 120.771 0.32 . . . . 0.69 111.622 -179.541 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -125.11 74.66 1.39 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.065 0.459 . . . . 0.46 110.397 179.328 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -84.72 -21.91 29.92 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.727 -0.67 . . . . 2.55 111.309 -179.653 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -75.97 -22.25 56.09 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.978 -0.555 . . . . 1.8 111.398 -179.404 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 82.12 4.53 90.21 Favored Glycine 0 C--N 1.33 0.229 0 C-N-CA 120.678 -0.773 . . . . 0.54 112.418 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 60.6 p -82.12 14.74 2.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.652 0.263 . . . . 1.1 111.177 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 53.92 22.86 20.91 Favored Glycine 0 C--N 1.332 0.339 0 C-N-CA 120.714 -0.755 . . . . 0.37 111.895 -179.498 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.623 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 46.2 mtpt -129.98 155.11 46.63 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.681 -0.259 . . . . 1.75 110.692 -179.374 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.649 HG13 ' HB2' ' A' ' 63' ' ' LEU . 15.4 pt -114.89 122.12 68.36 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.203 0 CA-C-O 120.915 0.388 . . . . 1.2 112.021 -179.43 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -52.81 134.71 36.71 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.087 -0.506 . . . . 1.04 111.114 179.693 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.438 ' HG1' ' HB2' ' A' ' 55' ' ' ALA . 7.0 t -65.53 -13.19 58.38 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.016 -0.538 . . . . 1.71 111.152 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 32.1 mtt180 -80.94 -10.09 59.76 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.012 -0.54 . . . . 3.53 110.632 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -116.61 1.12 12.82 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.819 -0.628 . . . . 2.26 110.619 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.466 HD13 HD21 ' A' ' 35' ' ' LEU . 16.0 tp -64.13 -47.75 78.75 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.382 -0.372 . . . . 1.95 110.685 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.429 ' O ' ' HG3' ' A' ' 37' ' ' ARG . . . -51.86 -41.41 51.46 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.246 -0.978 . . . . 0.32 110.927 179.115 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.43 ' O ' HG23 ' A' ' 38' ' ' THR . 95.2 m -68.14 -30.63 69.81 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.985 0.421 . . . . 1.01 110.359 179.112 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.466 HD21 HD13 ' A' ' 32' ' ' LEU . 60.6 tp -71.73 -41.52 68.39 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.761 -0.654 . . . . 1.85 111.246 -179.816 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.413 ' SD ' ' HG3' ' A' ' 43' ' ' PRO . 48.2 mtp -72.31 -23.9 61.24 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.301 -0.409 . . . . 1.43 110.849 179.807 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.429 ' HG3' ' O ' ' A' ' 33' ' ' GLY . 81.9 mtt180 -72.62 -46.14 55.59 Favored 'General case' 0 N--CA 1.461 0.125 0 CA-C-O 120.958 0.408 . . . . 3.27 110.297 179.179 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.564 HG22 HD13 ' A' ' 39' ' ' LEU . 1.8 t -68.16 -11.16 58.73 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.958 -0.564 . . . . 1.54 110.412 179.023 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.564 HD13 HG22 ' A' ' 38' ' ' THR . 8.4 mp -111.47 156.82 21.09 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.603 -0.726 . . . . 1.94 110.304 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -45.79 -24.42 1.26 Allowed Glycine 0 CA--C 1.519 0.323 0 C-N-CA 121.224 -0.512 . . . . 0.69 113.439 -179.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.416 ' OE1' ' HB3' ' A' ' 39' ' ' LEU . 19.7 mp0 -57.07 152.94 12.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.893 0.377 . . . . 1.97 111.174 179.811 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 -155.28 71.87 5.61 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.067 -0.515 . . . . 3.44 110.952 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.413 ' HG3' ' SD ' ' A' ' 36' ' ' MET . 60.0 Cg_endo -69.24 152.5 72.01 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.789 2.326 . . . . 0.59 112.35 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 27.2 m -76.13 151.21 37.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.174 -0.466 . . . . 1.28 110.321 179.397 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.432 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 1.3 mp0 -44.55 -55.08 5.43 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.678 0.275 . . . . 2.7 111.191 -179.714 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -54.5 -45.01 73.17 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.234 -0.439 . . . . 1.15 111.392 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -56.2 -49.83 72.96 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.234 -0.439 . . . . 2.23 111.216 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 17.5 mt -59.74 -41.78 91.73 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.683 0.278 . . . . 2.01 110.934 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.432 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 78.0 mm-40 -66.64 -30.28 70.52 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.523 -0.308 . . . . 1.68 111.274 -179.702 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 -75.83 -54.99 6.06 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.424 -0.353 . . . . 0.62 111.431 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 3.1 pp -64.09 -38.14 89.99 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.437 -0.347 . . . . 1.11 111.361 -179.469 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 44.9 mt -65.79 -43.92 93.19 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 C-N-CA 121.066 -0.253 . . . . 1.25 110.741 179.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.8 -29.55 70.8 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.929 0.395 . . . . 1.24 110.739 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -74.59 -52.96 10.34 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.963 -0.562 . . . . 2.54 110.075 179.625 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . 0.438 ' HB2' ' HG1' ' A' ' 29' ' ' THR . . . -69.86 -14.44 62.75 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.014 -0.539 . . . . 1.19 111.508 179.786 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -73.6 -37.04 65.56 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.851 0.358 . . . . 1.95 110.965 -179.647 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 18.0 m120 -89.6 16.67 7.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.235 -0.439 . . . . 3.19 110.656 179.683 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.413 ' ND2' ' H ' ' A' ' 59' ' ' ASN . 3.1 t-20 -142.39 151.55 41.97 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.905 -0.589 . . . . 2.69 110.627 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . 0.477 ' HB3' ' HZ2' ' A' ' 26' ' ' LYS . 2.5 m120 62.86 9.92 3.98 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.221 -0.445 . . . . 2.05 111.17 179.704 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 14.2 m120 63.03 11.52 5.22 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.329 -0.396 . . . . 1.67 111.827 179.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 110.44 44.03 1.02 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.61 -0.805 . . . . 0.86 112.822 179.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.623 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -147.62 154.83 41.14 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.066 0.46 . . . . 0.49 111.11 179.856 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.649 ' HB2' HG13 ' A' ' 27' ' ' ILE . 66.4 mt -124.47 155.88 38.18 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.809 -0.632 . . . . 2.05 109.982 179.531 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . 0.453 ' OD1' ' HE3' ' A' ' 26' ' ' LYS . 0.6 OUTLIER -113.15 156.74 22.66 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.924 -0.31 . . . . 1.52 110.505 -179.66 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -43.06 -50.23 6.07 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.117 -0.492 . . . . 0.46 110.913 179.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.7 -29.59 69.62 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.285 -0.416 . . . . 1.41 111.35 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.411 ' HG2' ' HB2' ' A' ' 64' ' ' ASN . 14.3 mm-40 -65.1 -55.45 18.7 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.831 0.348 . . . . 1.36 110.203 179.317 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 32.8 t80 -63.98 -45.98 86.65 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.077 -0.511 . . . . 0.61 109.993 179.255 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 62.7 m -57.34 -35.46 69.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.809 -0.632 . . . . 1.41 110.251 179.477 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -59.51 -54.4 38.07 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.788 -0.72 . . . . 0.41 111.431 179.436 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.466 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 12.6 mt -60.16 -43.38 92.96 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.347 0 CA-C-O 121.108 0.48 . . . . 1.13 110.173 179.099 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' MET . . . . . 0.409 ' O ' ' HB2' ' A' ' 76' ' ' MET . 40.1 mtp -53.76 -32.52 52.64 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.859 -0.61 . . . . 1.24 110.051 179.317 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -67.17 -47.71 70.15 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.186 -0.461 . . . . 1.17 110.853 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.466 ' HG2' ' O ' ' A' ' 71' ' ' ILE . 65.7 pttt -70.44 -28.9 65.39 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.412 -0.358 . . . . 1.91 111.747 -179.591 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 6.9 mm100 -82.1 -35.06 28.98 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.186 0.517 . . . . 2.03 111.155 -179.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' MET . . . . . 0.409 ' HB2' ' O ' ' A' ' 72' ' ' MET . 50.7 mtp -79.6 -19.2 49.87 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.525 -0.762 . . . . 1.52 111.969 -179.024 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 51.1 mtp180 -61.48 -17.53 54.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.663 -0.244 . . . . 5.25 111.361 -179.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -142.12 78.41 1.62 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.453 -0.34 . . . . 4.01 111.081 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 14.7 t -173.39 -1.36 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 120.764 -0.375 . . . . 5.71 111.342 179.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -107.68 -54.6 2.47 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.389 -0.368 . . . . 5.6 111.445 -179.499 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.546 ' O ' ' HG2' ' A' ' 85' ' ' MET . 6.6 t 36.11 57.06 1.02 Allowed 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 120.98 0.419 . . . . 7.48 111.836 -179.697 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -42.71 -30.91 0.41 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 115.57 -0.741 . . . . 9.74 112.977 -179.152 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -60.56 -55.94 27.37 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 120.879 0.371 . . . . 12.11 111.52 -179.332 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -63.99 -21.93 66.71 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.169 -0.468 . . . . 10.87 111.167 -179.582 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' MET . . . . . 0.546 ' HG2' ' O ' ' A' ' 81' ' ' THR . 11.3 mmm -74.41 -41.13 61.42 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.895 0.379 . . . . 11.09 110.578 -179.558 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 50.8 ttp180 -62.46 -46.57 87.92 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.969 -0.559 . . . . 16.05 110.404 179.729 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.424 ' O ' HG12 ' A' ' 91' ' ' ILE . 40.7 tt0 -55.73 -47.05 77.56 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.029 0.442 . . . . 14.85 109.867 179.015 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.84 -32.89 74.79 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.796 -0.638 . . . . 14.11 111.034 179.616 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 81.7 t80 -61.5 -37.12 82.52 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-O 120.978 0.418 . . . . 16.42 110.494 179.777 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 89.0 mttt -69.21 -40.1 78.21 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.871 -0.604 . . . . 17.66 110.501 179.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.424 HG12 ' O ' ' A' ' 87' ' ' GLU . 37.4 mm -60.51 -50.5 80.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.897 -0.592 . . . . 18.15 111.567 -179.799 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -66.79 -48.08 70.11 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.306 -0.406 . . . . 18.34 111.635 -179.347 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 53.6 t0 -60.83 93.82 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.984 0.421 . . . . 19.29 110.557 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.666 ' HE ' ' HG2' ' A' ' 104' ' ' GLU . 34.8 mtm180 -63.01 -11.55 19.83 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.9 -0.591 . . . . 22.47 111.49 -179.497 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . 0.418 ' HB2' ' OD1' ' A' ' 97' ' ' ASP . 8.9 m-20 -119.82 170.23 9.42 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.965 0.412 . . . . 23.34 111.09 -179.78 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.49 5.21 57.02 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.925 -0.655 . . . . 22.77 112.256 179.602 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.418 ' OD1' ' HB2' ' A' ' 95' ' ' ASP . 5.0 p-10 -60.0 -38.6 83.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.66 0.267 . . . . 23.0 111.119 -179.657 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 113.05 15.04 9.42 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.804 -0.712 . . . . 20.02 112.955 179.648 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -142.34 154.13 44.41 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.613 0.244 . . . . 20.56 110.758 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 76.8 mt -114.11 140.7 33.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 121.023 0.44 . . . . 19.37 111.337 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' SER . . . . . 0.431 ' OG ' ' HD2' ' A' ' 102' ' ' PRO . 31.1 t -114.51 154.22 46.6 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 115.589 -0.732 . . . . 22.65 109.956 179.785 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . 0.431 ' HD2' ' OG ' ' A' ' 101' ' ' SER . 57.7 Cg_exo -50.53 -36.19 48.55 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 121.941 1.76 . . . . 23.78 111.442 -179.892 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.73 -48.84 79.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.765 -0.652 . . . . 25.0 109.911 178.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . 0.666 ' HG2' ' HE ' ' A' ' 94' ' ' ARG . 45.4 mt-10 -59.47 -45.62 91.12 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.303 -0.862 . . . . 22.31 110.332 179.245 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.566 HD23 ' HB ' ' A' ' 121' ' ' ILE . 2.6 tt -63.29 -29.7 70.97 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.585 -0.734 . . . . 20.62 110.615 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.424 ' CZ ' HD11 ' A' ' 110' ' ' ILE . 12.1 tpt180 -72.81 -40.41 65.88 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.709 -0.678 . . . . 27.9 111.5 -179.645 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 53.3 t80 -76.87 -35.18 57.63 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 111.98 0.363 . . . . 25.96 111.98 -178.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 90.4 t -72.34 -47.45 52.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 111.692 0.256 . . . . 21.06 111.692 -179.455 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 12.9 mmt -50.98 -36.32 38.44 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.712 0.291 . . . . 20.93 111.283 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.424 HD11 ' CZ ' ' A' ' 106' ' ' ARG . 72.4 mt -67.94 -35.58 72.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.894 0.378 . . . . 25.52 110.636 179.801 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 -66.06 -37.94 87.08 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.025 -0.534 . . . . 23.32 110.744 179.594 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 14.6 mt -67.59 -28.89 68.14 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.999 -0.546 . . . . 21.07 110.954 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 116.28 0.14 20.65 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.9 -0.667 . . . . 23.25 112.305 -179.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -103.42 110.06 21.93 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.768 0.318 . . . . 22.59 110.978 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 17.6 tppt? -80.58 116.2 20.49 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.2 -0.455 . . . . 28.21 110.743 179.708 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 3.7 m -125.33 154.59 33.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.035 0.445 . . . . 24.75 111.569 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' THR . . . . . 0.4 ' HG1' ' H ' ' A' ' 120' ' ' GLU . 80.6 p -95.68 146.27 24.63 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.735 -0.666 . . . . 27.5 110.085 179.173 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -53.55 -18.94 3.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.279 -0.418 . . . . 27.03 111.367 -179.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -79.22 -52.13 8.56 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.38 -0.373 . . . . 29.14 111.697 -179.49 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . 0.4 ' H ' ' HG1' ' A' ' 117' ' ' THR . 13.2 pt-20 -63.09 -37.12 85.92 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.627 -0.261 . . . . 24.7 111.567 -179.269 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.566 ' HB ' HD23 ' A' ' 105' ' ' LEU . 48.3 pt -74.67 -35.46 37.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 C-N-CA 120.995 -0.282 . . . . 22.9 111.031 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -61.2 -38.59 87.1 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.961 0.41 . . . . 24.29 110.309 179.185 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -67.81 -43.48 79.54 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.897 -0.592 . . . . 24.74 110.52 179.488 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 50.2 ttp -58.11 -39.5 78.83 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.044 -0.525 . . . . 20.15 110.573 179.62 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 76.2 mt -66.94 -36.4 77.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.16 -0.473 . . . . 20.23 110.608 179.585 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 37.6 ttm180 -66.04 -29.92 70.35 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.173 -0.467 . . . . 25.57 110.806 179.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -75.88 -26.89 57.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.14 -0.482 . . . . 19.18 111.239 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.619 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -97.81 -16.23 19.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.245 -0.434 . . . . 16.88 111.173 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -94.57 105.19 17.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.135 -0.484 . . . . 20.4 111.009 -179.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -100.33 -33.34 10.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.865 -0.607 . . . . 21.43 111.294 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -64.06 -27.95 69.45 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.375 -0.375 . . . . 23.37 110.715 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 75.98 81.88 0.52 Allowed Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.921 -0.657 . . . . 24.32 112.952 179.51 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 16.5 p-10 -155.66 6.66 0.22 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.745 0.307 . . . . 24.4 110.919 179.605 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 59.94 25.64 62.04 Favored Glycine 0 C--N 1.331 0.251 0 C-N-CA 120.891 -0.671 . . . . 23.47 112.551 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 96.8 mmm -135.96 152.5 51.02 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.596 0.236 . . . . 22.91 110.43 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.502 HG22 ' HB2' ' A' ' 140' ' ' GLU . 41.4 mm -115.86 138.71 45.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 121.341 0.591 . . . . 18.67 112.126 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . 0.454 ' O ' ' N ' ' A' ' 139' ' ' GLU . 26.4 p30 -115.38 158.85 21.87 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.267 -0.879 . . . . 16.97 109.036 178.035 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 28.6 t80 -38.49 -24.21 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 112.589 0.589 . . . . 15.28 112.589 -179.029 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.454 ' N ' ' O ' ' A' ' 137' ' ' ASN . 44.4 mt-10 -80.25 -55.78 4.67 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.822 0.344 . . . . 14.82 111.213 -179.437 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.502 ' HB2' HG22 ' A' ' 136' ' ' ILE . 24.8 mt-10 -60.22 -27.17 66.98 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.174 -0.466 . . . . 17.46 110.266 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.57 ' HA ' ' HE3' ' A' ' 144' ' ' MET . 69.0 t80 -71.14 -56.34 6.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.877 -0.601 . . . . 13.65 110.415 179.54 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . 0.415 HG23 ' HB2' ' A' ' 85' ' ' MET . 43.1 t -44.73 -48.05 2.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.774 -0.648 . . . . 11.12 111.794 179.432 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 78.8 t90 -64.65 -55.43 20.25 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.513 0.56 . . . . 14.4 112.513 -178.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' MET . . . . . 0.619 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 16.7 ptt? -60.37 -35.41 75.64 Favored 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 112.451 0.538 . . . . 14.63 112.451 -178.004 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . 0.481 HD13 ' HB3' ' A' ' 85' ' ' MET . 3.2 pt -80.93 -17.27 12.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 C-N-CA 120.591 -0.444 . . . . 11.62 111.275 -179.883 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 42.2 t -69.25 -36.46 77.17 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.399 -0.593 . . . . 8.66 109.399 179.231 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 31.8 mm-40 -93.56 -16.48 24.36 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.138 -0.937 . . . . 11.87 110.229 179.382 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . 0.436 ' CB ' ' HA ' ' A' ' 145' ' ' ILE . 37.6 ttpt . . . . . 0 C--O 1.25 1.112 0 CA-C-O 118.231 -0.89 . . . . 13.97 110.961 179.474 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 149' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 151' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 79.0 p . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 120.746 0.308 . . . . 5.2 110.827 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -134.46 -19.34 1.9 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.169 -0.469 . . . . 3.26 110.995 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 9.8 mp 41.23 65.13 0.87 Allowed 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.218 -0.446 . . . . 2.0 111.491 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -62.88 167.0 5.02 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.422 -0.354 . . . . 1.72 110.68 179.616 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -49.37 -39.8 33.51 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.707 0.289 . . . . 2.2 111.436 179.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.95 -33.72 59.83 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.432 -0.349 . . . . 1.35 110.699 -179.593 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 -67.02 -44.73 79.5 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.001 -0.545 . . . . 2.34 110.583 179.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.514 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 80.4 mt -61.29 -51.77 69.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.992 -0.549 . . . . 1.27 110.755 179.804 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.48 -21.0 66.53 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.044 -0.526 . . . . 1.22 111.193 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -72.09 -56.42 5.64 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 116.405 -0.361 . . . . 2.27 111.696 -179.405 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.514 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 8.6 p90 -77.85 -24.67 48.52 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.703 -0.399 . . . . 0.46 110.823 -179.636 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.412 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 20.1 tptm -66.81 -36.93 83.51 Favored 'General case' 0 C--O 1.233 0.201 0 N-CA-C 109.355 -0.609 . . . . 1.85 109.355 178.738 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.432 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 23.5 t70 -68.05 -48.18 66.32 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 109.224 -0.658 . . . . 0.44 109.224 178.347 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.72 -14.31 61.04 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.666 -0.697 . . . . 1.08 110.528 178.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.412 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 81.2 t80 -77.48 -49.94 13.7 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-N 115.929 -0.578 . . . . 0.56 110.18 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 34.0 m -66.91 -21.4 28.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.075 -0.511 . . . . 1.69 110.141 179.395 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.432 ' HG3' ' O ' ' A' ' 14' ' ' ASP . 70.5 mt-30 -59.99 -46.17 90.34 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.625 -0.716 . . . . 2.23 111.212 179.2 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 25.8 m-85 -84.36 22.33 1.27 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.304 -0.407 . . . . 0.69 111.565 -179.471 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -120.45 66.15 0.84 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.146 0.498 . . . . 0.46 110.441 179.385 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 11.2 mmmm -73.32 -26.19 60.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.77 -0.65 . . . . 2.55 111.269 -179.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -68.89 -42.64 76.66 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.111 -0.495 . . . . 1.8 111.306 -179.629 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 107.73 11.77 24.09 Favored Glycine 0 C--N 1.331 0.272 0 C-N-CA 120.723 -0.751 . . . . 0.54 112.791 179.683 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 38.5 p -86.18 10.35 14.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.71 0.29 . . . . 1.1 111.199 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 55.68 20.12 23.35 Favored Glycine 0 C--N 1.332 0.333 0 C-N-CA 120.803 -0.713 . . . . 0.37 112.126 -179.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.473 ' C ' HE22 ' A' ' 62' ' ' GLN . 32.5 mtpt -130.35 155.93 45.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.727 0.299 . . . . 1.75 111.081 -179.669 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.423 HG13 ' HB2' ' A' ' 63' ' ' LEU . 39.5 pt -115.5 133.7 61.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.408 -0.36 . . . . 1.2 111.494 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -48.8 143.21 5.51 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.116 -0.493 . . . . 1.04 111.696 -179.672 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 58.5 p -68.86 -29.87 68.27 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.662 -0.699 . . . . 1.71 111.724 -179.704 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.522 ' H ' ' HD3' ' A' ' 30' ' ' ARG . 0.2 OUTLIER -86.11 0.47 53.43 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.392 -0.367 . . . . 3.53 111.109 -179.536 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -109.29 -3.57 17.08 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.105 -0.498 . . . . 2.26 110.845 179.824 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -61.03 -52.33 65.43 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.232 -0.44 . . . . 1.95 110.616 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.421 ' HA2' HD21 ' A' ' 48' ' ' LEU . . . -52.41 -41.25 55.12 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.638 -0.791 . . . . 0.32 111.633 179.441 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 89.4 m -64.5 -34.67 78.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.018 0.437 . . . . 1.01 110.218 179.103 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 28.9 tp -66.82 -23.72 66.08 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.711 -0.677 . . . . 1.85 110.525 179.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 23.3 mmt -78.92 -39.23 35.34 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.221 -0.445 . . . . 1.43 110.039 178.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 70.3 mtt180 -59.19 -43.12 92.2 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.691 -0.686 . . . . 3.27 111.068 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.437 HG23 HD13 ' A' ' 39' ' ' LEU . 2.0 t -70.4 -13.29 62.07 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.38 -0.373 . . . . 1.54 111.42 179.886 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.437 HD13 HG23 ' A' ' 38' ' ' THR . 10.6 mp -113.14 157.14 22.03 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.193 -0.458 . . . . 1.94 110.59 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -48.29 -19.23 1.07 Allowed Glycine 0 CA--C 1.519 0.314 0 CA-C-N 116.013 -0.54 . . . . 0.69 113.441 -179.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 61.9 mm-40 -59.03 168.57 1.28 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.885 0.374 . . . . 1.97 110.894 179.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 6.0 t30 -170.27 64.35 0.47 Allowed Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.068 -0.515 . . . . 3.44 110.777 179.605 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.533 ' HB3' ' NE2' ' A' ' 75' ' ' GLN . 32.1 Cg_endo -64.8 154.96 70.07 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.633 2.222 . . . . 0.59 112.449 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 20.8 m -80.43 157.01 26.37 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.027 -0.533 . . . . 1.28 110.69 179.765 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -46.77 -49.05 20.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.549 -0.296 . . . . 2.7 111.343 -179.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.09 -55.27 25.2 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.199 -0.455 . . . . 1.15 111.516 -179.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -50.7 -50.84 54.09 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.289 -0.414 . . . . 2.23 111.045 -179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.5 HD11 HD13 ' A' ' 52' ' ' ILE . 0.2 OUTLIER -58.25 -40.66 82.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.295 -0.411 . . . . 2.01 110.866 -179.844 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 85.0 mm-40 -67.42 -29.64 69.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.421 -0.354 . . . . 1.68 110.976 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -70.68 -49.37 47.94 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.22 -0.446 . . . . 0.62 111.529 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.401 HD12 HD12 ' A' ' 48' ' ' LEU . 0.9 OUTLIER -72.78 -28.32 62.52 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.49 -0.323 . . . . 1.11 111.614 -179.375 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.5 HD13 HD11 ' A' ' 48' ' ' LEU . 28.2 mt -70.21 -46.03 73.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 120.771 0.319 . . . . 1.25 110.389 179.467 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.94 -25.53 62.78 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.079 -0.51 . . . . 1.24 111.083 -179.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -77.98 -46.57 20.73 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.194 -0.457 . . . . 2.54 110.731 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -74.39 -27.13 60.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.188 -0.46 . . . . 1.19 111.378 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -64.76 -34.38 78.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.796 0.331 . . . . 1.95 110.985 -179.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -111.53 59.64 0.62 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.229 -0.441 . . . . 3.19 111.079 -179.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -170.81 -55.17 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.051 -0.522 . . . . 2.69 110.684 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 1.5 p30 -110.96 27.16 9.95 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.867 -0.606 . . . . 2.05 110.818 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . 0.529 ' N ' HD21 ' A' ' 60' ' ' ASN . 0.8 OUTLIER 62.66 -81.75 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.945 -0.57 . . . . 1.67 111.331 179.877 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -158.49 34.83 0.51 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.752 -0.737 . . . . 0.86 112.546 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.483 ' HA ' HE21 ' A' ' 62' ' ' GLN . 0.0 OUTLIER -140.47 150.22 43.52 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.031 0.443 . . . . 0.49 111.379 179.893 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.423 ' HB2' HG13 ' A' ' 27' ' ' ILE . 13.5 mt -121.99 155.48 35.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.804 -0.634 . . . . 2.05 110.566 -179.905 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -113.4 157.03 22.42 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.482 -0.326 . . . . 1.52 110.847 -179.657 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 59.7 t80 -43.16 -35.16 1.27 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.427 -0.351 . . . . 0.46 111.228 179.571 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.35 -38.8 59.89 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.143 0.423 . . . . 1.41 112.143 -179.579 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -63.99 -53.19 54.01 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.216 0.531 . . . . 1.36 110.28 179.636 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.433 ' CE2' ' HB2' ' A' ' 12' ' ' PHE . 18.4 t80 -59.22 -52.41 65.82 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.495 -0.775 . . . . 0.61 110.789 179.459 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 35.8 t -56.54 -49.0 76.09 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 116.28 -0.418 . . . . 1.41 110.51 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -43.67 -50.94 6.96 Favored Glycine 0 N--CA 1.45 -0.391 0 CA-C-N 115.503 -0.771 . . . . 0.41 112.313 179.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.473 ' HA ' ' HG2' ' A' ' 74' ' ' LYS . 11.0 mt -67.1 -42.69 88.62 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.373 0 CA-C-O 120.823 0.344 . . . . 1.13 111.064 179.752 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 87.8 mmm -53.26 -41.05 65.1 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.28 0.562 . . . . 1.24 110.003 179.344 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.8 -53.24 60.28 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.297 -0.865 . . . . 1.17 111.087 179.481 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.473 ' HG2' ' HA ' ' A' ' 71' ' ' ILE . 18.8 pttp -67.94 -27.09 66.32 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 120.858 0.361 . . . . 1.91 111.327 -179.81 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . 0.533 ' NE2' ' HB3' ' A' ' 43' ' ' PRO . 35.2 tt0 -80.35 -28.05 38.13 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.104 -0.498 . . . . 2.03 111.826 -179.352 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 38.6 mtt -75.46 -41.92 54.48 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 116.448 -0.342 . . . . 1.52 111.541 -179.483 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 34.0 ptt180 -67.28 -21.91 65.68 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.4 -0.364 . . . . 5.25 111.73 -179.368 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -94.29 -34.96 12.64 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.664 0.268 . . . . 4.01 111.267 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 55.1 m -66.42 129.21 39.08 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.379 -0.373 . . . . 5.71 111.006 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -157.39 29.41 0.29 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.999 -0.546 . . . . 5.6 110.152 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.479 ' O ' ' HG3' ' A' ' 85' ' ' MET . 2.7 t -38.26 117.21 0.6 Allowed 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.823 -0.626 . . . . 7.48 111.289 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -79.86 -28.73 39.98 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 112.776 0.658 . . . . 9.74 112.776 -178.3 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -59.91 -49.14 78.84 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.907 -0.317 . . . . 12.11 111.461 -179.393 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -69.72 -21.94 63.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.982 0.42 . . . . 10.87 110.628 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' MET . . . . . 0.479 ' HG3' ' O ' ' A' ' 81' ' ' THR . 23.9 mtt -72.75 -47.75 44.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.827 -0.624 . . . . 11.09 111.103 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 64.7 ttt180 -62.17 -38.21 88.17 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.396 -0.365 . . . . 16.05 110.195 179.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -59.01 -45.11 91.49 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.165 -0.68 . . . . 14.85 109.165 178.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -69.15 -27.92 65.97 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.476 -0.784 . . . . 14.11 110.557 179.259 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 62.0 t80 -63.4 -41.93 98.76 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.158 -0.474 . . . . 16.42 110.27 179.437 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 53.8 mttp -66.74 -41.82 87.2 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.765 -0.652 . . . . 17.66 110.435 179.481 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 78.3 mt -64.49 -39.61 86.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.102 -0.499 . . . . 18.15 111.076 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -73.79 -33.75 64.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.345 -0.389 . . . . 18.34 111.103 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 51.1 t0 -81.27 114.87 20.36 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.364 -0.38 . . . . 19.29 110.507 179.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.514 ' HG2' ' HB3' ' A' ' 104' ' ' GLU . 22.0 mmm180 -65.47 -57.48 8.17 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.004 -0.544 . . . . 22.47 110.992 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.99 160.3 22.04 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.093 -0.503 . . . . 23.34 110.975 -179.693 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -84.18 5.49 79.88 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.857 -0.687 . . . . 22.77 112.175 179.641 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 16.8 p-10 -57.81 -33.36 68.5 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.747 0.308 . . . . 23.0 111.185 -179.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 96.04 26.97 10.63 Favored Glycine 0 C--N 1.331 0.274 0 C-N-CA 120.833 -0.699 . . . . 20.02 112.619 179.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 68.0 m-85 -142.57 142.69 32.21 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.599 0.238 . . . . 20.56 110.853 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 65.5 mt -114.38 127.27 71.92 Favored 'Isoleucine or valine' 0 C--O 1.231 0.126 0 CA-C-O 121.0 0.429 . . . . 19.37 111.17 179.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 75.6 m -114.44 156.5 44.44 Favored Pre-proline 0 C--N 1.332 -0.182 0 CA-C-N 115.879 -0.6 . . . . 22.65 110.783 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_exo -44.13 -35.86 8.16 Favored 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 122.41 2.073 . . . . 23.78 112.284 -179.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.415 ' O ' ' HG3' ' A' ' 106' ' ' ARG . . . -63.83 -48.11 78.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.169 -0.468 . . . . 25.0 110.734 179.709 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . 0.514 ' HB3' ' HG2' ' A' ' 94' ' ' ARG . 45.4 mt-10 -72.9 -19.89 61.19 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.837 -0.619 . . . . 22.31 110.842 179.703 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.61 HD22 ' HB ' ' A' ' 121' ' ' ILE . 14.7 tp -80.16 -39.98 28.26 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.062 -0.517 . . . . 20.62 111.691 -179.22 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.433 ' HB3' HD13 ' A' ' 121' ' ' ILE . 7.4 ppt_? -73.76 -35.79 65.04 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.852 0.358 . . . . 27.9 110.517 -179.834 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 60.4 t80 -69.41 -44.7 70.85 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.963 -0.562 . . . . 25.96 111.306 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.419 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 7.3 p -63.75 -43.74 98.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.529 -0.305 . . . . 21.06 111.571 -179.536 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 20.6 mmt -55.43 -45.63 76.75 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.519 -0.309 . . . . 20.93 111.29 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 81.2 mt -59.35 -25.05 29.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.963 0.411 . . . . 25.52 110.619 179.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 80.1 m-20 -77.67 -39.41 44.96 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.963 -0.562 . . . . 23.32 110.533 179.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.419 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 10.5 mt -69.68 -28.68 66.07 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.93 -0.577 . . . . 21.07 110.668 179.859 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 113.18 17.08 7.94 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.921 -0.657 . . . . 23.25 112.523 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -113.88 108.8 17.55 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.804 0.335 . . . . 22.59 111.087 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -77.04 113.83 15.18 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.163 -0.471 . . . . 28.21 110.989 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . 0.467 ' HB ' HG21 ' A' ' 121' ' ' ILE . 1.2 m -127.39 155.01 38.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.026 0.441 . . . . 24.75 111.6 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' THR . . . . . 0.416 ' O ' HG12 ' A' ' 121' ' ' ILE . 72.2 p -99.34 144.26 28.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.793 -0.639 . . . . 27.5 110.227 179.275 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -51.77 -20.94 2.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.274 -0.421 . . . . 27.03 111.551 -179.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 12.9 mm-40 -77.43 -55.33 5.48 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.502 -0.317 . . . . 29.14 111.694 -179.618 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -61.63 -40.92 96.59 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 111.825 0.306 . . . . 24.7 111.825 -179.204 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.61 ' HB ' HD22 ' A' ' 105' ' ' LEU . 4.9 pt -68.59 -42.67 83.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 C-N-CA 121.062 -0.255 . . . . 22.9 111.584 -179.442 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.517 ' N ' HG13 ' A' ' 121' ' ' ILE . 24.0 t70 -59.76 -33.16 71.32 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.825 0.345 . . . . 24.29 110.649 179.842 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 -66.06 -49.19 68.5 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.034 -0.53 . . . . 24.74 110.434 179.562 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.423 ' HE1' HD23 ' A' ' 105' ' ' LEU . 3.1 tmm? -56.96 -37.94 72.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.032 -0.531 . . . . 20.15 111.054 179.547 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.519 HG23 HD11 ' A' ' 136' ' ' ILE . 66.4 mt -65.55 -43.52 94.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.291 -0.413 . . . . 20.23 110.516 179.793 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 23.9 ttm180 -57.43 -35.43 70.08 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.892 -0.595 . . . . 25.57 110.984 179.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -69.47 -43.5 73.11 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.166 -0.47 . . . . 19.18 110.969 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.554 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -80.4 -12.22 59.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.217 -0.447 . . . . 16.88 111.283 -179.911 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -101.31 106.14 17.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.161 -0.472 . . . . 20.4 110.942 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 82.1 m-85 -98.16 -33.64 11.05 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.911 -0.586 . . . . 21.43 111.032 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -65.1 -16.41 63.44 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.213 -0.449 . . . . 23.37 110.772 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 61.16 82.75 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.871 -0.68 . . . . 24.32 112.55 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -151.68 -6.68 0.24 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.65 0.262 . . . . 24.4 111.393 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 74.66 20.47 79.51 Favored Glycine 0 C--N 1.331 0.253 0 C-N-CA 120.785 -0.721 . . . . 23.47 112.815 179.647 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 47.9 mtp -136.01 155.64 49.93 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.623 0.249 . . . . 22.91 110.385 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.519 HD11 HG23 ' A' ' 125' ' ' ILE . 48.6 mm -114.84 140.17 37.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 121.309 0.576 . . . . 18.67 112.092 -179.416 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . 0.449 ' O ' ' N ' ' A' ' 139' ' ' GLU . 1.9 m-20 -115.07 157.84 22.96 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.919 -1.037 . . . . 16.97 108.996 178.594 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 31.2 t80 -40.0 -23.84 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 120.762 0.315 . . . . 15.28 111.605 179.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.449 ' N ' ' O ' ' A' ' 137' ' ' ASN . 19.4 mm-40 -80.53 -55.77 4.63 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-O 120.958 0.408 . . . . 14.82 110.871 -179.586 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.497 ' HB2' HG22 ' A' ' 136' ' ' ILE . 25.8 mt-10 -61.27 -33.42 73.52 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.958 -0.565 . . . . 17.46 110.693 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.56 ' HA ' ' HE3' ' A' ' 144' ' ' MET . 76.9 t80 -66.91 -56.06 11.93 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.914 -0.585 . . . . 13.65 110.194 179.796 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . 0.464 HG12 ' SD ' ' A' ' 85' ' ' MET . 2.5 t -45.75 -44.86 4.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.554 -0.748 . . . . 11.12 112.138 179.83 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 79.8 t90 -65.13 -55.58 17.89 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.439 0.533 . . . . 14.4 112.439 -178.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' MET . . . . . 0.56 ' HE3' ' HA ' ' A' ' 141' ' ' PHE . 17.3 ptt? -60.28 -36.71 78.48 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 112.099 0.407 . . . . 14.63 112.099 -178.185 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . 0.438 HG23 ' CZ ' ' A' ' 141' ' ' PHE . 2.8 pt -80.73 -15.39 12.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 C-N-CA 120.803 -0.359 . . . . 11.62 111.327 179.817 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 45.0 t -69.42 -38.9 78.09 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.385 -0.598 . . . . 8.66 109.385 179.589 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 10.0 mm-40 -87.03 -21.07 26.33 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.313 -0.858 . . . . 11.87 109.945 178.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 24.5 ttpp . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.258 -0.877 . . . . 13.97 111.11 179.7 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 149' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 151' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 55.8 m . . . . . 0 N--CA 1.485 1.286 0 CA-C-O 120.793 0.33 . . . . 5.2 110.997 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -168.69 69.79 0.08 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.179 -0.464 . . . . 3.26 110.92 -179.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.501 HD11 ' SG ' ' A' ' 69' ' ' CYS . 78.7 mt 47.05 81.17 0.04 OUTLIER 'General case' 0 C--O 1.232 0.178 0 CA-C-N 115.981 -0.554 . . . . 2.0 111.165 -179.865 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 50.5 p -73.19 -176.37 2.15 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.434 -0.348 . . . . 1.72 111.525 -179.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.4 ' HG2' ' N ' ' A' ' 7' ' ' GLU . 0.1 OUTLIER -64.7 -38.08 89.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.475 -0.329 . . . . 2.2 111.518 -179.586 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.4 ' N ' ' HG2' ' A' ' 6' ' ' GLU . 11.9 pt-20 -75.06 -44.26 48.67 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.963 0.411 . . . . 1.35 111.009 -179.549 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 27.6 mt-30 -61.92 -46.2 90.4 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.892 -0.595 . . . . 2.34 110.885 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.528 ' HA ' ' CZ ' ' A' ' 12' ' ' PHE . 62.9 mt -58.56 -52.64 57.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.135 -0.484 . . . . 1.27 111.006 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.85 -20.8 65.44 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.417 -0.356 . . . . 1.22 111.584 -179.722 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -70.82 -56.82 5.47 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 111.78 0.289 . . . . 2.27 111.78 -179.273 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.528 ' CZ ' ' HA ' ' A' ' 9' ' ' ILE . 19.3 p90 -79.57 -26.9 41.22 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 120.591 -0.444 . . . . 0.46 110.922 -179.692 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.418 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 45.8 tptt -65.51 -34.2 77.72 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 109.387 -0.598 . . . . 1.85 109.387 178.889 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.462 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 14.4 t70 -69.98 -50.09 45.13 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 108.998 -0.742 . . . . 0.44 108.998 178.187 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.89 -14.8 50.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.663 -0.699 . . . . 1.08 110.277 178.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.418 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 44.9 t80 -80.32 -45.47 17.78 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.636 -0.711 . . . . 0.56 110.733 -179.616 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.446 HG21 ' O ' ' A' ' 14' ' ' ASP . 24.6 m -69.62 -20.46 23.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 121.003 0.43 . . . . 1.69 110.288 179.749 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.462 ' HG3' ' O ' ' A' ' 14' ' ' ASP . 78.3 mt-30 -60.38 -29.43 68.94 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.784 -0.643 . . . . 2.23 111.175 179.471 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 56.8 m-85 -104.34 13.64 31.69 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.558 -0.292 . . . . 0.69 111.7 -179.409 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -114.12 81.96 1.62 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.981 0.419 . . . . 0.46 110.921 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 43.8 mmtm -85.42 -34.59 21.67 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.969 -0.56 . . . . 2.55 111.291 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -62.26 -28.53 69.77 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.127 -0.488 . . . . 1.8 111.296 -179.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 89.69 7.25 69.1 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.697 -0.763 . . . . 0.54 112.72 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 21.9 p -76.76 7.87 4.25 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.583 0.23 . . . . 1.1 111.231 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 55.88 27.23 49.9 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.609 -0.805 . . . . 0.37 111.745 -179.436 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.658 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 37.8 mtpt -136.68 155.56 49.71 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.858 0.361 . . . . 1.75 111.095 -179.402 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 46.5 pt -125.51 143.51 38.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.11 -0.496 . . . . 1.2 111.252 -179.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -56.92 124.98 20.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.365 -0.38 . . . . 1.04 111.04 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.1 t -62.03 -13.36 25.31 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.116 -0.493 . . . . 1.71 111.268 -179.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 68.1 mtp180 -79.75 -29.07 40.41 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.125 -0.488 . . . . 3.53 110.565 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -93.54 3.89 54.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.959 -0.564 . . . . 2.26 110.341 179.678 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.415 ' O ' ' HG3' ' A' ' 36' ' ' MET . 0.8 OUTLIER -56.91 -55.29 36.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.794 -0.639 . . . . 1.95 110.636 -179.932 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.443 ' HA3' HD21 ' A' ' 48' ' ' LEU . . . -53.91 -42.63 70.39 Favored Glycine 0 C--N 1.331 0.282 0 C-N-CA 120.556 -0.831 . . . . 0.32 111.892 179.551 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 57.8 m -62.69 -36.35 82.64 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.094 0.473 . . . . 1.01 110.573 179.278 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 62.9 tp -65.28 -31.65 72.91 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.799 -0.637 . . . . 1.85 110.822 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.415 ' HG3' ' O ' ' A' ' 32' ' ' LEU . 19.3 mtp -80.48 -28.59 37.51 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.129 -0.487 . . . . 1.43 110.851 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 24.9 mtp180 -65.23 -44.12 89.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.49 -0.323 . . . . 3.27 110.731 179.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.3 t -65.59 -13.67 59.53 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.956 0.408 . . . . 1.54 110.991 179.579 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 8.8 mp -113.86 156.87 23.16 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.996 -0.547 . . . . 1.94 110.65 179.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -46.51 -27.95 3.22 Favored Glycine 0 CA--C 1.52 0.372 0 C-N-CA 120.886 -0.673 . . . . 0.69 113.161 -179.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -60.66 154.64 20.87 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.712 0.292 . . . . 1.97 111.157 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 48.5 t-20 -172.13 82.61 0.46 Allowed Pre-proline 0 C--N 1.33 -0.242 0 CA-C-N 116.222 -0.444 . . . . 3.44 110.747 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.405 ' HB3' ' NE2' ' A' ' 75' ' ' GLN . 56.1 Cg_endo -70.27 159.26 53.63 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.512 2.141 . . . . 0.59 112.367 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 37.7 m -65.17 146.83 54.46 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.107 -0.497 . . . . 1.28 110.584 179.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.489 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 16.8 mm-40 -48.38 -55.68 10.14 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.843 -0.162 . . . . 2.7 111.377 -179.47 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -49.15 -42.66 40.32 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.784 0.326 . . . . 1.15 111.248 -179.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.508 ' HG3' HD23 ' A' ' 51' ' ' LEU . 7.9 tp10 -64.52 -50.76 66.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.16 -0.473 . . . . 2.23 110.288 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.446 ' HA ' HD21 ' A' ' 51' ' ' LEU . 33.0 tp -57.32 -33.83 68.11 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.957 -0.565 . . . . 2.01 110.9 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.489 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 77.4 mm-40 -73.55 -34.67 65.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.314 -0.403 . . . . 1.68 110.511 179.71 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 56.4 m-20 -72.26 -55.27 7.46 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.099 -0.501 . . . . 0.62 111.649 -179.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.508 HD23 ' HG3' ' A' ' 47' ' ' GLU . 1.9 pp -61.2 -34.64 75.41 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 111.823 0.305 . . . . 1.11 111.823 -179.207 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 49.4 mt -72.01 -53.62 19.45 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 120.692 0.282 . . . . 1.25 110.857 179.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.85 -26.23 65.66 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.341 -0.39 . . . . 1.24 111.036 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -77.33 -51.86 10.14 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.191 -0.459 . . . . 2.54 110.697 179.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -69.53 -16.6 63.46 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.197 -0.456 . . . . 1.19 111.294 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -80.08 -36.66 35.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.361 -0.382 . . . . 1.95 110.964 -179.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 18.9 m120 -98.5 36.57 1.61 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.201 -0.454 . . . . 3.19 110.991 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -159.54 -27.39 0.07 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.172 -0.467 . . . . 2.69 110.937 179.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 10.4 m120 -120.19 20.44 12.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.273 -0.421 . . . . 2.05 110.825 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 24.5 m-80 64.13 -81.34 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 115.901 -0.591 . . . . 1.67 111.453 179.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -154.84 5.21 0.26 Allowed Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.547 -0.835 . . . . 0.86 113.001 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.658 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -117.23 153.91 32.08 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.984 0.421 . . . . 0.49 111.619 -179.945 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.516 ' HG ' ' HB2' ' A' ' 67' ' ' GLU . 1.7 tp -128.62 153.62 47.07 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.699 -0.682 . . . . 2.05 110.201 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 10.9 m-80 -110.61 157.0 20.16 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-O 121.343 0.592 . . . . 1.52 111.472 -179.363 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.415 ' O ' ' HB2' ' A' ' 69' ' ' CYS . 88.1 t80 -46.39 -38.91 9.58 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.91 -1.041 . . . . 0.46 111.736 -179.439 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -67.49 -37.54 83.01 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.606 0.595 . . . . 1.41 112.606 -179.087 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.516 ' HB2' ' HG ' ' A' ' 63' ' ' LEU . 7.7 mt-10 -63.92 -52.91 57.65 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.126 0.489 . . . . 1.36 109.842 179.611 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.436 ' O ' ' HG3' ' A' ' 72' ' ' MET . 28.2 t80 -59.53 -54.39 47.14 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.551 -0.75 . . . . 0.61 110.608 179.175 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.501 ' SG ' HD11 ' A' ' 4' ' ' LEU . 0.5 OUTLIER -53.78 -46.63 71.08 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.2 -0.455 . . . . 1.41 110.729 -179.986 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -48.28 -54.27 13.19 Favored Glycine 0 C--N 1.331 0.291 0 CA-C-N 115.857 -0.61 . . . . 0.41 112.564 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.444 ' HA ' ' HG2' ' A' ' 74' ' ' LYS . 11.5 mt -61.79 -43.09 96.77 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.297 0 CA-C-O 120.861 0.363 . . . . 1.13 110.751 179.755 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' MET . . . . . 0.436 ' HG3' ' O ' ' A' ' 68' ' ' PHE . 61.8 mtp -54.9 -28.93 54.39 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.965 -0.561 . . . . 1.24 110.05 179.582 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.89 -50.3 36.49 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.964 -0.562 . . . . 1.17 110.754 179.63 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.444 ' HG2' ' HA ' ' A' ' 71' ' ' ILE . 63.8 pttt -68.84 -28.49 66.77 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.357 -0.383 . . . . 1.91 111.655 -179.616 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . 0.405 ' NE2' ' HB3' ' A' ' 43' ' ' PRO . 7.5 tt0 -81.0 -55.05 5.04 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.123 0.416 . . . . 2.03 112.123 -179.319 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 71.3 mtp -59.49 -37.01 77.16 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 112.282 0.475 . . . . 1.52 112.282 -178.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . 0.475 ' NE ' ' HA ' ' A' ' 77' ' ' ARG . 16.0 mmp_? -71.34 -41.05 70.28 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.523 0.201 . . . . 5.25 111.263 -179.627 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 62.76 -84.89 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.231 -0.441 . . . . 4.01 111.136 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 46.0 m -103.45 101.33 11.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.378 -0.374 . . . . 5.71 110.735 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . 0.419 ' O ' ' N ' ' A' ' 82' ' ' GLU . 0.1 OUTLIER -106.61 -34.13 7.44 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.381 -0.372 . . . . 5.6 111.612 -179.533 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.579 ' O ' ' HG3' ' A' ' 85' ' ' MET . 65.7 m -47.23 90.15 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.035 -0.53 . . . . 7.48 111.707 -179.36 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.424 ' HB3' ' OH ' ' A' ' 138' ' ' TYR . 44.9 mt-10 -55.55 -16.34 3.83 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 112.873 0.694 . . . . 9.74 112.873 -178.772 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -61.38 -55.99 25.38 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.863 0.364 . . . . 12.11 111.693 -179.329 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -71.59 -21.76 61.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.338 -0.392 . . . . 10.87 111.148 -179.522 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' MET . . . . . 0.579 ' HG3' ' O ' ' A' ' 81' ' ' THR . 10.8 mtp -74.38 -39.58 62.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.353 -0.385 . . . . 11.09 110.908 -179.473 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 61.4 ttt180 -69.76 -41.41 75.24 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.064 -0.517 . . . . 16.05 110.327 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -59.35 -40.93 87.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.219 0.533 . . . . 14.85 109.596 178.857 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -69.62 -29.51 67.02 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.652 -0.704 . . . . 14.11 110.425 179.277 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 64.0 t80 -66.91 -41.18 87.51 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.053 -0.521 . . . . 16.42 110.483 179.466 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 49.0 mttm -64.07 -42.93 96.82 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.882 -0.599 . . . . 17.66 110.789 179.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 84.0 mt -64.8 -46.95 90.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.892 -0.595 . . . . 18.15 111.066 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -60.02 -48.03 83.41 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.256 -0.429 . . . . 18.34 110.867 179.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 42.9 t0 -64.68 109.49 2.04 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.074 -0.512 . . . . 19.29 110.608 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.459 ' HG2' ' HB3' ' A' ' 104' ' ' GLU . 19.1 mmm180 -64.84 -42.2 95.1 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.114 -0.494 . . . . 22.47 111.141 -179.441 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -94.39 178.46 5.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.277 -0.42 . . . . 23.34 110.969 -179.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.14 5.24 57.57 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.962 -0.637 . . . . 22.77 112.033 179.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 18.5 p-10 -63.54 -31.66 72.89 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.783 0.325 . . . . 23.0 111.079 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 93.41 27.28 13.5 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.784 -0.722 . . . . 20.02 112.606 179.704 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 67.9 m-85 -138.88 143.52 38.78 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.594 0.235 . . . . 20.56 110.879 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.471 ' HB ' ' HB ' ' A' ' 136' ' ' ILE . 56.1 mt -114.33 128.74 71.22 Favored 'Isoleucine or valine' 0 C--O 1.232 0.144 0 CA-C-O 120.94 0.4 . . . . 19.37 111.061 179.638 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 49.5 m -114.84 156.65 44.74 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 115.818 -0.628 . . . . 22.65 110.506 -179.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . 0.413 ' HG3' HD12 ' A' ' 125' ' ' ILE . 83.2 Cg_exo -44.29 -35.11 7.84 Favored 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 122.174 1.916 . . . . 23.78 112.012 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.456 ' O ' ' HG3' ' A' ' 106' ' ' ARG . . . -65.35 -49.59 68.78 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.099 -0.501 . . . . 25.0 110.509 179.377 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . 0.459 ' HB3' ' HG2' ' A' ' 94' ' ' ARG . 45.5 mt-10 -69.71 -20.37 63.54 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.862 -0.608 . . . . 22.31 110.641 179.506 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.534 HD23 ' HB ' ' A' ' 121' ' ' ILE . 42.1 tp -80.29 -39.55 28.59 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.061 -0.518 . . . . 20.62 111.51 -179.346 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.456 ' HG3' ' O ' ' A' ' 103' ' ' ALA . 3.3 ppt_? -72.03 -32.16 66.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.186 0.517 . . . . 27.9 110.39 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 81.0 t80 -73.49 -43.33 60.38 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.581 -0.736 . . . . 25.96 111.482 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 7.5 p -66.86 -48.17 80.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 N-CA-C 111.879 0.325 . . . . 21.06 111.879 -179.184 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.503 ' HE2' ' HZ1' ' A' ' 148' ' ' LYS . 22.7 mmt -50.84 -41.89 58.1 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 111.625 0.232 . . . . 20.93 111.625 -179.174 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 79.7 mt -61.78 -30.44 48.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 120.951 0.405 . . . . 25.52 110.528 179.401 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -70.77 -35.85 72.79 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.007 -0.542 . . . . 23.32 110.427 179.619 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.413 HD11 ' N ' ' A' ' 112' ' ' LEU . 9.0 mp -72.84 -42.14 64.08 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.946 -0.57 . . . . 21.07 110.634 179.783 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 115.53 41.11 0.82 Allowed Glycine 0 N--CA 1.452 -0.272 0 CA-C-N 115.875 -0.602 . . . . 23.25 112.392 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -110.03 -31.75 7.26 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 111.577 0.214 . . . . 22.59 111.577 -179.558 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 36.6 mtmm 52.7 90.0 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.966 0.413 . . . . 28.21 110.606 -179.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 2.4 m -123.38 155.78 29.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.906 -0.588 . . . . 24.75 112.12 -178.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 70.5 p -92.23 145.06 24.79 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.57 -0.741 . . . . 27.5 110.216 179.187 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . 0.46 ' HA ' HD13 ' A' ' 121' ' ' ILE . 8.8 m-20 -51.62 -18.38 1.14 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.041 -0.527 . . . . 27.03 111.98 -179.361 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -77.51 -55.62 5.22 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.078 0.399 . . . . 29.14 112.078 -179.008 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -61.87 -40.57 95.83 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 111.967 0.358 . . . . 24.7 111.967 -179.044 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.534 ' HB ' HD23 ' A' ' 105' ' ' LEU . 5.1 pt -69.63 -40.15 79.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 C-N-CA 120.897 -0.321 . . . . 22.9 111.522 -179.568 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.419 ' N ' HG13 ' A' ' 121' ' ' ILE . 15.4 t70 -56.49 -41.52 76.78 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.858 0.361 . . . . 24.29 110.42 179.552 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -62.83 -45.37 92.91 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.059 -0.519 . . . . 24.74 110.475 179.52 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 59.9 ttp -56.98 -38.2 72.69 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.034 -0.53 . . . . 20.15 110.868 179.49 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.54 HG21 HD11 ' A' ' 136' ' ' ILE . 58.6 mt -64.43 -38.39 82.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.147 -0.479 . . . . 20.23 110.525 179.691 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 6.7 ttp85 -62.21 -42.7 99.53 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.957 -0.565 . . . . 25.57 110.632 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -65.6 -26.46 67.85 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.876 -0.602 . . . . 19.18 110.962 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.543 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -95.65 -13.07 24.6 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.104 -0.498 . . . . 16.88 111.21 179.912 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -100.16 105.79 17.43 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.094 -0.503 . . . . 20.4 110.837 -179.77 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 91.2 m-85 -97.4 -30.91 12.65 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.878 -0.601 . . . . 21.43 111.387 -179.498 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -69.72 -15.04 63.08 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.301 -0.409 . . . . 23.37 110.715 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 60.5 87.4 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.977 -0.63 . . . . 24.32 113.059 179.581 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -155.7 -23.84 0.11 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.755 0.312 . . . . 24.4 111.099 179.511 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 93.87 23.51 22.85 Favored Glycine 0 C--N 1.331 0.293 0 C-N-CA 120.817 -0.706 . . . . 23.47 112.617 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 82.1 mmm -135.8 155.22 50.68 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 110.423 -0.214 . . . . 22.91 110.423 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.54 HD11 HG21 ' A' ' 125' ' ' ILE . 46.9 mm -114.57 139.53 40.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 121.306 0.574 . . . . 18.67 111.599 179.759 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . 0.451 ' O ' ' N ' ' A' ' 139' ' ' GLU . 16.2 m-20 -115.09 157.4 23.61 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.095 -0.957 . . . . 16.97 108.887 178.662 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.424 ' OH ' ' HB3' ' A' ' 82' ' ' GLU . 19.5 t80 -41.13 -22.86 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 120.893 0.378 . . . . 15.28 111.024 179.483 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.451 ' N ' ' O ' ' A' ' 137' ' ' ASN . 9.6 mm-40 -81.16 -55.25 4.87 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.24 -0.436 . . . . 14.82 111.019 -179.662 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.503 ' HB2' HG22 ' A' ' 136' ' ' ILE . 31.9 mt-10 -60.11 -34.1 73.04 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.195 -0.457 . . . . 17.46 110.74 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.558 ' HA ' ' HE1' ' A' ' 144' ' ' MET . 82.2 t80 -68.29 -55.28 12.68 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.034 -0.53 . . . . 13.65 110.326 179.503 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . 0.52 ' HA ' HD11 ' A' ' 145' ' ' ILE . 2.3 t -47.04 -39.67 4.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.485 -0.78 . . . . 11.12 111.684 179.427 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' TRP . . . . . 0.435 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 84.8 t90 -71.06 -55.43 8.26 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.182 0.438 . . . . 14.4 112.182 -178.856 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' MET . . . . . 0.558 ' HE1' ' HA ' ' A' ' 141' ' ' PHE . 17.3 ptt? -61.3 -23.79 65.95 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 113.156 0.799 . . . . 14.63 113.156 -177.801 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . 0.55 HG13 ' N ' ' A' ' 146' ' ' SER . 48.5 pt -80.7 -46.15 21.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 N-CA-C 112.488 0.551 . . . . 11.62 112.488 -179.287 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' SER . . . . . 0.55 ' N ' HG13 ' A' ' 145' ' ' ILE . 12.6 p -63.29 -13.94 44.09 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-O 121.201 0.524 . . . . 8.66 110.469 -179.839 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 147' ' ' GLN . . . . . 0.435 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 17.0 mm-40 -117.57 13.77 14.39 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.35 -0.841 . . . . 11.87 111.326 -178.563 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . 0.532 ' HG3' ' O ' ' A' ' 144' ' ' MET . 35.5 mttm . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.19 -0.91 . . . . 13.97 110.84 179.548 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 149' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 151' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 40.2 t . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 120.846 0.355 . . . . 5.2 110.833 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -146.46 133.86 20.75 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.137 -0.483 . . . . 3.26 110.622 179.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.456 HD12 ' SG ' ' A' ' 69' ' ' CYS . 49.3 mt -67.12 89.84 0.19 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.955 0.407 . . . . 2.0 110.71 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.41 169.32 17.41 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.875 -0.602 . . . . 1.72 111.073 -179.833 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -52.05 -46.64 65.18 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.407 -0.36 . . . . 2.2 111.501 179.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -70.82 -46.13 63.33 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.216 -0.447 . . . . 1.35 111.08 -179.27 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -58.16 -42.99 87.14 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.975 -0.557 . . . . 2.34 110.872 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.492 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 72.5 mt -59.47 -51.04 77.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.302 -0.408 . . . . 1.27 110.376 179.596 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.08 -22.54 66.97 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.024 -0.535 . . . . 1.22 111.315 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -70.05 -56.87 5.81 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 116.34 -0.391 . . . . 2.27 111.835 -179.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.497 ' HB2' ' HE2' ' A' ' 68' ' ' PHE . 13.3 p90 -78.91 -24.85 43.85 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.733 -0.387 . . . . 0.46 110.692 -179.684 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.401 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 24.0 tptp -64.01 -35.58 81.17 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 108.923 -0.769 . . . . 1.85 108.923 178.382 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.427 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 20.4 t70 -70.14 -49.78 47.18 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 115.621 -0.718 . . . . 0.44 109.302 178.37 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.43 -14.62 42.81 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.769 -0.65 . . . . 1.08 110.506 178.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.401 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 36.3 t80 -79.93 -50.58 10.24 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.742 -0.663 . . . . 0.56 110.686 -179.708 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 31.2 m -65.93 -19.31 25.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 121.01 0.433 . . . . 1.69 110.336 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.427 ' HG2' ' O ' ' A' ' 14' ' ' ASP . 75.3 mm-40 -58.64 -37.18 75.39 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.656 -0.702 . . . . 2.23 111.331 179.294 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 62.0 m-85 -91.26 9.87 29.57 Favored 'General case' 0 N--CA 1.464 0.248 0 N-CA-C 111.767 0.284 . . . . 0.69 111.767 -179.684 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -106.85 83.94 1.92 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.886 0.374 . . . . 0.46 110.808 179.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 29.9 mmmt -92.77 -10.61 36.34 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.061 -0.518 . . . . 2.55 111.242 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -84.95 -14.32 47.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.147 -0.479 . . . . 1.8 111.281 -179.488 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.14 6.73 88.79 Favored Glycine 0 N--CA 1.453 -0.21 0 C-N-CA 120.688 -0.768 . . . . 0.54 112.605 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 40.2 p -82.4 8.09 12.39 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.688 0.28 . . . . 1.1 111.071 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 56.94 18.01 24.49 Favored Glycine 0 C--N 1.332 0.34 0 C-N-CA 120.824 -0.703 . . . . 0.37 112.165 -179.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.441 ' C ' HE22 ' A' ' 62' ' ' GLN . 32.6 mtpt -129.31 155.69 45.21 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.773 0.32 . . . . 1.75 111.161 -179.406 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.412 ' N ' HE22 ' A' ' 62' ' ' GLN . 39.8 pt -118.19 133.02 66.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 120.895 0.379 . . . . 1.2 111.455 -179.791 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -52.52 138.77 27.03 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.079 -0.509 . . . . 1.04 111.247 -179.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 8.9 t -71.27 -2.51 16.41 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.194 -0.457 . . . . 1.71 111.323 -179.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.433 ' HD2' ' N ' ' A' ' 30' ' ' ARG . 0.9 OUTLIER -98.48 2.49 47.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.029 0.443 . . . . 3.53 110.25 179.592 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -124.43 -5.41 7.7 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.782 -0.645 . . . . 2.26 110.886 -179.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.463 ' O ' ' HG2' ' A' ' 36' ' ' MET . 2.1 tm? -55.57 -51.28 67.64 Favored 'General case' 0 C--O 1.233 0.198 0 N-CA-C 109.954 -0.387 . . . . 1.95 109.954 179.694 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -53.71 -37.31 56.72 Favored Glycine 0 C--N 1.333 0.366 0 C-N-CA 120.629 -0.796 . . . . 0.32 111.4 179.122 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 59.7 m -67.49 -31.48 71.65 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.279 0.561 . . . . 1.01 110.112 178.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 56.3 tp -72.83 -19.72 61.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.544 -0.753 . . . . 1.85 110.369 179.554 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.463 ' HG2' ' O ' ' A' ' 32' ' ' LEU . 75.8 mmm -80.02 -47.11 15.43 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.062 -0.517 . . . . 1.43 110.786 179.593 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 13.4 ptm180 -61.85 -39.87 93.38 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.365 -0.38 . . . . 3.27 111.399 -179.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.476 HG21 HD11 ' A' ' 39' ' ' LEU . 5.3 t -62.84 -14.42 45.64 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 121.179 0.514 . . . . 1.54 110.413 179.491 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.476 HD11 HG21 ' A' ' 38' ' ' THR . 6.8 mp -114.46 157.21 23.23 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.464 -0.789 . . . . 1.94 109.31 178.385 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -74.02 34.54 0.91 Allowed Glycine 0 CA--C 1.521 0.43 0 C-N-CA 120.612 -0.804 . . . . 0.69 113.298 -179.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.462 ' OE1' ' HB3' ' A' ' 39' ' ' LEU . 3.5 mm100 -91.65 -68.12 0.81 Allowed 'General case' 0 C--O 1.232 0.14 0 CA-C-O 120.829 0.347 . . . . 1.97 110.547 179.517 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 31.0 m-80 54.42 78.32 0.39 Allowed Pre-proline 0 CA--C 1.53 0.183 0 CA-C-N 115.961 -0.563 . . . . 3.44 111.16 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -75.04 175.51 11.15 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.456 2.104 . . . . 0.59 112.319 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 34.4 m -74.16 149.01 41.19 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.173 -0.467 . . . . 1.28 110.734 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.466 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 38.1 mt-10 -53.6 -55.84 22.31 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.546 -0.297 . . . . 2.7 111.484 -179.664 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.85 -47.08 71.32 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.339 -0.391 . . . . 1.15 111.698 -179.405 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -57.9 -49.95 74.99 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.926 0.393 . . . . 2.23 110.582 -179.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 21.4 tp -57.48 -37.13 72.42 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.832 -0.622 . . . . 2.01 111.068 -179.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.466 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 78.4 mm-40 -75.2 -28.01 59.82 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.42 -0.355 . . . . 1.68 111.264 -179.818 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 45.7 m-20 -75.35 -46.05 35.6 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.402 -0.363 . . . . 0.62 111.681 -179.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.9 pp -71.92 -40.12 69.01 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.552 -0.295 . . . . 1.11 111.66 -179.314 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 71.8 mt -64.97 -45.02 95.94 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-O 120.746 0.308 . . . . 1.25 110.736 179.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -69.08 -35.12 76.15 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.308 -0.405 . . . . 1.24 110.667 179.767 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -64.93 -46.63 80.83 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.18 -0.464 . . . . 2.54 109.87 179.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -70.92 -21.5 62.35 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.844 -0.616 . . . . 1.19 110.909 179.295 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -65.65 -54.39 28.17 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.344 -0.389 . . . . 1.95 110.865 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 87.1 m-20 -93.81 52.76 1.71 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.279 -0.419 . . . . 3.19 110.932 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.419 ' C ' HD21 ' A' ' 58' ' ' ASN . 0.2 OUTLIER -162.33 -63.24 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.188 -0.46 . . . . 2.69 110.628 179.987 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 29.4 m-80 -93.0 27.1 2.54 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.204 -0.453 . . . . 2.05 110.869 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 10.9 m120 65.21 -78.98 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 115.998 -0.546 . . . . 1.67 111.172 179.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -163.79 22.06 0.16 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.901 -0.666 . . . . 0.86 112.297 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.441 HE22 ' C ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -131.92 153.1 50.61 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.976 0.417 . . . . 0.49 111.38 -179.782 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 33.6 mt -120.63 151.9 38.86 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.768 -0.651 . . . . 2.05 110.276 179.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 19.9 m-80 -113.18 157.69 21.37 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.765 0.317 . . . . 1.52 110.879 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -42.61 -39.75 2.46 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.751 -0.659 . . . . 0.46 111.415 -179.499 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -68.98 -35.63 76.94 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.105 0.409 . . . . 1.41 112.105 -179.575 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -61.1 -52.87 63.08 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.01 0.433 . . . . 1.36 110.457 179.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.497 ' HE2' ' HB2' ' A' ' 12' ' ' PHE . 36.6 t80 -65.63 -46.24 80.01 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.698 -0.683 . . . . 0.61 111.02 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.456 ' SG ' HD12 ' A' ' 4' ' ' LEU . 2.7 t -58.38 -46.99 85.28 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.233 -0.44 . . . . 1.41 110.723 -179.932 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -53.32 -50.27 53.12 Favored Glycine 0 N--CA 1.451 -0.347 0 CA-C-N 115.837 -0.619 . . . . 0.41 112.136 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.528 HG23 ' HE2' ' A' ' 74' ' ' LYS . 12.6 mt -62.57 -38.04 80.46 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.386 0 CA-C-O 120.924 0.392 . . . . 1.13 110.787 179.695 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -58.6 -28.57 65.71 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.899 -0.591 . . . . 1.24 110.26 179.421 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -73.09 -49.45 28.4 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.06 -0.518 . . . . 1.17 110.778 179.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.528 ' HE2' HG23 ' A' ' 71' ' ' ILE . 61.9 pttt -69.56 -26.7 64.62 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.245 -0.434 . . . . 1.91 110.838 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 58.2 tt0 -78.69 -50.06 12.07 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.074 -0.512 . . . . 2.03 110.99 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 34.8 mtt -55.53 -36.65 66.98 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 116.175 -0.466 . . . . 1.52 110.908 179.779 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 13.9 tpt180 -61.36 -27.58 68.62 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.782 -0.645 . . . . 5.25 110.827 179.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -77.69 -45.58 24.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.029 -0.532 . . . . 4.01 110.817 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 72.6 p -88.0 70.38 9.41 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.049 -0.523 . . . . 5.71 111.646 -179.362 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . 0.504 ' O ' ' HE3' ' A' ' 85' ' ' MET . 0.1 OUTLIER -77.36 92.18 3.91 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.029 -0.532 . . . . 5.6 110.315 179.267 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.5 ' O ' ' HG2' ' A' ' 85' ' ' MET . 6.1 t 35.52 58.69 0.84 Allowed 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.079 0.466 . . . . 7.48 111.388 -179.558 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -46.08 -32.38 2.84 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 113.064 0.764 . . . . 9.74 113.064 -178.479 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -53.74 -56.06 20.77 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.002 0.43 . . . . 12.11 111.733 -179.152 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -65.99 -17.51 64.72 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.227 -0.442 . . . . 10.87 110.85 -179.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' MET . . . . . 0.504 ' HE3' ' O ' ' A' ' 80' ' ' ASP . 0.8 OUTLIER -83.0 -25.02 32.63 Favored 'General case' 0 CA--C 1.509 -0.63 0 CA-C-O 121.912 0.863 . . . . 11.09 109.081 -179.089 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.522 ' HB2' ' HH ' ' A' ' 138' ' ' TYR . 31.1 tpt180 -71.04 -45.23 64.22 Favored 'General case' 0 N--CA 1.442 -0.835 0 CA-C-N 113.902 -1.499 . . . . 16.05 110.151 179.693 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -69.26 -37.26 77.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.844 -0.616 . . . . 14.85 110.06 178.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -69.69 -39.58 76.86 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.008 -0.542 . . . . 14.11 111.046 179.635 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -64.25 -34.84 79.04 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.995 0.426 . . . . 16.42 110.276 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 59.8 mttt -62.45 -55.23 29.65 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.726 -0.67 . . . . 17.66 110.882 179.493 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 55.1 mt -64.15 -29.68 48.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.655 -0.702 . . . . 18.15 111.652 -179.409 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -79.6 -29.97 41.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.584 -0.28 . . . . 18.34 111.657 -179.403 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 24.1 t0 -83.84 101.83 11.91 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.009 0.433 . . . . 19.29 110.617 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.86 -14.17 58.65 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.874 -0.603 . . . . 22.47 111.719 -179.567 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . 0.448 ' HB2' ' OD1' ' A' ' 97' ' ' ASP . 4.7 m-20 -125.66 160.07 30.62 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.932 0.396 . . . . 23.34 111.148 -179.876 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -87.68 5.34 85.11 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.899 -0.667 . . . . 22.77 112.051 179.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.448 ' OD1' ' HB2' ' A' ' 95' ' ' ASP . 10.4 p-10 -61.54 -33.12 73.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.784 0.326 . . . . 23.0 110.962 -179.844 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 99.84 17.85 24.43 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.758 -0.734 . . . . 20.02 112.845 179.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . 0.423 ' HB2' ' OD2' ' A' ' 97' ' ' ASP . 98.0 m-85 -141.09 147.1 38.01 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.815 0.34 . . . . 20.56 111.313 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 71.3 mt -114.96 136.2 52.41 Favored 'Isoleucine or valine' 0 C--O 1.232 0.157 0 CA-C-N 116.141 -0.482 . . . . 19.37 110.828 179.368 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 70.8 m -114.64 156.13 45.18 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 116.076 -0.511 . . . . 22.65 110.647 -179.819 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -40.1 -36.14 1.39 Allowed 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 122.458 2.105 . . . . 23.78 112.524 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.83 -51.66 60.89 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.105 -0.498 . . . . 25.0 110.839 179.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -63.42 -45.03 92.87 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.808 -0.633 . . . . 22.31 110.739 179.768 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.588 HD21 ' HB ' ' A' ' 121' ' ' ILE . 21.7 tp -52.27 -42.71 63.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.862 -0.608 . . . . 20.62 110.999 -179.665 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.53 HH21 ' HA ' ' A' ' 117' ' ' THR . 4.4 ttm180 -72.13 -45.24 61.33 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.896 -0.593 . . . . 27.9 111.14 -179.907 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -53.14 -34.2 55.76 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.272 -0.422 . . . . 25.96 111.42 -179.468 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.453 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 43.3 t -80.17 -51.15 16.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.636 -0.256 . . . . 21.06 111.292 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 18.1 mmt -49.61 -46.18 49.01 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.372 -0.376 . . . . 20.93 111.406 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 68.4 mt -62.31 -30.16 48.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.92 0.39 . . . . 25.52 110.589 179.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 -74.94 -28.02 60.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.029 -0.532 . . . . 23.32 110.913 179.494 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.453 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 27.8 mt -77.16 -41.79 40.31 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.108 -0.496 . . . . 21.07 110.732 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 131.18 -5.2 5.65 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.996 -0.621 . . . . 23.25 111.965 -179.611 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -91.13 97.69 11.3 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.696 0.284 . . . . 22.59 110.875 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -68.71 102.1 1.45 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.291 -0.413 . . . . 28.21 110.82 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . 0.43 ' HB ' HG23 ' A' ' 121' ' ' ILE . 2.3 m -115.86 154.74 17.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.212 -0.449 . . . . 24.75 111.428 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' THR . . . . . 0.53 ' HA ' HH21 ' A' ' 106' ' ' ARG . 81.5 p -98.88 145.77 26.65 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.854 -0.612 . . . . 27.5 110.53 179.487 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -51.88 -20.84 2.49 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.227 -0.442 . . . . 27.03 111.612 -179.549 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -78.26 -53.2 7.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.427 -0.351 . . . . 29.14 111.676 -179.527 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -63.83 -37.91 89.13 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.04 0.385 . . . . 24.7 112.04 -179.115 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.588 ' HB ' HD21 ' A' ' 105' ' ' LEU . 38.7 pt -72.83 -42.19 61.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 C-N-CA 120.83 -0.348 . . . . 22.9 111.702 -179.518 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.457 ' N ' HG13 ' A' ' 121' ' ' ILE . 18.1 t70 -58.74 -44.77 90.59 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.842 0.353 . . . . 24.29 110.671 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -60.08 -44.99 94.38 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.082 -0.508 . . . . 24.74 110.457 179.475 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 43.2 ttp -57.46 -33.66 68.19 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.905 -0.588 . . . . 20.15 110.63 179.386 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 66.5 mt -65.82 -43.96 93.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.048 -0.524 . . . . 20.23 110.554 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 33.8 ttm180 -58.23 -40.66 82.28 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.924 -0.58 . . . . 25.57 111.048 179.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -56.45 -43.65 79.7 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.254 -0.43 . . . . 19.18 111.08 -179.892 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.605 ' HB3' ' HB3' ' A' ' 144' ' ' MET . . . -87.39 -14.25 41.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.148 -0.478 . . . . 16.88 111.28 -179.776 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . 0.421 ' HA ' ' OE1' ' A' ' 140' ' ' GLU . 27.5 t70 -93.61 99.23 11.71 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.015 0.436 . . . . 20.4 110.728 -179.739 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -89.74 -37.1 14.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.8 -0.636 . . . . 21.43 111.278 -179.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -63.7 -18.04 63.59 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.324 -0.398 . . . . 23.37 110.583 -179.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 60.74 83.45 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.977 -0.63 . . . . 24.32 112.831 179.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . 0.418 ' OD2' ' HB2' ' A' ' 135' ' ' MET . 12.6 p-10 -146.44 -5.62 0.56 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.791 0.329 . . . . 24.4 111.086 179.586 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 77.09 11.71 85.31 Favored Glycine 0 C--N 1.331 0.254 0 C-N-CA 120.866 -0.683 . . . . 23.47 112.699 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' MET . . . . . 0.418 ' HB2' ' OD2' ' A' ' 133' ' ' ASP . 88.9 mtp -133.38 154.27 50.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.646 0.26 . . . . 22.91 110.389 179.653 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.539 HG22 ' HB2' ' A' ' 140' ' ' GLU . 40.4 mm -115.3 144.89 21.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 121.254 0.55 . . . . 18.67 112.155 -179.246 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . 0.429 ' O ' ' N ' ' A' ' 139' ' ' GLU . 30.0 p-10 -114.81 157.86 22.68 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.304 -0.862 . . . . 16.97 108.779 178.058 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.522 ' HH ' ' HB2' ' A' ' 86' ' ' ARG . 27.8 t80 -39.27 -25.19 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 112.377 0.51 . . . . 15.28 112.377 -179.152 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.429 ' N ' ' O ' ' A' ' 137' ' ' ASN . 44.9 mt-10 -80.05 -55.92 4.61 Favored 'General case' 0 C--O 1.234 0.275 0 O-C-N 122.226 -0.296 . . . . 14.82 111.401 -179.563 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.539 ' HB2' HG22 ' A' ' 136' ' ' ILE . 30.7 mt-10 -60.82 -27.33 67.97 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.986 0.422 . . . . 17.46 110.36 179.895 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.483 ' HA ' ' HE1' ' A' ' 144' ' ' MET . 91.6 t80 -69.33 -56.01 8.77 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.905 -0.588 . . . . 13.65 109.787 179.333 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . 0.444 HG13 ' HG3' ' A' ' 85' ' ' MET . 38.9 t -45.41 -40.84 2.84 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 CA-C-N 115.55 -0.75 . . . . 11.12 111.643 178.917 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 75.5 t90 -67.68 -55.61 12.58 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.744 0.646 . . . . 14.4 112.744 -178.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' MET . . . . . 0.605 ' HB3' ' HB3' ' A' ' 128' ' ' ALA . 19.9 ptt? -67.07 -20.25 65.79 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 113.257 0.836 . . . . 14.63 113.257 -177.433 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . 0.533 HG13 ' N ' ' A' ' 146' ' ' SER . 43.4 pt -80.52 -46.09 21.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 N-CA-C 112.236 0.458 . . . . 11.62 112.236 -179.121 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 146' ' ' SER . . . . . 0.533 ' N ' HG13 ' A' ' 145' ' ' ILE . 28.8 t -63.58 -13.93 46.55 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.193 0.521 . . . . 8.66 110.356 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -118.35 45.33 2.04 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.385 -0.825 . . . . 11.87 111.651 -178.245 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . 0.648 ' HB2' ' HZ3' ' A' ' 148' ' ' LYS . 10.4 mtmp? . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.242 -0.885 . . . . 13.97 110.919 179.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 149' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 151' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 56.9 m . . . . . 0 N--CA 1.486 1.347 0 CA-C-O 120.8 0.333 . . . . 5.2 110.893 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -135.68 14.94 3.39 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.171 -0.468 . . . . 3.26 111.164 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.9 mt -61.07 94.48 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.118 -0.492 . . . . 2.0 111.007 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 72.3 p -76.68 -177.45 4.27 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.456 -0.338 . . . . 1.72 111.294 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -60.25 -51.26 70.32 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.376 -0.375 . . . . 2.2 111.562 -179.512 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -67.74 -45.63 74.44 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.983 0.42 . . . . 1.35 111.018 -179.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -59.23 -42.41 90.95 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.812 -0.631 . . . . 2.34 111.245 -179.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.523 ' HA ' ' CZ ' ' A' ' 12' ' ' PHE . 55.0 mt -60.62 -49.79 83.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.884 0.373 . . . . 1.27 110.652 179.744 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.2 -19.07 64.73 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.995 -0.548 . . . . 1.22 111.099 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -73.94 -55.83 5.69 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.259 -0.428 . . . . 2.27 111.767 -179.238 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.523 ' CZ ' ' HA ' ' A' ' 9' ' ' ILE . 4.2 p90 -77.53 -24.51 49.95 Favored 'General case' 0 C--N 1.332 -0.196 0 C-N-CA 120.673 -0.411 . . . . 0.46 111.012 -179.582 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 23.9 tptp -66.92 -41.44 87.05 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 109.397 -0.594 . . . . 1.85 109.397 178.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -65.26 -47.67 75.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.898 -0.592 . . . . 0.44 109.477 178.498 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.87 -30.65 70.27 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 115.643 -0.708 . . . . 1.08 110.415 179.127 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 24.9 t80 -66.95 -38.89 86.96 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.572 -0.74 . . . . 0.56 110.623 179.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -70.88 -28.39 33.5 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.774 0 CA-C-N 115.966 -0.561 . . . . 1.69 111.153 -179.724 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -60.54 -27.86 67.98 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.791 -0.641 . . . . 2.23 111.486 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 54.9 m-85 -94.01 -12.63 28.22 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.63 -0.259 . . . . 0.69 111.672 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -84.93 91.25 8.0 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.894 0.378 . . . . 0.46 110.732 179.621 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 71.8 mmtt -100.03 -26.03 14.11 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.965 -0.561 . . . . 2.55 111.243 -179.659 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -70.96 -20.14 62.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.168 -0.469 . . . . 1.8 111.281 -179.549 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 86.45 0.2 86.64 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.786 -0.721 . . . . 0.54 112.707 179.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 22.7 p -79.39 10.74 3.48 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.738 0.304 . . . . 1.1 111.212 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 55.54 30.01 54.97 Favored Glycine 0 C--N 1.331 0.293 0 C-N-CA 120.82 -0.705 . . . . 0.37 112.066 -179.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.45 ' C ' HE22 ' A' ' 62' ' ' GLN . 33.0 mtmm -138.33 155.85 48.18 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.744 0.307 . . . . 1.75 111.238 -179.466 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.539 HG13 ' HB2' ' A' ' 63' ' ' LEU . 33.8 pt -116.12 126.41 73.61 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 116.358 -0.383 . . . . 1.2 111.199 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -50.74 142.02 11.99 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.181 -0.463 . . . . 1.04 111.501 -179.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 9.8 t -67.44 -16.09 64.03 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.886 -0.597 . . . . 1.71 111.745 -179.542 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -89.46 5.08 46.95 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.473 -0.33 . . . . 3.53 110.679 179.728 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -123.18 -4.26 8.45 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.091 -0.504 . . . . 2.26 110.942 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.439 HD11 ' HE3' ' A' ' 36' ' ' MET . 1.6 tm? -58.81 -48.6 80.75 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.35 -0.386 . . . . 1.95 110.373 179.617 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -55.64 -35.77 63.18 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.533 -0.841 . . . . 0.32 111.306 179.341 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 88.5 m -69.74 -39.92 76.5 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.062 0.458 . . . . 1.01 110.21 179.272 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 56.1 tp -65.15 -24.07 67.3 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.731 -0.668 . . . . 1.85 110.322 179.439 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.482 ' HG3' ' HG3' ' A' ' 43' ' ' PRO . 21.5 mmt -75.46 -43.32 50.15 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.94 -0.573 . . . . 1.43 110.13 179.139 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -55.87 -50.14 71.43 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.645 -0.707 . . . . 3.27 111.102 179.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.443 HG21 ' HG ' ' A' ' 39' ' ' LEU . 10.1 t -61.68 -13.49 23.17 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.294 -0.412 . . . . 1.54 111.135 179.84 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.443 ' HG ' HG21 ' A' ' 38' ' ' THR . 75.0 mt -113.57 157.16 22.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.096 -0.502 . . . . 1.94 110.613 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -75.85 40.36 1.4 Allowed Glycine 0 CA--C 1.521 0.426 0 C-N-CA 120.883 -0.675 . . . . 0.69 114.027 -178.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 9.9 mp0 -97.15 -66.72 0.88 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 117.103 0.451 . . . . 1.97 111.109 179.029 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 59.0 m-20 60.82 67.21 1.55 Allowed Pre-proline 0 CA--C 1.53 0.199 0 CA-C-N 116.149 -0.478 . . . . 3.44 111.098 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.514 ' HA ' HE22 ' A' ' 75' ' ' GLN . 60.1 Cg_endo -71.47 160.39 48.65 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.72 2.28 . . . . 0.59 112.124 179.655 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 33.4 m -74.5 146.76 42.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.153 -0.476 . . . . 1.28 110.604 179.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.423 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 41.9 tt0 -46.4 -50.34 16.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.61 -0.268 . . . . 2.7 111.137 -179.522 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -51.32 -53.07 39.66 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.274 -0.421 . . . . 1.15 111.315 -179.748 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.443 ' HG2' HD22 ' A' ' 51' ' ' LEU . 36.8 tt0 -52.08 -49.5 63.43 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.357 -0.383 . . . . 2.23 110.618 179.888 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 51.6 mt -57.87 -40.24 79.73 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.38 -0.373 . . . . 2.01 110.584 179.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.423 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 31.7 mm-40 -65.66 -32.74 74.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.411 -0.359 . . . . 1.68 111.026 179.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -75.13 -54.64 6.79 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.222 -0.444 . . . . 0.62 112.103 -179.349 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.443 HD22 ' HG2' ' A' ' 47' ' ' GLU . 2.2 pp -66.33 -39.71 89.42 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 111.995 0.368 . . . . 1.11 111.995 -178.871 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 86.1 mt -68.48 -43.31 83.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 C-N-CA 121.147 -0.221 . . . . 1.25 111.054 -179.647 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.86 -38.86 89.95 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.809 0.338 . . . . 1.24 110.811 179.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -64.02 -43.54 95.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.13 -0.486 . . . . 2.54 110.309 179.607 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -77.19 -16.36 59.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.983 -0.553 . . . . 1.19 110.996 179.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -65.74 -23.9 66.84 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.148 -0.478 . . . . 1.95 110.799 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -103.92 29.61 5.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.035 -0.53 . . . . 3.19 110.621 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -158.51 150.26 21.23 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.007 -0.542 . . . . 2.69 110.754 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 74.4 m-20 59.76 15.1 4.54 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.042 -0.526 . . . . 2.05 111.021 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 18.3 m-80 60.71 12.9 3.96 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.905 -0.589 . . . . 1.67 111.917 179.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 113.62 30.47 2.6 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.636 -0.792 . . . . 0.86 112.389 179.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.45 HE22 ' C ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -127.32 154.52 44.84 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.095 0.474 . . . . 0.49 111.3 -179.832 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.539 ' HB2' HG13 ' A' ' 27' ' ' ILE . 17.4 mt -121.08 152.42 38.68 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.608 -0.724 . . . . 2.05 109.753 179.366 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -113.07 156.76 22.55 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 110.19 -0.3 . . . . 1.52 110.19 -179.483 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.513 ' O ' ' HB2' ' A' ' 69' ' ' CYS . 82.8 t80 -42.41 -41.56 2.93 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.483 -0.326 . . . . 0.46 110.959 179.889 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 3.8 m -71.45 -33.85 69.73 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.352 -0.386 . . . . 1.41 111.397 -179.766 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -62.51 -51.28 68.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.871 0.367 . . . . 1.36 110.287 179.393 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.423 ' HE2' ' HB2' ' A' ' 12' ' ' PHE . 32.8 t80 -67.65 -47.43 69.56 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.021 -0.536 . . . . 0.61 110.649 179.534 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.513 ' HB2' ' O ' ' A' ' 65' ' ' PHE . 0.1 OUTLIER -57.27 -38.9 74.62 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-O 120.959 0.409 . . . . 1.41 110.059 179.599 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -57.51 -50.95 60.87 Favored Glycine 0 CA--C 1.507 -0.466 0 N-CA-C 111.119 -0.792 . . . . 0.41 111.119 179.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.58 HG23 ' HE2' ' A' ' 74' ' ' LYS . 70.6 mt -59.5 -50.12 81.09 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.656 0 CA-C-O 121.032 0.444 . . . . 1.13 110.365 178.466 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 15.2 mtp -49.68 -28.94 6.58 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.613 -0.721 . . . . 1.24 110.51 179.524 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -71.87 -45.28 61.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.328 -0.396 . . . . 1.17 110.231 179.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.58 ' HE2' HG23 ' A' ' 71' ' ' ILE . 49.0 pttt -70.56 -28.87 65.23 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.125 -0.489 . . . . 1.91 111.041 179.823 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . 0.514 HE22 ' HA ' ' A' ' 43' ' ' PRO . 4.8 tp-100 -80.58 -55.42 4.87 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.001 -0.545 . . . . 2.03 111.623 -179.784 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 68.3 mtp -63.07 -22.96 67.21 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 116.169 -0.469 . . . . 1.52 111.793 -179.275 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 43.3 mtt180 -60.4 -39.09 86.12 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.648 0.261 . . . . 5.25 110.705 179.432 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 58.6 -82.71 0.02 OUTLIER 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.085 -0.507 . . . . 4.01 110.791 -179.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 5.0 m -91.74 -64.49 1.11 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.251 -0.432 . . . . 5.71 110.238 179.347 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . 0.587 ' HB2' ' HE2' ' A' ' 85' ' ' MET . 1.1 p30 177.55 -12.3 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.781 -0.645 . . . . 5.6 111.239 179.683 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.619 ' O ' ' HG2' ' A' ' 85' ' ' MET . 58.8 m 62.67 76.82 0.35 Allowed 'General case' 0 CA--C 1.529 0.137 0 N-CA-C 109.925 -0.398 . . . . 7.48 109.925 -179.104 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -58.12 -16.03 11.72 Favored 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 113.39 0.885 . . . . 9.74 113.39 -178.169 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -64.26 -56.5 14.17 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.001 0.429 . . . . 12.11 111.683 -179.286 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -68.19 -14.08 62.71 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.045 -0.525 . . . . 10.87 110.919 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' MET . . . . . 0.619 ' HG2' ' O ' ' A' ' 81' ' ' THR . 4.5 mmm -80.35 -38.77 29.83 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.119 -0.491 . . . . 11.09 110.42 -179.441 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 10.4 ttm180 -67.73 -42.55 81.72 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.975 -0.557 . . . . 16.05 109.595 179.303 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.481 ' O ' HG12 ' A' ' 91' ' ' ILE . 36.9 tt0 -59.55 -48.77 80.34 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.879 -0.6 . . . . 14.85 109.811 179.011 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.56 -29.87 70.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.938 -0.574 . . . . 14.11 110.778 179.583 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 46.7 t80 -59.28 -52.04 67.37 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 109.846 -0.427 . . . . 16.42 109.846 179.492 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -59.06 -37.77 77.82 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.797 -0.638 . . . . 17.66 110.021 178.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.481 HG12 ' O ' ' A' ' 87' ' ' GLU . 40.0 mm -59.92 -40.98 84.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.431 -0.804 . . . . 18.15 110.83 179.469 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.517 ' O ' ' HD3' ' A' ' 94' ' ' ARG . 7.0 m-85 -74.06 -56.64 4.68 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.311 -0.404 . . . . 18.34 111.332 -179.636 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.481 ' HA ' ' CZ ' ' A' ' 94' ' ' ARG . 43.2 t0 -49.96 124.97 10.97 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 120.947 0.403 . . . . 19.29 110.566 -179.739 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.65 ' CZ ' ' HB3' ' A' ' 104' ' ' GLU . 0.0 OUTLIER -76.78 -31.97 57.38 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.904 -0.589 . . . . 22.47 111.662 -178.694 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -113.76 177.97 4.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.978 0.418 . . . . 23.34 111.368 -179.036 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -88.38 3.9 85.32 Favored Glycine 0 N--CA 1.449 -0.472 0 N-CA-C 110.919 -0.872 . . . . 22.77 110.919 178.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 22.3 p-10 -56.02 -39.18 71.55 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.227 -0.487 . . . . 23.0 111.167 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 89.48 21.57 40.3 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.846 -0.693 . . . . 20.02 111.922 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . 0.49 ' HA ' ' O ' ' A' ' 136' ' ' ILE . 97.5 m-85 -136.93 143.83 43.12 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.858 0.361 . . . . 20.56 111.328 -179.709 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.519 ' HB ' ' HB ' ' A' ' 136' ' ' ILE . 59.6 mt -114.35 132.3 63.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-N 115.904 -0.589 . . . . 19.37 110.832 179.629 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 26.7 p -114.42 156.18 44.86 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.037 -0.529 . . . . 22.65 110.693 -179.705 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_exo -42.78 -48.71 7.18 Favored 'Trans proline' 0 C--N 1.348 0.538 0 C-N-CA 122.686 2.257 . . . . 23.78 112.965 -179.78 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.81 -51.29 68.86 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.093 0.473 . . . . 25.0 111.068 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . 0.65 ' HB3' ' CZ ' ' A' ' 94' ' ' ARG . 38.6 mt-10 -59.15 -41.34 88.1 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.716 -0.674 . . . . 22.31 111.04 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.56 HD22 ' HB ' ' A' ' 121' ' ' ILE . 47.7 tp -54.38 -46.72 73.13 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.67 -0.695 . . . . 20.62 111.037 -179.476 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 5.4 ttt180 -60.47 -48.16 82.98 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.104 -0.498 . . . . 27.9 110.854 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 72.5 t80 -52.19 -35.02 47.92 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.223 -0.444 . . . . 25.96 111.513 -179.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.611 HG22 HH11 ' A' ' 94' ' ' ARG . 30.2 t -77.18 -54.12 13.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 N-CA-C 111.748 0.277 . . . . 21.06 111.748 -179.611 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -49.54 -39.63 35.27 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.834 0.349 . . . . 20.93 110.955 -179.715 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 84.7 mt -66.84 -28.68 43.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.17 -0.468 . . . . 25.52 110.936 179.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 89.1 m-20 -72.84 -46.18 54.37 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.235 -0.439 . . . . 23.32 110.336 179.639 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 9.6 mp -60.32 -45.11 94.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.626 -0.715 . . . . 21.07 110.976 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 128.95 11.81 2.79 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.8 -0.714 . . . . 23.25 112.474 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -106.51 94.64 5.24 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.789 0.328 . . . . 22.59 111.07 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -60.99 126.2 26.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.159 -0.473 . . . . 28.21 110.704 179.588 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 3.0 m -144.41 150.71 16.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.231 -0.44 . . . . 24.75 111.444 -179.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 68.3 p -94.5 149.36 21.32 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.826 -0.625 . . . . 27.5 110.218 179.231 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -54.78 -17.24 3.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.155 -0.475 . . . . 27.03 111.601 -179.597 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -77.8 -55.18 5.54 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.479 -0.328 . . . . 29.14 111.511 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -63.36 -38.84 92.71 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 111.996 0.369 . . . . 24.7 111.996 -179.151 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.56 ' HB ' HD22 ' A' ' 105' ' ' LEU . 42.0 pt -71.68 -41.61 71.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 N-CA-C 111.787 0.292 . . . . 22.9 111.787 -179.408 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.492 ' N ' HG13 ' A' ' 121' ' ' ILE . 19.7 t70 -59.89 -39.76 86.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.741 0.305 . . . . 24.29 110.702 179.873 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -65.06 -43.9 90.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.11 -0.496 . . . . 24.74 110.605 179.682 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 52.6 ttp -56.76 -37.78 71.54 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.114 -0.494 . . . . 20.15 110.585 179.459 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.495 HG22 HD13 ' A' ' 136' ' ' ILE . 72.3 mt -65.85 -43.23 93.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.99 -0.55 . . . . 20.23 110.448 179.595 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 75.0 ttt180 -60.82 -30.66 70.22 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.701 -0.682 . . . . 25.57 111.115 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -75.88 -27.62 57.81 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.132 -0.485 . . . . 19.18 111.362 -179.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.539 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -101.06 -8.73 22.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.355 -0.384 . . . . 16.88 111.181 -179.805 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 30.2 t0 -100.7 87.48 3.35 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.179 -0.464 . . . . 20.4 110.825 -179.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 71.7 m-85 -67.4 -49.81 62.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.895 -0.593 . . . . 21.43 111.147 -179.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -57.39 -29.12 63.81 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.239 -0.437 . . . . 23.37 110.776 179.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 67.17 63.62 3.7 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.973 -0.632 . . . . 24.32 112.909 179.419 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -122.95 7.26 9.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.851 0.358 . . . . 24.4 110.586 179.533 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 69.07 18.83 73.27 Favored Glycine 0 C--N 1.33 0.246 0 C-N-CA 120.99 -0.624 . . . . 23.47 112.629 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 85.6 mmm -134.57 153.66 51.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.701 0.286 . . . . 22.91 110.545 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.519 ' HB ' ' HB ' ' A' ' 100' ' ' ILE . 43.4 mm -114.79 141.81 29.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 121.091 0.472 . . . . 18.67 111.563 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . 0.495 ' ND2' ' H ' ' A' ' 138' ' ' TYR . 3.5 t-20 -114.89 156.42 25.02 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.258 -0.883 . . . . 16.97 108.801 178.345 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.495 ' H ' ' ND2' ' A' ' 137' ' ' ASN . 6.8 t80 -40.08 -24.8 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 120.706 0.288 . . . . 15.28 111.487 179.698 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.435 ' N ' ' O ' ' A' ' 137' ' ' ASN . 14.3 mm-40 -80.28 -55.78 4.67 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.876 0.37 . . . . 14.82 111.01 -179.353 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.51 ' HB2' HG21 ' A' ' 136' ' ' ILE . 35.5 mt-10 -57.74 -31.17 66.19 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.005 -0.543 . . . . 17.46 110.401 179.742 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.551 ' HA ' ' HE2' ' A' ' 144' ' ' MET . 90.0 t80 -69.58 -56.04 8.44 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.599 -0.728 . . . . 13.65 110.708 -179.922 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . 0.553 ' HA ' HD13 ' A' ' 145' ' ' ILE . 52.0 t -46.58 -38.22 3.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.002 -0.545 . . . . 11.12 111.958 179.626 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' TRP . . . . . 0.418 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 91.0 t90 -71.08 -55.87 7.32 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.469 0.544 . . . . 14.4 112.469 -178.809 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' MET . . . . . 0.551 ' HE2' ' HA ' ' A' ' 141' ' ' PHE . 18.4 ptt? -62.47 -25.0 67.76 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 112.971 0.73 . . . . 14.63 112.971 -177.75 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . 0.553 HD13 ' HA ' ' A' ' 142' ' ' VAL . 45.1 pt -80.93 -40.47 18.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 N-CA-C 112.168 0.433 . . . . 11.62 112.168 -179.83 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 146' ' ' SER . . . . . 0.522 ' N ' HG13 ' A' ' 145' ' ' ILE . 88.1 p -61.31 -14.82 29.72 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-O 121.494 0.664 . . . . 8.66 109.557 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 147' ' ' GLN . . . . . 0.418 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 2.7 mm-40 -113.6 -11.51 12.99 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 114.899 -1.046 . . . . 11.87 109.897 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . 0.537 ' HB2' ' HA ' ' A' ' 145' ' ' ILE . 28.0 ttpp . . . . . 0 C--O 1.25 1.085 0 CA-C-O 118.247 -0.882 . . . . 13.97 110.92 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 149' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 151' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 53.4 m . . . . . 0 N--CA 1.486 1.325 0 CA-C-O 120.919 0.39 . . . . 5.2 110.996 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -142.74 142.02 31.87 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.121 -0.49 . . . . 3.26 110.87 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.582 HD12 ' SG ' ' A' ' 69' ' ' CYS . 33.2 mt -70.75 82.78 0.63 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.325 -0.398 . . . . 2.0 110.614 179.738 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 56.5 p -70.99 -165.4 0.12 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.132 -0.486 . . . . 1.72 111.194 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -75.48 -42.79 52.16 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.995 0.426 . . . . 2.2 110.472 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -73.06 -35.13 66.63 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.834 -0.621 . . . . 1.35 110.536 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -70.85 -47.21 60.59 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.922 -0.581 . . . . 2.34 110.817 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.501 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 35.4 mt -58.46 -41.26 81.18 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 116.271 -0.422 . . . . 1.27 110.912 179.828 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -76.06 -22.05 56.08 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.438 -0.347 . . . . 1.22 111.043 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -68.47 -57.1 6.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.199 -0.455 . . . . 2.27 111.736 -179.425 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.501 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 11.5 p90 -76.76 -25.29 53.27 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.678 -0.409 . . . . 0.46 110.489 -179.721 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.9 tptm -63.33 -34.01 76.77 Favored 'General case' 0 CA--C 1.519 -0.242 0 N-CA-C 108.87 -0.789 . . . . 1.85 108.87 178.227 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.533 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 14.0 t70 -69.74 -53.02 20.39 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 109.013 -0.736 . . . . 0.44 109.013 178.418 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.05 -15.23 21.26 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.821 -0.627 . . . . 1.08 110.508 178.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 66.1 t80 -80.69 -44.76 18.24 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.746 -0.661 . . . . 0.56 111.001 -179.729 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.433 HG23 ' O ' ' A' ' 14' ' ' ASP . 25.7 m -69.33 -21.14 24.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.983 0.42 . . . . 1.69 110.675 -179.664 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.533 ' HG3' ' O ' ' A' ' 14' ' ' ASP . 83.8 mt-30 -63.69 -25.29 68.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.83 -0.623 . . . . 2.23 111.3 179.814 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -104.9 25.06 10.93 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.57 -0.286 . . . . 0.69 111.617 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -116.74 80.64 1.5 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.059 0.457 . . . . 0.46 110.723 179.336 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt -93.83 5.14 52.63 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.85 -0.614 . . . . 2.55 111.176 -179.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -103.89 -1.26 27.99 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.316 -0.402 . . . . 1.8 111.35 -179.371 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 63.48 10.39 36.03 Favored Glycine 0 CA--C 1.517 0.201 0 C-N-CA 120.921 -0.657 . . . . 0.54 113.144 179.578 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 30.4 p -90.15 10.85 22.84 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.699 0.285 . . . . 1.1 111.122 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 56.26 18.13 20.12 Favored Glycine 0 C--N 1.332 0.306 0 C-N-CA 120.766 -0.73 . . . . 0.37 111.912 -179.653 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.502 ' C ' HE22 ' A' ' 62' ' ' GLN . 32.1 mtpt -129.58 155.95 44.97 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.594 -0.303 . . . . 1.75 110.819 -179.339 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.443 ' N ' HE22 ' A' ' 62' ' ' GLN . 35.7 pt -120.87 129.96 75.13 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 120.934 0.397 . . . . 1.2 111.359 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.406 ' C ' ' H ' ' A' ' 30' ' ' ARG . . . -47.78 137.46 9.6 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.144 -0.48 . . . . 1.04 111.336 179.84 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.463 HG23 ' HA ' ' A' ' 56' ' ' GLU . 5.5 t -67.31 -0.27 3.41 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.926 -0.579 . . . . 1.71 110.873 179.804 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.442 ' HD2' HG21 ' A' ' 29' ' ' THR . 3.6 mmm180 -94.28 -17.8 22.27 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.98 -0.554 . . . . 3.53 110.28 179.839 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -102.07 -3.0 28.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.56 -0.745 . . . . 2.26 110.503 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -58.08 -50.66 72.68 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.009 -0.542 . . . . 1.95 110.311 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -54.34 -38.56 62.5 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.49 -0.862 . . . . 0.32 111.524 179.301 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 92.8 m -65.95 -34.53 78.33 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.006 0.432 . . . . 1.01 110.429 179.145 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 48.3 tp -68.3 -36.68 79.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.789 -0.641 . . . . 1.85 110.909 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.436 ' HG3' ' HG3' ' A' ' 43' ' ' PRO . 40.0 mmm -65.46 -40.19 92.91 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.88 -0.415 . . . . 1.43 109.88 179.549 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 74.9 mtp180 -67.9 -30.39 69.71 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.266 -0.642 . . . . 3.27 109.266 178.705 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 96.2 m -65.97 -21.29 66.41 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 115.286 -0.87 . . . . 1.54 110.415 179.245 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.414 ' C ' ' H ' ' A' ' 41' ' ' GLN . 10.3 mp -114.49 156.96 23.62 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.493 -0.776 . . . . 1.94 110.413 179.757 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -53.16 -8.12 0.64 Allowed Glycine 0 CA--C 1.52 0.402 0 C-N-CA 121.109 -0.567 . . . . 0.69 113.339 -179.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.414 ' H ' ' C ' ' A' ' 39' ' ' LEU . 82.9 mm-40 -60.43 176.14 0.38 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.089 0.471 . . . . 1.97 111.343 179.752 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 16.8 p-10 -169.81 72.27 0.66 Allowed Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 115.782 -0.645 . . . . 3.44 110.85 179.8 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.436 ' HG3' ' HG3' ' A' ' 36' ' ' MET . 56.9 Cg_endo -68.84 142.29 51.68 Favored 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.595 2.196 . . . . 0.59 112.316 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 26.9 m -64.22 148.46 50.05 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.243 -0.435 . . . . 1.28 110.168 179.346 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.469 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 6.7 tp10 -48.15 -55.69 9.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.595 0.236 . . . . 2.7 110.999 -179.356 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -51.13 -52.13 46.9 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.144 -0.48 . . . . 1.15 111.42 -179.837 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -50.01 -50.45 47.29 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.375 -0.375 . . . . 2.23 110.702 179.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 12.8 mt -57.07 -45.48 83.26 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.229 -0.441 . . . . 2.01 110.676 179.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.469 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 30.4 mm-40 -60.73 -32.31 71.59 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.811 0.339 . . . . 1.68 110.911 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -73.71 -55.52 6.16 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.204 -0.453 . . . . 0.62 112.185 -179.086 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.8 pp -66.59 -36.72 83.3 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 111.613 0.227 . . . . 1.11 111.613 -179.13 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 78.9 mt -64.81 -43.25 96.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.702 0.287 . . . . 1.25 110.483 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.54 -28.84 68.14 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.2 -0.454 . . . . 1.24 110.372 179.328 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -66.05 -51.36 58.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.93 -0.577 . . . . 2.54 110.228 179.452 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -78.51 -14.72 59.22 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.055 -0.52 . . . . 1.19 111.429 179.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.463 ' HA ' HG23 ' A' ' 29' ' ' THR . 40.7 tt0 -59.97 -44.09 94.68 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.504 -0.316 . . . . 1.95 111.051 -179.807 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -122.45 57.64 1.08 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.306 -0.406 . . . . 3.19 110.984 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -149.26 -30.53 0.24 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.157 -0.474 . . . . 2.69 110.782 179.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 27.7 m-80 -128.7 25.69 5.65 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.139 -0.482 . . . . 2.05 110.784 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . 0.558 ' N ' HD21 ' A' ' 60' ' ' ASN . 0.8 OUTLIER 62.69 11.37 4.8 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.96 -0.564 . . . . 1.67 111.667 179.846 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 104.18 37.95 2.78 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.687 -0.768 . . . . 0.86 112.647 179.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.502 HE22 ' C ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -140.56 154.31 46.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.139 0.495 . . . . 0.49 111.438 179.921 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 81.3 mt -122.02 147.76 45.67 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.742 -0.663 . . . . 2.05 110.146 179.607 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -112.9 156.76 22.4 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.61 -0.268 . . . . 1.52 110.507 -179.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.415 ' O ' ' HB2' ' A' ' 69' ' ' CYS . 78.3 t80 -43.69 -42.6 5.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.206 -0.452 . . . . 0.46 111.287 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' THR . . . . . 0.411 ' H ' ' HG1' ' A' ' 66' ' ' THR . 0.2 OUTLIER -69.27 -34.11 74.27 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 111.874 0.324 . . . . 1.41 111.874 -179.713 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -63.09 -54.02 44.56 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.097 0.475 . . . . 1.36 110.239 179.501 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.472 ' HE2' ' HB2' ' A' ' 12' ' ' PHE . 28.7 t80 -64.14 -45.01 90.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.752 -0.658 . . . . 0.61 110.752 179.676 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.582 ' SG ' HD12 ' A' ' 4' ' ' LEU . 3.9 t -58.15 -44.19 87.74 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.079 -0.509 . . . . 1.41 110.156 179.62 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -53.26 -48.16 60.02 Favored Glycine 0 N--CA 1.45 -0.432 0 CA-C-N 115.622 -0.717 . . . . 0.41 111.674 179.536 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.464 ' HA ' ' HG2' ' A' ' 74' ' ' LYS . 14.4 mt -62.75 -44.7 99.7 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.363 0 CA-C-O 121.091 0.472 . . . . 1.13 110.426 179.257 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -53.33 -27.12 21.66 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.555 -0.748 . . . . 1.24 110.035 179.472 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -74.48 -47.29 34.13 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.907 -0.588 . . . . 1.17 111.034 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.464 ' HG2' ' HA ' ' A' ' 71' ' ' ILE . 63.1 pttt -68.74 -27.5 65.98 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 116.551 -0.295 . . . . 1.91 111.247 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 22.3 mt-30 -81.24 -50.41 9.59 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.796 0.332 . . . . 2.03 111.497 179.061 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 33.1 mtt -58.66 -40.13 82.61 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 112.373 0.509 . . . . 1.52 112.373 -178.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . 0.423 ' NE ' ' HA ' ' A' ' 74' ' ' LYS . 10.0 ptp180 -53.6 -43.52 68.69 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-O 121.024 0.44 . . . . 5.25 109.939 -179.346 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.422 ' O ' ' C ' ' A' ' 79' ' ' THR . 7.1 pt-20 -89.52 -117.84 0.06 Allowed 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 108.912 -0.773 . . . . 4.01 108.912 178.067 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' THR . . . . . 0.422 ' C ' ' O ' ' A' ' 78' ' ' GLU . 19.6 m 34.23 49.31 0.31 Allowed 'General case' 0 CA--C 1.531 0.221 0 CA-C-O 121.26 0.552 . . . . 5.71 111.099 179.701 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -163.26 -2.09 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.093 -0.503 . . . . 5.6 111.305 -179.6 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.502 ' O ' ' HG2' ' A' ' 85' ' ' MET . 13.0 t -44.91 126.63 5.93 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.213 -0.449 . . . . 7.48 111.163 -179.76 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -75.61 -14.4 60.37 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.21 -0.45 . . . . 9.74 111.495 -179.273 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -60.78 -55.29 34.92 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.384 -0.371 . . . . 12.11 111.614 -179.716 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -65.74 -20.52 66.3 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.303 -0.408 . . . . 10.87 111.23 -179.503 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' MET . . . . . 0.51 ' HB3' HD13 ' A' ' 145' ' ' ILE . 1.5 mmm -80.46 -36.01 34.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.991 0.424 . . . . 11.09 110.78 -179.353 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 29.4 ttt180 -67.96 -42.44 80.88 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.821 -0.627 . . . . 16.05 110.487 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -68.06 -37.93 81.86 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.078 -0.51 . . . . 14.85 110.002 179.161 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.16 -31.15 67.33 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.972 -0.558 . . . . 14.11 110.854 179.499 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -67.71 -40.45 84.27 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.118 -0.492 . . . . 16.42 110.456 179.766 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -66.5 -39.91 88.97 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.914 -0.585 . . . . 17.66 110.559 179.493 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 96.9 mt -64.47 -47.93 87.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.845 -0.616 . . . . 18.15 110.795 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.44 ' O ' ' CZ ' ' A' ' 94' ' ' ARG . 4.4 m-85 -63.85 -57.14 10.77 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.114 -0.494 . . . . 18.34 110.695 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.59 ' HA ' HH21 ' A' ' 94' ' ' ARG . 27.4 t0 -53.51 127.3 24.67 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 120.787 0.327 . . . . 19.29 110.228 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.719 ' H ' ' HE ' ' A' ' 94' ' ' ARG . 0.0 OUTLIER -98.19 -24.18 15.38 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.28 -0.418 . . . . 22.47 111.788 -178.665 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -101.84 -179.93 4.15 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.969 0.414 . . . . 23.34 111.026 -179.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.26 3.3 56.67 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.886 -0.673 . . . . 22.77 112.024 179.628 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -71.63 -36.14 70.66 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.869 0.366 . . . . 23.0 111.24 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 90.38 27.15 21.31 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.737 -0.744 . . . . 20.02 112.494 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . 0.41 ' HA ' ' O ' ' A' ' 136' ' ' ILE . 86.3 m-85 -132.32 142.81 49.49 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.569 0.223 . . . . 20.56 110.764 179.839 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.552 ' HB ' ' HB ' ' A' ' 136' ' ' ILE . 41.5 mt -114.47 126.28 71.97 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-O 120.923 0.392 . . . . 19.37 111.268 179.893 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 26.8 p -116.05 156.12 47.19 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 115.94 -0.573 . . . . 22.65 110.555 179.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_exo -41.63 -36.33 3.1 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 122.448 2.099 . . . . 23.78 112.464 -179.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.89 -49.98 68.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.08 0.467 . . . . 25.0 110.591 179.554 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . 0.568 ' HB3' ' CZ ' ' A' ' 94' ' ' ARG . 38.1 mt-10 -63.24 -50.25 70.94 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.935 -0.575 . . . . 22.31 110.677 179.337 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.486 HD22 ' HB ' ' A' ' 121' ' ' ILE . 48.0 tp -51.55 -35.43 40.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.642 -0.708 . . . . 20.62 111.799 -179.081 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.461 ' HG3' ' N ' ' A' ' 107' ' ' PHE . 0.1 OUTLIER -76.28 -32.15 58.65 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.91 0.386 . . . . 27.9 110.551 -179.677 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . 0.461 ' N ' ' HG3' ' A' ' 106' ' ' ARG . 85.5 t80 -72.62 -34.75 67.57 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.901 -0.591 . . . . 25.96 111.732 -179.883 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.411 HG21 ' HA ' ' A' ' 92' ' ' PHE . 7.3 p -77.86 -47.0 26.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 N-CA-C 112.011 0.374 . . . . 21.06 112.011 -179.203 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -51.6 -36.99 47.89 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.724 0.297 . . . . 20.93 111.533 -179.321 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.441 HG13 ' O ' ' A' ' 106' ' ' ARG . 75.7 mt -69.47 -26.8 32.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.349 -0.387 . . . . 25.52 111.082 -179.827 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -73.29 -41.14 63.94 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.195 -0.457 . . . . 23.32 110.619 179.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 9.2 mp -63.5 -44.37 94.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.914 -0.585 . . . . 21.07 110.945 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 133.6 1.88 3.72 Favored Glycine 0 C--N 1.331 0.286 0 C-N-CA 120.688 -0.768 . . . . 23.25 112.753 179.562 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -103.16 115.38 30.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.784 0.326 . . . . 22.59 111.291 -179.637 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -76.09 128.52 35.15 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.196 -0.456 . . . . 28.21 110.256 179.434 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . 0.453 ' HB ' HG23 ' A' ' 121' ' ' ILE . 3.1 m -142.36 155.6 18.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 121.18 0.514 . . . . 24.75 111.802 -179.474 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' THR . . . . . 0.436 ' O ' HG12 ' A' ' 121' ' ' ILE . 43.0 p -103.44 147.49 27.07 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.472 -0.785 . . . . 27.5 110.208 179.646 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -51.95 -19.69 1.94 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.241 -0.436 . . . . 27.03 111.519 -179.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -77.9 -54.92 5.76 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.523 -0.308 . . . . 29.14 111.704 -179.535 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -63.17 -39.57 95.03 Favored 'General case' 0 C--N 1.332 -0.196 0 N-CA-C 112.034 0.383 . . . . 24.7 112.034 -179.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.518 HG13 ' N ' ' A' ' 122' ' ' ASP . 15.2 pt -71.63 -40.28 70.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 C-N-CA 121.022 -0.271 . . . . 22.9 111.63 -179.485 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.518 ' N ' HG13 ' A' ' 121' ' ' ILE . 15.4 t70 -57.79 -43.13 85.43 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.741 0.305 . . . . 24.29 110.538 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -63.0 -43.7 98.07 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.07 -0.514 . . . . 24.74 110.171 179.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 56.0 ttp -57.15 -33.89 67.87 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.002 -0.545 . . . . 20.15 110.362 179.148 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.51 HG22 HD13 ' A' ' 136' ' ' ILE . 97.3 mt -67.36 -43.72 87.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.815 -0.629 . . . . 20.23 110.533 179.638 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 32.3 ttm180 -60.3 -32.6 71.37 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.937 -0.574 . . . . 25.57 110.801 179.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -63.67 -29.73 70.93 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.13 -0.487 . . . . 19.18 111.278 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.67 ' HB1' ' HB3' ' A' ' 144' ' ' MET . . . -104.28 -15.37 15.49 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.3 -0.409 . . . . 16.88 111.329 -179.86 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -93.98 103.53 15.61 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.108 -0.496 . . . . 20.4 110.771 -179.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -96.52 -31.09 12.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.883 -0.599 . . . . 21.43 111.32 -179.427 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -70.69 -15.85 62.75 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.389 -0.369 . . . . 23.37 110.74 179.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 58.88 85.29 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 121.024 -0.607 . . . . 24.32 112.946 179.557 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -152.21 1.98 0.34 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.684 0.278 . . . . 24.4 111.073 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 69.28 20.85 75.5 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.81 -0.709 . . . . 23.47 112.753 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 82.1 mmm -135.12 155.04 51.4 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.591 0.234 . . . . 22.91 110.523 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.552 ' HB ' ' HB ' ' A' ' 100' ' ' ILE . 46.4 mm -116.79 143.81 26.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 121.093 0.473 . . . . 18.67 111.491 179.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . 0.418 ' N ' HG23 ' A' ' 136' ' ' ILE . 30.2 m-20 -114.41 156.67 24.07 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.267 -0.878 . . . . 16.97 108.711 178.465 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 16.9 t80 -42.65 -23.47 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.673 0.273 . . . . 15.28 111.151 179.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.404 ' N ' ' C ' ' A' ' 137' ' ' ASN . 12.0 mm-40 -80.52 -56.03 4.46 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 120.904 0.383 . . . . 14.82 110.831 -179.799 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.516 ' HB2' HG21 ' A' ' 136' ' ' ILE . 29.6 mt-10 -57.96 -27.26 63.26 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.139 -0.482 . . . . 17.46 110.121 179.616 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.471 ' HA ' ' HE2' ' A' ' 144' ' ' MET . 90.3 t80 -70.4 -55.71 8.41 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.746 -0.661 . . . . 13.65 110.035 179.435 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . 0.443 HG12 ' HG3' ' A' ' 85' ' ' MET . 55.1 t -46.03 -36.91 2.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 115.781 -0.645 . . . . 11.12 111.507 178.964 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 79.5 t90 -71.81 -55.5 7.47 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 112.563 0.579 . . . . 14.4 112.563 -178.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' MET . . . . . 0.67 ' HB3' ' HB1' ' A' ' 128' ' ' ALA . 20.8 ptt? -64.28 -22.63 67.02 Favored 'General case' 0 N--CA 1.463 0.203 0 N-CA-C 112.921 0.711 . . . . 14.63 112.921 -177.637 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . 0.656 ' HA ' ' HB2' ' A' ' 148' ' ' LYS . 28.3 pt -80.55 -42.58 21.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 C-N-CA 120.702 -0.399 . . . . 11.62 111.416 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 146' ' ' SER . . . . . 0.446 ' N ' HG13 ' A' ' 145' ' ' ILE . 82.3 p -65.04 -14.15 59.7 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.519 0.676 . . . . 8.66 109.421 179.235 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 -125.94 19.5 7.76 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 114.839 -1.073 . . . . 11.87 110.066 -179.589 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . 0.656 ' HB2' ' HA ' ' A' ' 145' ' ' ILE . 24.1 ttpp . . . . . 0 C--O 1.25 1.107 0 CA-C-O 118.296 -0.859 . . . . 13.97 110.898 -179.618 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 149' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 151' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 57.9 m . . . . . 0 N--CA 1.485 1.313 0 CA-C-O 120.839 0.352 . . . . 5.2 110.892 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -163.81 118.69 1.57 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 3.26 111.034 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.441 HD12 ' SG ' ' A' ' 69' ' ' CYS . 51.3 mt -63.49 118.02 7.55 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.031 -0.531 . . . . 2.0 111.105 -179.678 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -98.07 165.16 12.03 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.205 -0.452 . . . . 1.72 110.838 179.822 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -51.59 -39.05 57.21 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.797 0.332 . . . . 2.2 111.51 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.43 ' HG3' ' N ' ' A' ' 8' ' ' GLN . 11.6 pt-20 -72.08 -46.7 55.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.278 -0.419 . . . . 1.35 111.075 -179.406 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . 0.43 ' N ' ' HG3' ' A' ' 7' ' ' GLU . 96.7 mt-30 -61.04 -42.55 98.69 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.885 -0.598 . . . . 2.34 110.945 -179.812 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.465 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 77.1 mt -59.29 -51.94 66.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.951 -0.568 . . . . 1.27 110.893 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.0 -26.8 67.86 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.12 -0.491 . . . . 1.22 111.654 -179.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -69.45 -56.72 6.61 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 112.155 0.428 . . . . 2.27 112.155 -178.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.465 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 8.5 p90 -77.89 -25.03 48.29 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 120.466 -0.494 . . . . 0.46 110.908 -179.544 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.446 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 41.6 tptt -64.45 -34.12 77.47 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 108.969 -0.752 . . . . 1.85 108.969 178.707 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -70.12 -48.95 55.35 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 108.697 -0.853 . . . . 0.44 108.697 177.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.84 -14.06 41.26 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.268 -0.878 . . . . 1.08 110.355 178.697 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.446 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 31.2 t80 -80.04 -54.04 6.16 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.809 -0.632 . . . . 0.56 111.0 -179.501 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 15.6 m -62.25 -22.73 30.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 121.105 0.479 . . . . 1.69 110.334 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 75.6 mm-40 -61.09 -32.41 72.07 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.624 -0.716 . . . . 2.23 111.543 179.597 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 99.7 m-85 -101.97 33.89 2.88 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.741 0.305 . . . . 0.69 111.631 -179.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -125.64 75.5 1.49 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.042 0.449 . . . . 0.46 110.425 179.32 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 41.1 tptt -87.01 -33.85 19.43 Favored 'General case' 0 N--CA 1.436 -1.129 0 CA-C-N 115.824 -0.625 . . . . 2.55 110.925 -179.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -63.24 -15.68 57.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.102 -0.499 . . . . 1.8 111.384 -179.52 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.48 10.7 84.6 Favored Glycine 0 C--N 1.331 0.264 0 C-N-CA 120.832 -0.699 . . . . 0.54 112.833 179.553 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 20.3 p -86.9 15.35 5.98 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.637 0.256 . . . . 1.1 111.213 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 53.35 26.39 29.57 Favored Glycine 0 C--N 1.333 0.388 0 C-N-CA 120.851 -0.69 . . . . 0.37 112.234 -179.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.441 ' C ' HE22 ' A' ' 62' ' ' GLN . 31.5 mtmm -135.0 156.57 48.82 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.822 0.344 . . . . 1.75 111.054 -179.646 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.591 HG13 ' HB2' ' A' ' 63' ' ' LEU . 23.8 pt -114.11 126.02 71.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 121.115 0.483 . . . . 1.2 111.468 -179.649 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -54.49 138.17 41.07 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.861 -0.609 . . . . 1.04 111.213 179.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 9.4 t -68.31 -9.44 47.75 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.061 -0.518 . . . . 1.71 111.382 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.431 ' HD3' ' N ' ' A' ' 30' ' ' ARG . 0.0 OUTLIER -87.13 -14.14 42.15 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.256 -0.429 . . . . 3.53 110.681 179.902 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -108.19 -0.28 21.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.093 -0.503 . . . . 2.26 110.632 179.768 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -60.08 -46.08 90.77 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.072 -0.513 . . . . 1.95 109.972 179.665 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.477 ' HA2' HD12 ' A' ' 48' ' ' LEU . . . -56.89 -36.8 74.8 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.507 -0.854 . . . . 0.32 111.277 179.051 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 87.6 m -70.54 -32.5 69.98 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.007 0.432 . . . . 1.01 110.027 179.047 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.453 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 1.2 tt -65.48 -35.47 80.98 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.679 -0.691 . . . . 1.85 110.165 179.68 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.567 ' HG3' ' HG3' ' A' ' 43' ' ' PRO . 21.7 mmt -69.52 -42.17 75.03 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.215 -0.448 . . . . 1.43 110.482 179.301 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 62.7 mtp180 -53.19 -51.65 61.39 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.617 -0.719 . . . . 3.27 111.403 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 10.2 t -62.99 -12.78 28.1 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.433 -0.349 . . . . 1.54 111.538 -179.785 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.453 ' HG ' ' O ' ' A' ' 35' ' ' LEU . 47.1 mt -113.06 156.65 22.75 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.364 -0.38 . . . . 1.94 110.708 -179.827 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -76.88 39.89 1.6 Allowed Glycine 0 CA--C 1.52 0.357 0 C-N-CA 120.88 -0.676 . . . . 0.69 113.912 -178.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 67.2 mm-40 -94.3 -59.98 1.83 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 117.148 0.474 . . . . 1.97 110.745 179.034 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.564 ' N ' HD21 ' A' ' 42' ' ' ASN . 0.8 OUTLIER 57.15 66.28 3.17 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.132 -0.486 . . . . 3.44 111.088 179.965 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.567 ' HG3' ' HG3' ' A' ' 36' ' ' MET . 43.5 Cg_endo -67.42 167.95 19.26 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.593 2.195 . . . . 0.59 112.117 179.723 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 20.6 m -74.43 150.09 40.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.184 -0.462 . . . . 1.28 110.511 179.654 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -54.76 -48.01 73.17 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.654 0.264 . . . . 2.7 111.434 -179.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.81 -47.19 81.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.375 -0.375 . . . . 1.15 111.498 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.402 ' O ' HD22 ' A' ' 51' ' ' LEU . 10.0 tp10 -56.46 -48.79 76.33 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.03 0.443 . . . . 2.23 110.48 -179.554 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.477 HD12 ' HA2' ' A' ' 33' ' ' GLY . 33.4 tp -57.45 -41.24 80.16 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.555 -0.748 . . . . 2.01 110.938 -179.759 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 67.8 mt-30 -72.17 -25.95 61.88 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.058 -0.519 . . . . 1.68 111.212 -179.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -71.12 -55.05 9.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.483 -0.326 . . . . 0.62 111.565 -179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.423 HD23 ' HA ' ' A' ' 48' ' ' LEU . 0.9 OUTLIER -64.9 -38.8 92.16 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.459 -0.337 . . . . 1.11 111.844 -179.226 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 94.5 mt -65.5 -48.37 83.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.841 0.353 . . . . 1.25 110.837 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.92 -26.33 66.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.192 -0.458 . . . . 1.24 110.745 179.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -69.79 -53.98 15.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.991 -0.549 . . . . 2.54 110.416 179.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -72.7 -14.3 61.54 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.996 -0.547 . . . . 1.19 111.176 179.735 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -55.53 -30.61 61.02 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.097 -0.501 . . . . 1.95 111.406 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -118.57 -33.23 4.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.506 -0.316 . . . . 3.19 111.337 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -69.58 -34.64 74.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.412 -0.358 . . . . 2.69 111.133 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . 0.46 ' O ' ' HB2' ' A' ' 60' ' ' ASN . 13.5 m120 -114.7 6.25 15.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.315 -0.402 . . . . 2.05 111.246 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . 0.46 ' HB2' ' O ' ' A' ' 59' ' ' ASN . 39.6 m-80 74.0 -49.66 0.68 Allowed 'General case' 0 N--CA 1.466 0.375 0 O-C-N 123.607 0.567 . . . . 1.67 111.527 -179.867 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 169.43 7.52 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.598 -0.81 . . . . 0.86 112.992 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.454 ' HA ' HE21 ' A' ' 62' ' ' GLN . 0.0 OUTLIER -124.66 155.03 39.85 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.995 0.426 . . . . 0.49 111.284 179.837 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.591 ' HB2' HG13 ' A' ' 27' ' ' ILE . 27.3 mt -129.28 156.56 43.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.867 -0.606 . . . . 2.05 110.854 -179.79 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . 0.412 ' OD1' ' HD3' ' A' ' 26' ' ' LYS . 44.3 m-80 -112.34 157.26 21.21 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.526 -0.307 . . . . 1.52 110.493 179.902 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.45 ' O ' ' HB2' ' A' ' 69' ' ' CYS . 87.8 t80 -43.06 -38.46 2.34 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.986 -0.552 . . . . 0.46 110.654 179.589 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -72.81 -37.71 67.44 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.063 -0.517 . . . . 1.41 111.922 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -59.65 -49.97 75.69 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.179 0.514 . . . . 1.36 109.918 179.562 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.459 ' HE2' ' HB2' ' A' ' 12' ' ' PHE . 34.2 t80 -68.5 -53.7 21.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.525 -0.761 . . . . 0.61 110.839 179.763 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.45 ' HB2' ' O ' ' A' ' 65' ' ' PHE . 1.8 t -51.52 -41.02 60.74 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-O 120.971 0.415 . . . . 1.41 110.267 179.667 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -56.94 -50.38 64.45 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.864 -0.684 . . . . 0.41 111.526 179.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.454 ' HA ' ' HE2' ' A' ' 74' ' ' LYS . 11.4 mt -62.38 -36.69 76.02 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.407 0 CA-C-O 120.88 0.372 . . . . 1.13 110.852 179.344 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 95.0 mmm -59.2 -41.34 88.32 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.153 0.501 . . . . 1.24 109.679 179.104 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -55.93 -52.7 63.19 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.463 -0.79 . . . . 1.17 110.659 178.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.454 ' HE2' ' HA ' ' A' ' 71' ' ' ILE . 55.3 pttt -68.7 -30.52 69.2 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.287 -0.415 . . . . 1.91 111.15 -179.923 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . 0.499 ' NE2' ' HB3' ' A' ' 43' ' ' PRO . 5.1 tp-100 -68.64 -45.61 71.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.92 0.39 . . . . 2.03 110.884 179.624 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 45.1 mtt -58.92 -43.78 91.19 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 115.861 -0.609 . . . . 1.52 111.022 -179.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 76.6 mtp180 -79.29 -18.86 51.83 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.125 -0.489 . . . . 5.25 111.051 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -64.92 -46.13 82.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.3 -0.409 . . . . 4.01 111.215 -179.629 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' THR . . . . . 0.476 HG21 ' N ' ' A' ' 80' ' ' ASP . 94.5 m -83.76 -99.84 0.05 Allowed 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 116.381 -0.372 . . . . 5.71 111.497 -179.396 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . 0.476 ' HB2' ' HE1' ' A' ' 85' ' ' MET . 3.2 p30 175.31 17.75 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 117.468 0.122 . . . . 5.6 110.842 -179.392 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.519 ' O ' ' HG2' ' A' ' 85' ' ' MET . 3.0 t 37.01 69.04 0.23 Allowed 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 121.17 0.509 . . . . 7.48 111.07 -179.417 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -49.92 -18.95 0.59 Allowed 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 115.281 -0.872 . . . . 9.74 113.112 -178.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -60.35 -56.28 23.35 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 111.854 0.316 . . . . 12.11 111.854 -179.213 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -72.73 -13.65 61.38 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.357 -0.383 . . . . 10.87 111.285 -179.455 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' MET . . . . . 0.519 ' HG2' ' O ' ' A' ' 81' ' ' THR . 5.6 mmm -79.34 -49.28 12.66 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.468 -0.333 . . . . 11.09 110.627 -179.197 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 16.3 ttp180 -63.45 -42.23 98.65 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 116.219 -0.446 . . . . 16.05 109.912 179.586 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -60.11 -42.14 94.1 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.013 -0.539 . . . . 14.85 109.795 179.105 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -72.17 -23.23 61.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.75 -0.659 . . . . 14.11 110.597 179.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -68.95 -43.44 75.04 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.194 -0.457 . . . . 16.42 110.482 179.649 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 47.7 mtmt -68.32 -40.99 81.46 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.135 -0.484 . . . . 17.66 110.353 179.482 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 93.0 mt -64.47 -46.36 93.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.89 -0.595 . . . . 18.15 111.106 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -65.93 -49.13 69.03 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.281 -0.418 . . . . 18.34 110.907 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -61.06 98.63 0.08 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.28 -0.418 . . . . 19.29 110.069 179.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.42 ' HG2' ' HB3' ' A' ' 104' ' ' GLU . 18.9 mmm180 -51.7 -27.77 12.76 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.918 -0.583 . . . . 22.47 111.231 -179.414 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . 0.408 ' HB2' ' OD1' ' A' ' 97' ' ' ASP . 4.0 m-20 -112.22 169.9 8.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.3 -0.409 . . . . 23.34 110.731 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.41 5.6 57.31 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.891 -0.671 . . . . 22.77 112.051 179.675 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.416 ' OD2' ' HB2' ' A' ' 99' ' ' PHE . 7.8 p-10 -57.43 -32.7 67.16 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.687 0.28 . . . . 23.0 111.23 -179.659 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 107.43 12.97 22.06 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.698 -0.763 . . . . 20.02 112.926 179.626 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . 0.443 ' HA ' ' O ' ' A' ' 136' ' ' ILE . 97.3 m-85 -138.69 145.26 40.14 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.834 0.349 . . . . 20.56 111.071 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 48.5 mt -115.85 137.81 48.33 Favored 'Isoleucine or valine' 0 C--O 1.232 0.148 0 CA-C-N 116.151 -0.477 . . . . 19.37 111.445 -179.726 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 28.3 p -115.84 156.31 46.65 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 115.827 -0.624 . . . . 22.65 110.606 179.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_exo -44.34 -38.01 11.0 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.396 2.064 . . . . 23.78 112.552 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -63.89 -40.05 95.6 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.055 -0.521 . . . . 25.0 111.037 179.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . 0.425 ' O ' HG21 ' A' ' 108' ' ' VAL . 42.2 mt-10 -72.82 -41.44 64.9 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.473 -0.785 . . . . 22.31 110.369 -179.896 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.503 HD21 ' HB ' ' A' ' 121' ' ' ILE . 4.9 tp -58.05 -55.04 40.14 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.695 -0.684 . . . . 20.62 110.381 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.483 ' HA ' ' HE1' ' A' ' 109' ' ' MET . 9.0 ttp180 -54.61 -49.78 69.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.588 -0.733 . . . . 27.9 111.573 -179.813 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 55.3 t80 -54.59 -33.8 60.93 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.203 -0.453 . . . . 25.96 111.786 -178.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.48 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 58.3 t -79.23 -55.43 9.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 112.113 0.412 . . . . 21.06 112.113 -179.187 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.483 ' HE1' ' HA ' ' A' ' 106' ' ' ARG . 49.5 mtm -50.64 -41.23 55.02 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.524 0.202 . . . . 20.93 111.429 -179.278 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 88.9 mt -62.85 -32.59 56.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.928 0.394 . . . . 25.52 110.546 179.36 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 95.8 m-20 -71.46 -38.27 71.29 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.007 -0.542 . . . . 23.32 110.828 179.501 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.48 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 2.3 mt -74.66 -25.94 59.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.191 -0.459 . . . . 21.07 110.936 -179.708 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 98.23 46.87 2.12 Favored Glycine 0 N--CA 1.453 -0.23 0 C-N-CA 120.887 -0.673 . . . . 23.25 112.433 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -100.26 -27.02 13.71 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.523 0.201 . . . . 22.59 111.359 -179.684 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 13.4 mmmm 52.3 85.97 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.327 -0.397 . . . . 28.21 110.809 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . 0.467 HG23 ' SD ' ' A' ' 109' ' ' MET . 2.8 m -129.44 155.38 41.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.122 -0.49 . . . . 24.75 111.824 -179.514 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 59.2 p -95.87 146.71 24.35 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.798 -0.637 . . . . 27.5 109.864 178.608 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -55.54 -15.85 3.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.476 -0.329 . . . . 27.03 111.618 -179.453 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -79.21 -55.22 5.26 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.498 -0.319 . . . . 29.14 111.612 -179.573 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . 0.424 ' OE1' HG13 ' A' ' 116' ' ' VAL . 13.3 pt-20 -62.03 -37.34 84.54 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 111.824 0.305 . . . . 24.7 111.824 -179.347 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.503 ' HB ' HD21 ' A' ' 105' ' ' LEU . 33.3 pt -74.89 -38.19 43.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 N-CA-C 111.887 0.329 . . . . 22.9 111.887 -179.06 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.49 ' N ' HG13 ' A' ' 121' ' ' ILE . 18.0 t70 -62.33 -43.94 97.66 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.872 0.367 . . . . 24.29 110.561 179.753 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -62.55 -43.03 99.83 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.03 -0.532 . . . . 24.74 110.565 179.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 45.4 ttp -56.41 -36.95 69.51 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.063 -0.517 . . . . 20.15 110.651 179.389 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.512 HG22 HD11 ' A' ' 136' ' ' ILE . 71.9 mt -65.24 -43.05 95.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.045 -0.525 . . . . 20.23 110.514 179.751 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 69.9 ttt180 -59.4 -37.92 79.25 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.815 -0.63 . . . . 25.57 111.046 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -70.92 -24.48 62.47 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.202 -0.454 . . . . 19.18 111.315 -179.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.553 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -98.94 -12.77 20.37 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.309 -0.405 . . . . 16.88 111.272 -179.831 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 62.1 t0 -103.32 96.45 6.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.204 -0.453 . . . . 20.4 110.935 -179.553 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -66.38 -54.05 28.88 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.896 -0.593 . . . . 21.43 111.128 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -61.14 -19.3 61.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.153 -0.476 . . . . 23.37 111.042 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 52.16 77.38 0.14 Allowed Glycine 0 N--CA 1.453 -0.186 0 C-N-CA 120.904 -0.665 . . . . 24.32 112.753 179.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -128.75 -0.3 5.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.825 0.345 . . . . 24.4 110.667 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 80.74 19.66 67.56 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.9 -0.667 . . . . 23.47 112.617 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 38.2 mtp -139.33 149.33 44.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.65 0.262 . . . . 22.91 110.419 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.543 HG23 ' HB2' ' A' ' 141' ' ' PHE . 47.4 mm -116.62 142.3 30.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 121.254 0.549 . . . . 18.67 111.95 -179.408 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . 0.543 ' ND2' ' HB2' ' A' ' 139' ' ' GLU . 1.2 p-10 -114.94 158.75 21.58 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.159 -0.928 . . . . 16.97 109.239 178.647 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 11.8 t80 -37.72 -27.56 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 112.481 0.549 . . . . 15.28 112.481 -179.067 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.543 ' HB2' ' ND2' ' A' ' 137' ' ' ASN . 43.3 mt-10 -80.54 -55.73 4.66 Favored 'General case' 0 C--N 1.328 -0.327 0 O-C-N 122.155 -0.34 . . . . 14.82 111.236 -179.328 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.429 ' HB2' HG21 ' A' ' 136' ' ' ILE . 71.4 mt-10 -59.15 -29.76 67.66 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.228 -0.442 . . . . 17.46 110.504 179.819 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.563 ' HA ' ' HE1' ' A' ' 144' ' ' MET . 78.7 t80 -70.23 -55.61 8.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.821 -0.627 . . . . 13.65 110.575 179.715 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 53.7 t -48.25 -35.86 5.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 115.917 -0.583 . . . . 11.12 111.972 179.728 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' TRP . . . . . 0.455 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 91.4 t90 -72.23 -56.06 6.16 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.469 0.544 . . . . 14.4 112.469 -179.018 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' MET . . . . . 0.563 ' HE1' ' HA ' ' A' ' 141' ' ' PHE . 18.2 ptt? -61.35 -25.76 67.37 Favored 'General case' 0 N--CA 1.464 0.244 0 N-CA-C 112.93 0.715 . . . . 14.63 112.93 -177.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . 0.53 HG13 ' N ' ' A' ' 146' ' ' SER . 45.6 pt -80.48 -40.78 19.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 112.022 0.378 . . . . 11.62 112.022 -179.559 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 146' ' ' SER . . . . . 0.53 ' N ' HG13 ' A' ' 145' ' ' ILE . 22.6 t -59.7 -14.49 14.34 Favored 'General case' 0 CA--C 1.519 -0.25 0 CA-C-O 121.45 0.643 . . . . 8.66 109.841 -179.804 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 147' ' ' GLN . . . . . 0.455 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 2.6 mm-40 -114.63 -15.54 11.95 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.887 -1.051 . . . . 11.87 110.242 -179.579 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.312 -0.851 . . . . 13.97 110.904 179.822 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 149' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 151' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 66.4 m . . . . . 0 N--CA 1.485 1.283 0 CA-C-O 120.658 0.266 . . . . 5.2 110.929 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 28.7 mm-40 65.19 136.07 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 115.958 -0.564 . . . . 3.26 111.337 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.548 HD12 ' SG ' ' A' ' 69' ' ' CYS . 31.3 mt -76.86 82.92 3.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.106 -0.497 . . . . 2.0 110.925 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 76.3 p -70.34 -167.84 0.2 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.259 -0.428 . . . . 1.72 111.057 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.417 ' HG3' ' N ' ' A' ' 7' ' ' GLU . 10.0 pt-20 -72.64 -40.46 66.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.908 0.385 . . . . 2.2 110.505 -179.91 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.417 ' N ' ' HG3' ' A' ' 6' ' ' GLU . 9.4 pt-20 -74.18 -39.05 63.46 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.936 -0.574 . . . . 1.35 110.515 179.733 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -65.13 -48.99 71.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.905 -0.588 . . . . 2.34 110.64 179.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.514 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 61.9 mt -55.8 -50.59 67.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.389 -0.369 . . . . 1.27 110.705 179.829 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.61 -23.11 66.13 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.163 -0.472 . . . . 1.22 111.255 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -69.71 -56.35 7.45 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.295 -0.412 . . . . 2.27 111.828 -179.108 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.514 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 12.3 p90 -78.22 -25.47 46.99 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 120.586 -0.446 . . . . 0.46 110.879 -179.775 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.457 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 20.0 tptm -63.32 -36.23 83.02 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 108.989 -0.745 . . . . 1.85 108.989 178.484 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.447 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 15.7 t70 -68.44 -51.98 37.75 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 108.825 -0.806 . . . . 0.44 108.825 177.927 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.34 -13.81 22.31 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.399 -0.819 . . . . 1.08 110.568 179.069 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.457 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 55.0 t80 -79.43 -51.45 9.35 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.886 -0.597 . . . . 0.56 110.597 -179.697 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 26.9 m -65.36 -18.92 24.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 121.003 0.43 . . . . 1.69 110.294 179.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.447 ' HG2' ' O ' ' A' ' 14' ' ' ASP . 29.2 mm-40 -63.2 -29.62 70.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.648 -0.705 . . . . 2.23 111.719 179.483 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -105.87 27.1 8.85 Favored 'General case' 0 N--CA 1.463 0.217 0 N-CA-C 112.04 0.385 . . . . 0.69 112.04 -179.185 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -113.94 86.74 2.47 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.988 0.423 . . . . 0.46 110.589 179.217 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.556 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -94.85 -38.01 10.94 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.917 -0.583 . . . . 2.55 111.438 -179.599 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -56.8 -24.59 51.73 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.307 -0.406 . . . . 1.8 111.477 -179.583 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 87.28 1.92 83.56 Favored Glycine 0 C--N 1.33 0.209 0 C-N-CA 120.793 -0.717 . . . . 0.54 112.88 179.62 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 26.8 p -82.35 16.07 2.2 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.688 0.28 . . . . 1.1 111.195 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 54.93 25.55 38.17 Favored Glycine 0 C--N 1.331 0.299 0 C-N-CA 120.721 -0.752 . . . . 0.37 111.766 -179.539 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.47 ' C ' HE22 ' A' ' 62' ' ' GLN . 35.4 mtmm -132.38 156.61 46.34 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.842 0.353 . . . . 1.75 111.067 -179.382 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.669 HG13 ' HB2' ' A' ' 63' ' ' LEU . 31.1 pt -114.33 124.94 71.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 121.001 0.429 . . . . 1.2 111.341 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -51.2 141.19 15.05 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.063 -0.517 . . . . 1.04 111.416 179.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 8.3 t -65.91 -11.84 50.13 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.94 -0.573 . . . . 1.71 111.313 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.455 ' HD2' ' N ' ' A' ' 30' ' ' ARG . 2.5 mpt_? -90.76 5.25 49.05 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.971 0.415 . . . . 3.53 110.492 179.777 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -120.86 -9.43 9.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.923 -0.58 . . . . 2.26 110.788 -179.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.404 HD23 HD12 ' A' ' 51' ' ' LEU . 7.9 tt -53.25 -52.46 58.92 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.317 -0.401 . . . . 1.95 110.747 179.671 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.426 ' HA2' HD12 ' A' ' 48' ' ' LEU . . . -54.3 -48.01 65.97 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.427 -0.892 . . . . 0.32 111.602 179.551 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 30.2 m -58.3 -29.25 65.71 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 121.423 0.63 . . . . 1.01 109.643 178.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.404 HD11 HD12 ' A' ' 27' ' ' ILE . 1.2 tt -72.67 -35.07 67.62 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.163 -0.926 . . . . 1.85 109.905 179.391 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.549 ' SD ' ' HG3' ' A' ' 43' ' ' PRO . 7.4 mtp -76.92 -16.9 59.23 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.976 -0.556 . . . . 1.43 110.297 179.89 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -80.63 -41.78 23.3 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.977 -0.556 . . . . 3.27 110.302 179.049 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.426 HG22 ' HG ' ' A' ' 39' ' ' LEU . 10.4 t -67.32 -12.44 60.16 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.991 -0.55 . . . . 1.54 110.769 179.568 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.427 ' C ' ' H ' ' A' ' 41' ' ' GLN . 26.4 mt -112.28 155.53 23.9 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.918 -0.583 . . . . 1.94 110.136 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -72.42 16.83 1.62 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.834 -0.698 . . . . 0.69 113.462 -179.272 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.427 ' H ' ' C ' ' A' ' 39' ' ' LEU . 85.1 mm-40 -68.09 -63.2 1.11 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.907 0.384 . . . . 1.97 110.932 179.602 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 69.7 m-20 55.57 70.77 1.43 Allowed Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 115.936 -0.574 . . . . 3.44 111.061 -179.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.549 ' HG3' ' SD ' ' A' ' 36' ' ' MET . 57.5 Cg_endo -67.97 -167.78 0.18 Allowed 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.87 2.38 . . . . 0.59 112.307 179.645 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 41.1 m -100.17 144.23 29.44 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.036 -0.529 . . . . 1.28 110.489 179.45 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -48.99 -55.14 12.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.742 0.306 . . . . 2.7 111.364 -179.442 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -54.49 -48.24 72.09 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.204 -0.453 . . . . 1.15 111.622 -179.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.428 ' HG2' HD23 ' A' ' 51' ' ' LEU . 37.8 tt0 -56.4 -47.29 79.27 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.813 0.339 . . . . 2.23 110.651 -179.778 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.426 HD12 ' HA2' ' A' ' 33' ' ' GLY . 13.9 tp -58.83 -41.88 87.92 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.936 -0.575 . . . . 2.01 111.112 -179.764 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 82.8 mm-40 -71.12 -31.76 68.15 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.249 -0.432 . . . . 1.68 111.759 -179.384 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.456 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 28.8 m-20 -74.07 -55.88 5.58 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 111.919 0.34 . . . . 0.62 111.919 -179.199 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.428 HD23 ' HG2' ' A' ' 47' ' ' GLU . 3.1 pp -59.51 -37.29 77.93 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.696 -0.229 . . . . 1.11 111.285 -179.314 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 76.8 mt -69.35 -35.39 67.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.754 0.312 . . . . 1.25 110.556 179.539 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.68 -36.55 81.19 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.301 -0.409 . . . . 1.24 110.756 179.45 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.456 ' HG2' ' O ' ' A' ' 50' ' ' ASP . 3.3 mm-40 -73.23 -50.38 22.72 Favored 'General case' 0 CA--C 1.516 -0.365 0 N-CA-C 109.623 -0.51 . . . . 2.54 109.623 179.178 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -63.12 -14.36 47.66 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.551 -0.749 . . . . 1.19 110.975 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -57.47 -37.26 72.6 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.975 -0.557 . . . . 1.95 111.61 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 6.8 p30 -127.09 -36.95 2.12 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.597 -0.274 . . . . 3.19 111.563 -179.416 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 19.9 m120 -62.0 -15.53 44.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.557 -0.292 . . . . 2.69 111.37 -179.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . 0.443 ' C ' ' H ' ' A' ' 61' ' ' GLY . 14.4 m120 -123.24 1.28 9.09 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.436 -0.347 . . . . 2.05 110.972 179.861 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . 0.406 ' HB2' ' O ' ' A' ' 59' ' ' ASN . 12.5 m120 73.24 -31.24 0.22 Allowed 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.99 -0.55 . . . . 1.67 111.766 179.794 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . 0.443 ' H ' ' C ' ' A' ' 59' ' ' ASN . . . 140.5 15.5 0.49 Allowed Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.553 -0.832 . . . . 0.86 112.738 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.485 ' HA ' HE21 ' A' ' 62' ' ' GLN . 0.0 OUTLIER -138.66 151.49 47.24 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.077 0.465 . . . . 0.49 111.195 179.825 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.669 ' HB2' HG13 ' A' ' 27' ' ' ILE . 6.3 mp -119.12 150.02 40.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.627 -0.715 . . . . 2.05 110.685 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . 0.422 ' H ' ' HB2' ' A' ' 67' ' ' GLU . 50.0 m-80 -113.94 157.67 22.12 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.961 -0.385 . . . . 1.52 109.961 178.876 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.514 ' O ' ' HB2' ' A' ' 69' ' ' CYS . 85.3 t80 -43.68 -35.32 1.76 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.881 0.372 . . . . 0.46 110.411 179.147 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -77.08 -37.84 53.64 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.994 -0.548 . . . . 1.41 111.748 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.422 ' HB2' ' H ' ' A' ' 64' ' ' ASN . 10.2 mm-40 -59.64 -49.4 77.88 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.144 0.497 . . . . 1.36 110.016 179.486 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.462 ' HE2' ' HB2' ' A' ' 12' ' ' PHE . 28.5 t80 -69.08 -52.85 24.2 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.548 -0.751 . . . . 0.61 111.087 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.548 ' SG ' HD12 ' A' ' 4' ' ' LEU . 1.4 t -52.44 -45.02 65.82 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 121.002 0.43 . . . . 1.41 110.311 179.788 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -54.26 -50.85 54.46 Favored Glycine 0 N--CA 1.451 -0.32 0 CA-C-N 115.644 -0.707 . . . . 0.41 112.046 179.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.421 ' HA ' ' HG2' ' A' ' 74' ' ' LYS . 11.7 mt -62.54 -40.57 88.72 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.375 0 CA-C-O 120.973 0.416 . . . . 1.13 110.523 179.296 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' MET . . . . . 0.457 ' HA ' HE21 ' A' ' 75' ' ' GLN . 3.6 mtp -58.92 -22.72 60.29 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.784 -0.644 . . . . 1.24 109.998 179.43 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -74.89 -52.23 11.82 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.03 -0.532 . . . . 1.17 109.969 178.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.421 ' HG2' ' HA ' ' A' ' 71' ' ' ILE . 61.2 pttt -67.05 -24.25 65.97 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 121.08 0.467 . . . . 1.91 110.07 179.164 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . 0.457 HE21 ' HA ' ' A' ' 72' ' ' MET . 7.7 tt0 -78.08 -49.72 13.41 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.756 -0.657 . . . . 2.03 110.593 178.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 38.9 mtt -67.9 -13.71 62.37 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.82 -0.627 . . . . 1.52 110.84 179.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 23.7 tpt180 -44.11 -21.33 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.734 -0.666 . . . . 5.25 112.196 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -51.54 -27.1 9.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.71 0.291 . . . . 4.01 111.624 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 9.2 t -62.32 -44.33 96.75 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.318 0.488 . . . . 5.71 112.318 -178.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -80.04 -65.11 1.05 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.608 0.242 . . . . 5.6 111.511 -179.613 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.566 ' O ' ' HG2' ' A' ' 85' ' ' MET . 91.9 m 56.67 81.66 0.13 Allowed 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.377 -0.374 . . . . 7.48 110.477 -179.296 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.412 ' HB3' ' OH ' ' A' ' 138' ' ' TYR . 32.3 mt-10 -59.27 -14.88 12.68 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 113.034 0.753 . . . . 9.74 113.034 -178.507 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -64.61 -56.71 12.14 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 120.821 0.344 . . . . 12.11 111.66 -179.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -67.43 -16.55 64.29 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.134 0.492 . . . . 10.87 110.381 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' MET . . . . . 0.566 ' HG2' ' O ' ' A' ' 81' ' ' THR . 7.1 mmm -80.36 -34.96 36.09 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.646 -0.706 . . . . 11.09 109.768 -179.702 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 17.8 ttm180 -65.82 -42.6 90.42 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.643 -0.708 . . . . 16.05 109.512 179.039 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.418 ' HA ' ' HE3' ' A' ' 90' ' ' LYS . 1.9 tm-20 -59.87 -47.43 85.77 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 109.272 -0.64 . . . . 14.85 109.272 178.62 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.79 -26.08 68.19 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.59 -0.732 . . . . 14.11 110.553 179.155 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -69.77 -38.22 76.65 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.203 -0.453 . . . . 16.42 110.229 179.481 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.588 ' HZ1' ' HB2' ' A' ' 90' ' ' LYS . 9.6 mtmp? -63.09 -48.79 77.09 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.929 -0.578 . . . . 17.66 110.416 179.57 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 84.1 mt -61.21 -46.25 96.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.179 -0.464 . . . . 18.15 110.882 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.493 ' HA ' HG23 ' A' ' 108' ' ' VAL . 0.9 OUTLIER -60.43 -39.91 89.16 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.147 -0.478 . . . . 18.34 111.132 -179.871 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 36.7 t0 -72.83 95.54 1.95 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.943 0.401 . . . . 19.29 110.0 179.425 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.421 ' HG3' ' HA ' ' A' ' 104' ' ' GLU . 0.6 OUTLIER -56.75 -16.25 6.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.754 -0.657 . . . . 22.47 111.177 -179.366 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . 0.423 ' HB2' ' OD1' ' A' ' 97' ' ' ASP . 24.2 m-20 -118.14 169.43 9.69 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.94 0.4 . . . . 23.34 110.859 179.73 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.27 5.4 57.45 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.869 -0.681 . . . . 22.77 112.342 179.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.423 ' OD1' ' HB2' ' A' ' 95' ' ' ASP . 5.7 p-10 -62.0 -41.69 98.33 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.716 0.293 . . . . 23.0 111.147 -179.758 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 117.69 10.94 8.9 Favored Glycine 0 C--N 1.332 0.335 0 C-N-CA 120.717 -0.754 . . . . 20.02 112.767 179.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -137.87 150.84 47.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.786 0.327 . . . . 20.56 110.948 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 46.6 mt -114.81 139.44 40.97 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.141 0 CA-C-N 116.253 -0.43 . . . . 19.37 111.315 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 74.2 m -114.53 156.24 44.9 Favored Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 115.894 -0.594 . . . . 22.65 110.045 179.512 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_exo -44.16 -36.3 8.71 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.304 2.003 . . . . 23.78 112.846 -179.43 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.63 -39.72 88.41 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.223 0.535 . . . . 25.0 110.884 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . 0.421 ' HA ' ' HG3' ' A' ' 94' ' ' ARG . 42.1 mt-10 -74.51 -44.65 50.31 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.409 -0.814 . . . . 22.31 110.202 -179.847 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.452 HD21 ' HB ' ' A' ' 121' ' ' ILE . 2.8 tp -54.32 -51.66 63.98 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.232 -0.894 . . . . 20.62 110.246 179.733 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.446 ' HA ' ' HE2' ' A' ' 109' ' ' MET . 10.7 ttt85 -57.07 -55.24 37.32 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.337 -0.847 . . . . 27.9 111.633 -179.749 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 36.0 t80 -46.11 -44.35 15.6 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.102 -0.499 . . . . 25.96 112.32 -178.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.493 HG23 ' HA ' ' A' ' 92' ' ' PHE . 23.0 t -69.62 -54.55 18.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 N-CA-C 112.235 0.457 . . . . 21.06 112.235 -178.706 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.446 ' HE2' ' HA ' ' A' ' 106' ' ' ARG . 62.3 mtm -52.51 -37.38 57.31 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 120.886 0.374 . . . . 20.93 110.531 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 72.5 mt -64.88 -36.47 77.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.987 -0.552 . . . . 25.52 110.162 178.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 14.4 m120 -67.31 -34.92 78.39 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.844 -0.616 . . . . 23.32 110.504 179.448 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 69.5 mt -72.0 -40.83 68.24 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.875 -0.602 . . . . 21.07 110.825 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 129.51 -3.48 6.18 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.759 -0.734 . . . . 23.25 112.557 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -86.94 93.92 9.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.679 0.276 . . . . 22.59 110.984 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -64.7 119.34 10.38 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.274 -0.421 . . . . 28.21 110.635 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 4.8 m -137.89 154.9 29.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.992 -0.549 . . . . 24.75 111.398 -179.638 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 71.3 p -98.12 147.37 24.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.804 -0.634 . . . . 27.5 110.576 179.463 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . 0.425 ' HA ' HG12 ' A' ' 121' ' ' ILE . 21.3 m-20 -53.7 -21.42 7.04 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.23 -0.441 . . . . 27.03 111.065 -179.908 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -80.5 -50.41 10.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.257 -0.429 . . . . 29.14 111.106 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.3 -33.62 75.91 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.265 -0.425 . . . . 24.7 111.121 -179.483 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.452 ' HB ' HD21 ' A' ' 105' ' ' LEU . 32.6 pt -79.17 -35.08 16.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.399 -0.364 . . . . 22.9 110.946 -179.892 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.433 ' N ' HG13 ' A' ' 121' ' ' ILE . 14.8 t70 -62.13 -32.0 72.54 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.041 0.448 . . . . 24.29 109.827 179.307 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -72.79 -47.08 49.61 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.763 -0.653 . . . . 24.74 110.203 179.278 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 49.3 ttp -55.62 -40.13 71.7 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.977 -0.556 . . . . 20.15 110.526 179.375 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.447 HG22 HD11 ' A' ' 136' ' ' ILE . 85.7 mt -65.89 -41.85 90.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.089 -0.505 . . . . 20.23 110.27 179.33 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 56.1 ttt180 -59.76 -31.96 70.14 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.697 -0.683 . . . . 25.57 110.826 179.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -77.79 -28.18 50.39 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.142 -0.481 . . . . 19.18 111.101 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.593 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -92.7 -14.13 28.44 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.17 -0.468 . . . . 16.88 111.029 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . 0.43 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 30.0 t70 -100.86 106.64 18.03 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.045 -0.525 . . . . 20.4 110.613 -179.798 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 74.1 m-85 -93.4 -41.83 9.61 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.739 -0.664 . . . . 21.43 111.499 -179.351 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -56.19 -26.17 49.82 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.417 -0.356 . . . . 23.37 111.021 -179.76 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 76.26 62.85 2.5 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.879 -0.677 . . . . 24.32 112.432 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . 0.401 ' OD2' ' HB2' ' A' ' 135' ' ' MET . 3.3 p-10 -130.35 -0.73 4.51 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.69 0.281 . . . . 24.4 111.258 -179.697 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 66.98 18.2 68.54 Favored Glycine 0 C--N 1.33 0.245 0 C-N-CA 120.814 -0.708 . . . . 23.47 112.731 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' MET . . . . . 0.401 ' HB2' ' OD2' ' A' ' 133' ' ' ASP . 68.4 mtp -134.3 155.36 50.35 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 110.183 -0.303 . . . . 22.91 110.183 179.857 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.515 HG23 ' HB2' ' A' ' 140' ' ' GLU . 47.5 mm -114.12 145.59 19.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 121.497 0.665 . . . . 18.67 112.119 -179.089 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . 0.498 HD21 ' H ' ' A' ' 139' ' ' GLU . 6.5 t30 -118.64 158.41 25.53 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 114.901 -1.045 . . . . 16.97 108.922 178.508 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.412 ' OH ' ' HB3' ' A' ' 82' ' ' GLU . 8.2 t80 -38.72 -26.6 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 112.009 0.374 . . . . 15.28 112.009 -179.664 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.498 ' H ' HD21 ' A' ' 137' ' ' ASN . 45.4 mt-10 -80.68 -55.85 4.55 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.774 0.321 . . . . 14.82 111.097 -179.546 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.515 ' HB2' HG23 ' A' ' 136' ' ' ILE . 27.5 mt-10 -60.87 -24.41 65.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.164 0.507 . . . . 17.46 110.214 179.712 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.58 ' HA ' ' HE3' ' A' ' 144' ' ' MET . 86.6 t80 -74.0 -55.56 5.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.556 -0.747 . . . . 13.65 110.527 179.857 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . 0.402 HG22 ' O ' ' A' ' 138' ' ' TYR . 42.9 t -48.63 -37.0 7.9 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 CA-C-N 115.9 -0.591 . . . . 11.12 111.417 179.499 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 76.8 t90 -70.57 -55.0 9.87 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.265 0.469 . . . . 14.4 112.265 -179.165 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' MET . . . . . 0.593 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 24.6 ptt? -65.13 -22.22 66.9 Favored 'General case' 0 N--CA 1.464 0.274 0 N-CA-C 113.339 0.866 . . . . 14.63 113.339 -177.611 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . 0.623 ' HA ' ' HB2' ' A' ' 148' ' ' LYS . 39.6 pt -80.55 -44.6 21.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 C-N-CA 120.751 -0.38 . . . . 11.62 111.833 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 146' ' ' SER . . . . . 0.518 ' N ' HG13 ' A' ' 145' ' ' ILE . 78.7 p -64.29 -14.19 54.41 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-O 121.448 0.642 . . . . 8.66 109.59 179.629 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 147' ' ' GLN . . . . . 0.485 HE21 ' HG ' ' A' ' 146' ' ' SER . 8.0 mm-40 -125.35 19.93 8.11 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 114.967 -1.015 . . . . 11.87 110.245 -179.417 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . 0.623 ' HB2' ' HA ' ' A' ' 145' ' ' ILE . 16.5 ttpp . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.267 -0.873 . . . . 13.97 111.069 -179.451 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 149' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 151' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.524 ' HB3' ' HB3' ' A' ' 76' ' ' MET . 47.7 t . . . . . 0 N--CA 1.485 1.323 0 CA-C-O 120.781 0.324 . . . . 5.2 110.906 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -133.73 138.98 46.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.106 -0.497 . . . . 3.26 110.544 -179.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 65.2 mt -59.14 95.49 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.209 -0.451 . . . . 2.0 110.898 -179.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 67.6 p -87.01 -165.55 1.32 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.242 -0.435 . . . . 1.72 111.15 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -73.78 -39.78 63.92 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.991 0.424 . . . . 2.2 110.762 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -74.46 -41.13 61.32 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.827 -0.624 . . . . 1.35 110.813 -179.665 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 -63.74 -49.39 73.2 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.164 -0.471 . . . . 2.34 110.79 179.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.522 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 63.8 mt -55.95 -52.44 49.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.445 -0.343 . . . . 1.27 110.882 179.76 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.86 -21.54 66.82 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.38 -0.373 . . . . 1.22 111.371 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -71.23 -56.75 5.41 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 116.441 -0.345 . . . . 2.27 111.923 -179.181 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.522 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 17.9 p90 -78.51 -26.11 45.81 Favored 'General case' 0 C--N 1.332 -0.154 0 C-N-CA 120.579 -0.448 . . . . 0.46 110.931 -179.666 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 49.9 tptt -66.15 -34.95 79.22 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.348 -0.612 . . . . 1.85 109.348 178.769 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.432 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 24.8 t70 -68.83 -50.94 45.84 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.349 -0.612 . . . . 0.44 109.349 178.489 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.58 -14.3 57.1 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.823 -0.626 . . . . 1.08 110.445 178.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -80.09 -44.38 20.1 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.816 -0.629 . . . . 0.56 111.016 -179.442 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 34.2 m -73.45 -22.75 19.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.336 -0.393 . . . . 1.69 111.021 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.432 ' HG2' ' O ' ' A' ' 14' ' ' ASP . 82.5 mm-40 -63.21 -34.16 77.05 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.137 -0.483 . . . . 2.23 111.201 179.74 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 46.9 m-85 -86.95 -13.38 44.79 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.473 -0.331 . . . . 0.69 111.579 -179.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -90.35 87.62 6.88 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.832 0.349 . . . . 0.46 110.596 179.777 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 70.4 mmtt -95.0 -19.78 19.91 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.078 -0.51 . . . . 2.55 111.292 -179.605 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -78.59 -42.29 29.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.252 -0.431 . . . . 1.8 111.204 -179.669 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.95 3.94 29.77 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.649 -0.786 . . . . 0.54 112.735 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 49.4 p -73.06 1.09 9.69 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.628 0.251 . . . . 1.1 111.216 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 61.6 23.73 63.24 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.503 -0.856 . . . . 0.37 111.679 -179.369 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.641 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 28.9 mtpt -133.83 155.76 49.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.817 0.341 . . . . 1.75 111.065 -179.748 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.535 HG13 ' HB3' ' A' ' 63' ' ' LEU . 23.3 pt -117.41 131.77 69.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.108 -0.496 . . . . 1.2 111.714 -179.257 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -54.97 130.46 41.63 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.27 -0.423 . . . . 1.04 110.974 179.599 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 81.5 p -62.68 -22.46 66.49 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.154 -0.475 . . . . 1.71 111.13 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 52.6 mtp180 -73.25 -18.03 61.27 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.087 -0.506 . . . . 3.53 110.41 179.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -102.6 0.85 33.95 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.75 -0.659 . . . . 2.26 110.595 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.401 HD21 HD21 ' A' ' 63' ' ' LEU . 0.5 OUTLIER -60.07 -52.44 65.36 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.939 -0.573 . . . . 1.95 110.646 -179.818 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -54.12 -39.54 64.04 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.628 -0.796 . . . . 0.32 111.799 179.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.4 ' O ' HG21 ' A' ' 38' ' ' THR . 60.7 m -70.04 -28.11 65.21 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.021 0.439 . . . . 1.01 110.559 179.462 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 52.4 tp -72.23 -34.41 68.3 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.66 -0.7 . . . . 1.85 111.526 -179.324 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.437 ' SD ' ' HG3' ' A' ' 43' ' ' PRO . 26.7 mtp -80.4 -29.02 37.73 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.439 -0.346 . . . . 1.43 110.8 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 76.3 mtp180 -68.21 -41.86 80.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.269 -0.423 . . . . 3.27 110.466 179.557 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.414 HG23 ' CD1' ' A' ' 39' ' ' LEU . 1.8 t -66.13 -13.07 59.54 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.153 -0.476 . . . . 1.54 111.006 179.51 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.414 ' CD1' HG23 ' A' ' 38' ' ' THR . 10.5 mp -113.12 156.06 23.84 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.982 -0.553 . . . . 1.94 110.553 179.574 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -42.32 -33.48 1.38 Allowed Glycine 0 CA--C 1.52 0.378 0 C-N-CA 121.305 -0.474 . . . . 0.69 113.817 -179.173 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 24.8 mp0 -52.52 143.7 15.06 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.883 0.373 . . . . 1.97 111.282 -179.544 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -133.43 72.75 74.45 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 115.886 -0.597 . . . . 3.44 110.869 179.706 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.437 ' HG3' ' SD ' ' A' ' 36' ' ' MET . 28.0 Cg_endo -60.54 150.08 83.43 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.814 2.343 . . . . 0.59 112.482 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.3 m -78.61 159.92 27.83 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.191 -0.458 . . . . 1.28 110.456 179.662 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -59.52 -55.23 37.17 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.768 0.318 . . . . 2.7 111.242 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.0 -49.18 77.08 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.303 -0.408 . . . . 1.15 111.459 -179.725 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.436 ' O ' HD22 ' A' ' 51' ' ' LEU . 42.2 tt0 -55.06 -43.95 74.31 Favored 'General case' 0 CA--C 1.518 -0.25 0 CA-C-N 116.322 -0.399 . . . . 2.23 110.086 -179.798 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.459 ' HA ' HD23 ' A' ' 51' ' ' LEU . 55.9 tp -56.55 -44.78 81.25 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.577 -0.738 . . . . 2.01 110.806 179.765 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -70.59 -25.55 63.12 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.081 -0.509 . . . . 1.68 111.251 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -68.6 -51.54 41.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.539 -0.3 . . . . 0.62 111.39 179.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.459 HD23 ' HA ' ' A' ' 48' ' ' LEU . 0.9 OUTLIER -70.64 -36.14 73.25 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.502 -0.317 . . . . 1.11 111.363 -179.643 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 75.8 mt -65.68 -46.03 90.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.459 -0.337 . . . . 1.25 111.033 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.56 -34.45 78.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.393 -0.367 . . . . 1.24 110.882 179.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -65.12 -47.12 78.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.136 -0.484 . . . . 2.54 110.691 179.778 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -79.0 -14.62 59.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.139 -0.482 . . . . 1.19 111.383 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -71.33 -37.47 71.72 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.265 -0.425 . . . . 1.95 111.391 -179.556 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 30.5 p-10 -106.91 10.73 30.47 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.503 -0.317 . . . . 3.19 111.654 -179.372 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 24.0 t-20 -125.87 -11.99 6.54 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.91 0.386 . . . . 2.69 110.939 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -138.42 18.8 2.74 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.089 -0.505 . . . . 2.05 110.599 179.764 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 21.6 m-80 64.6 -80.26 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 115.672 -0.694 . . . . 1.67 111.544 179.666 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -153.93 4.1 0.29 Allowed Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.502 -0.856 . . . . 0.86 112.681 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.641 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -118.46 155.3 31.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.011 0.434 . . . . 0.49 111.271 179.88 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.637 ' HG ' ' HB2' ' A' ' 67' ' ' GLU . 2.4 tp -126.64 155.21 42.92 Favored 'General case' 0 C--O 1.223 -0.304 0 CA-C-N 115.778 -0.647 . . . . 2.05 110.554 -179.389 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . 0.456 ' OD1' ' HE3' ' A' ' 26' ' ' LYS . 0.7 OUTLIER -110.43 155.58 22.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.893 0.377 . . . . 1.52 111.3 -179.113 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 82.0 t80 -44.93 -46.07 10.79 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.618 -0.719 . . . . 0.46 111.424 179.869 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -64.3 -33.89 76.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.433 -0.349 . . . . 1.41 111.926 -179.594 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.637 ' HB2' ' HG ' ' A' ' 63' ' ' LEU . 12.3 mm-40 -63.18 -55.84 21.73 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.778 0.323 . . . . 1.36 110.446 179.901 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.442 ' HE2' ' HB2' ' A' ' 12' ' ' PHE . 41.6 t80 -59.93 -49.36 77.99 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.262 -0.426 . . . . 0.61 110.337 179.142 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 1.7 t -53.22 -45.25 68.61 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.131 -0.486 . . . . 1.41 110.305 179.548 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -51.5 -47.14 52.24 Favored Glycine 0 N--CA 1.448 -0.512 0 N-CA-C 111.103 -0.799 . . . . 0.41 111.103 179.135 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.479 ' HA ' ' HG2' ' A' ' 74' ' ' LYS . 14.1 mt -63.96 -40.99 91.05 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.45 0 CA-C-O 120.851 0.358 . . . . 1.13 110.664 179.104 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' MET . . . . . 0.425 ' HG2' ' O ' ' A' ' 68' ' ' PHE . 95.3 mmm -51.82 -41.76 61.99 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.986 -0.552 . . . . 1.24 109.659 179.346 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.84 -55.35 35.26 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.561 -0.745 . . . . 1.17 110.938 179.12 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.479 ' HG2' ' HA ' ' A' ' 71' ' ' ILE . 21.8 pttp -64.15 -25.95 68.31 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.422 -0.354 . . . . 1.91 111.715 -179.411 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -81.92 -33.7 30.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.352 0.596 . . . . 2.03 110.55 -179.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' MET . . . . . 0.524 ' HB3' ' HB3' ' A' ' 2' ' ' SER . 54.7 mtt -74.12 -19.45 60.57 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.055 -0.975 . . . . 1.52 111.053 -179.614 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 28.9 mmt180 -54.04 -19.0 4.14 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.112 -0.495 . . . . 5.25 111.785 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -120.8 86.53 2.59 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.843 0.354 . . . . 4.01 111.802 -179.595 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' THR . . . . . 0.461 HG21 ' O ' ' A' ' 76' ' ' MET . 14.9 t -176.31 2.01 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.104 -0.498 . . . . 5.71 110.939 179.483 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.4 p-10 -70.09 -63.51 1.07 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.129 -0.487 . . . . 5.6 111.489 -179.762 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.568 ' O ' ' HG2' ' A' ' 85' ' ' MET . 52.7 m 58.33 91.66 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.11 0 CA-C-N 116.352 -0.385 . . . . 7.48 110.374 -179.275 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -68.44 -25.12 64.85 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 112.857 0.688 . . . . 9.74 112.857 -178.478 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 -54.35 -55.79 25.03 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 111.957 0.354 . . . . 12.11 111.957 -178.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -63.97 -20.82 66.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.949 0.404 . . . . 10.87 111.065 -179.743 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' MET . . . . . 0.568 ' HG2' ' O ' ' A' ' 81' ' ' THR . 4.7 mmm -79.89 -25.67 40.54 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.07 -0.514 . . . . 11.09 110.175 -179.336 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 29.2 ttt180 -74.19 -50.09 20.72 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.517 -0.765 . . . . 16.05 109.754 179.619 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -59.86 -36.45 76.9 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.826 -0.624 . . . . 14.85 109.512 178.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -72.16 -35.5 69.05 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-N 115.663 -0.698 . . . . 14.11 110.897 179.249 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -67.76 -20.57 65.24 Favored 'General case' 0 CA--C 1.52 -0.183 0 CA-C-O 121.326 0.584 . . . . 16.42 110.093 179.49 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 15.6 tttt -79.91 -47.13 15.55 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 115.298 -0.865 . . . . 17.66 110.169 179.775 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 73.7 mt -64.29 -43.47 97.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.496 -0.775 . . . . 18.15 111.111 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -66.82 -52.66 41.13 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.271 -0.422 . . . . 18.34 111.025 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -59.63 99.83 0.07 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.303 -0.408 . . . . 19.29 110.386 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.503 ' HG2' ' HB3' ' A' ' 104' ' ' GLU . 22.4 mmm180 -53.04 -37.2 61.37 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.859 -0.61 . . . . 22.47 111.316 -179.393 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -107.84 -176.73 3.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.9 0.381 . . . . 23.34 111.09 -179.697 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.77 4.26 56.25 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.944 -0.646 . . . . 22.77 112.631 179.754 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -63.66 -31.25 72.37 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.64 0.257 . . . . 23.0 111.29 -179.761 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 92.89 35.18 6.49 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.791 -0.718 . . . . 20.02 112.83 179.771 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . 0.416 ' HA ' ' O ' ' A' ' 136' ' ' ILE . 96.6 m-85 -147.54 142.27 26.7 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.638 0.256 . . . . 20.56 110.811 179.857 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 59.6 mt -114.35 125.83 71.74 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.162 0 CA-C-O 121.054 0.454 . . . . 19.37 110.998 179.672 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 23.5 p -114.48 156.07 45.07 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 115.793 -0.639 . . . . 22.65 110.626 -179.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_exo -39.95 -35.61 1.16 Allowed 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.608 2.206 . . . . 23.78 112.681 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.07 -53.43 25.63 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.254 -0.43 . . . . 25.0 110.973 179.782 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . 0.503 ' HB3' ' HG2' ' A' ' 94' ' ' ARG . 46.8 mt-10 -62.29 -38.78 90.66 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.872 -0.604 . . . . 22.31 110.55 179.87 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.464 HD23 ' HB ' ' A' ' 121' ' ' ILE . 39.9 tp -64.48 -35.6 81.47 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.541 -0.754 . . . . 20.62 110.869 -179.892 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 10.4 ttp180 -63.97 -52.53 59.25 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.343 -0.389 . . . . 27.9 110.858 179.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 35.7 t80 -54.27 -47.92 71.79 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.088 -0.506 . . . . 25.96 111.563 -179.407 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 7.7 p -70.77 -46.98 66.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 N-CA-C 112.144 0.424 . . . . 21.06 112.144 -179.14 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.424 ' HG3' ' HG ' ' A' ' 105' ' ' LEU . 0.4 OUTLIER -57.2 -20.68 28.37 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 111.728 0.27 . . . . 20.93 111.728 -179.018 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.574 ' HA ' ' HA ' ' A' ' 114' ' ' GLU . 83.0 mt -82.67 -28.71 8.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 120.943 0.402 . . . . 25.52 110.353 178.915 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -73.87 -36.21 64.79 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.103 -0.499 . . . . 23.32 109.904 178.765 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.454 HD11 ' N ' ' A' ' 112' ' ' LEU . 7.0 mp -85.85 -41.69 14.78 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.648 -0.705 . . . . 21.07 109.762 179.223 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -148.93 80.83 0.2 Allowed Glycine 0 C--N 1.33 0.235 0 CA-C-N 115.33 -0.85 . . . . 23.25 111.769 179.498 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . 0.574 ' HA ' ' HA ' ' A' ' 110' ' ' ILE . 0.0 OUTLIER -48.14 160.48 0.15 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.064 0.459 . . . . 22.59 112.136 -179.356 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 23.6 ttmm 70.67 62.97 0.19 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.238 -0.892 . . . . 28.21 111.858 179.488 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . 0.472 HG12 ' OE1' ' A' ' 120' ' ' GLU . 1.6 m -125.81 114.73 40.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.165 -0.47 . . . . 24.75 110.625 178.286 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' THR . . . . . 0.401 ' HG1' ' HG2' ' A' ' 120' ' ' GLU . 72.7 p -67.51 147.42 52.84 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.295 -0.411 . . . . 27.5 110.419 179.8 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 28.8 m-20 -56.3 -14.73 3.09 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.208 -0.451 . . . . 27.03 110.581 179.804 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -79.7 -55.17 5.2 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.032 -0.531 . . . . 29.14 111.249 -179.876 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . 0.472 ' OE1' HG12 ' A' ' 116' ' ' VAL . 14.0 pt-20 -58.57 -42.56 88.25 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.748 -0.205 . . . . 24.7 111.46 -179.576 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.528 HG13 ' H ' ' A' ' 122' ' ' ASP . 2.7 pt -68.37 -42.92 84.5 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-O 120.643 0.259 . . . . 22.9 111.144 179.487 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.528 ' H ' HG13 ' A' ' 121' ' ' ILE . 17.8 t70 -60.24 -40.42 90.17 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.826 0.346 . . . . 24.29 110.444 179.666 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -58.34 -46.05 86.96 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.002 -0.545 . . . . 24.74 110.201 179.382 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.416 ' HE3' HD21 ' A' ' 105' ' ' LEU . 58.9 ttp -55.54 -37.17 67.62 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.214 -0.448 . . . . 20.15 110.328 179.195 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.438 HG23 HD11 ' A' ' 136' ' ' ILE . 78.6 mt -65.92 -42.38 91.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.049 -0.523 . . . . 20.23 110.337 179.341 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 21.4 tpp180 -63.43 -25.26 68.19 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.806 -0.634 . . . . 25.57 111.042 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -78.53 -30.02 46.81 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.229 -0.441 . . . . 19.18 111.308 -179.535 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.641 ' HB1' ' HB3' ' A' ' 144' ' ' MET . . . -99.73 -12.39 20.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.309 -0.405 . . . . 16.88 111.479 -179.689 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . 0.444 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 25.4 t0 -100.68 104.03 15.31 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.977 0.418 . . . . 20.4 110.906 -179.615 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 88.1 m-85 -82.79 -39.46 21.74 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.962 -0.563 . . . . 21.43 111.174 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -69.07 -13.35 62.39 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.381 -0.372 . . . . 23.37 111.007 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 47.63 82.38 0.03 OUTLIER Glycine 0 C--N 1.331 0.256 0 C-N-CA 121.19 -0.528 . . . . 24.32 113.212 179.629 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -133.22 -24.49 1.84 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.846 0.355 . . . . 24.4 110.617 179.579 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 105.84 10.62 30.16 Favored Glycine 0 C--N 1.332 0.321 0 C-N-CA 120.794 -0.717 . . . . 23.47 112.562 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 91.1 mmm -135.37 150.42 49.92 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.805 0.336 . . . . 22.91 110.756 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.531 HG23 ' HB2' ' A' ' 140' ' ' GLU . 46.9 mm -114.83 141.17 32.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.037 0.446 . . . . 18.67 111.486 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . 0.451 ' O ' ' N ' ' A' ' 139' ' ' GLU . 29.2 p-10 -114.78 157.51 23.13 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.002 -0.74 . . . . 16.97 109.002 178.405 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 42.4 t80 -40.59 -21.51 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 111.97 0.359 . . . . 15.28 111.97 -179.754 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.451 ' N ' ' O ' ' A' ' 137' ' ' ASN . 44.2 mt-10 -80.76 -56.76 3.92 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.786 0.327 . . . . 14.82 111.261 -179.615 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.531 ' HB2' HG23 ' A' ' 136' ' ' ILE . 45.5 mt-10 -61.16 -29.82 70.02 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 121.0 0.429 . . . . 17.46 110.102 179.93 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.563 ' HA ' ' HE1' ' A' ' 144' ' ' MET . 83.9 t80 -67.09 -55.52 13.93 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.848 -0.614 . . . . 13.65 110.186 179.403 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . 0.562 ' HA ' HD11 ' A' ' 145' ' ' ILE . 42.9 t -51.42 -30.77 11.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.667 -0.697 . . . . 11.12 111.392 179.811 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 143' ' ' TRP . . . . . 0.462 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 90.3 t90 -70.65 -55.84 7.82 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.496 0.554 . . . . 14.4 112.496 -179.122 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 144' ' ' MET . . . . . 0.641 ' HB3' ' HB1' ' A' ' 128' ' ' ALA . 18.8 ptt? -63.48 -28.79 70.2 Favored 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 113.272 0.842 . . . . 14.63 113.272 -177.771 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . 0.562 HD11 ' HA ' ' A' ' 142' ' ' VAL . 42.8 pt -80.76 -35.9 15.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 112.383 0.512 . . . . 11.62 112.383 -179.304 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 146' ' ' SER . . . . . 0.475 ' N ' HG13 ' A' ' 145' ' ' ILE . 42.0 t -60.69 -14.12 18.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.198 0.523 . . . . 8.66 110.432 -179.679 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 147' ' ' GLN . . . . . 0.462 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 4.0 mm-40 -101.04 -16.22 17.19 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.362 -0.835 . . . . 11.87 111.089 -179.053 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 65.1 mttm . . . . . 0 C--O 1.25 1.111 0 CA-C-O 118.296 -0.859 . . . . 13.97 110.829 179.685 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 149' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 151' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 76.4 p . . . . . 0 N--CA 1.486 1.334 0 CA-C-O 120.834 0.35 . . . . 5.2 110.881 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -80.95 167.17 20.15 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.223 -0.444 . . . . 3.26 110.89 179.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.5 mp -53.12 102.64 0.06 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.956 -0.565 . . . . 2.0 110.961 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.487 ' H ' HE21 ' A' ' 8' ' ' GLN . 6.8 m -90.49 158.89 16.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.034 -0.53 . . . . 1.72 110.565 179.853 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -47.34 -42.83 22.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.709 0.29 . . . . 2.2 111.63 -179.651 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -73.32 -41.41 63.56 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.033 0.444 . . . . 1.35 111.005 -179.476 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . 0.487 HE21 ' H ' ' A' ' 5' ' ' THR . 24.1 mt-30 -63.99 -40.43 96.36 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.833 -0.622 . . . . 2.34 111.001 -179.879 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.48 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 89.2 mt -62.11 -50.79 78.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.117 -0.492 . . . . 1.27 110.628 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.41 -24.81 67.6 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.001 -0.545 . . . . 1.22 111.366 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -69.91 -56.35 7.27 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.39 -0.368 . . . . 2.27 111.939 -179.033 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.48 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 10.5 p90 -78.4 -28.07 46.81 Favored 'General case' 0 C--N 1.332 -0.155 0 C-N-CA 120.603 -0.439 . . . . 0.46 111.009 -179.532 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 21.2 tptm -62.65 -35.62 80.2 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.153 -0.684 . . . . 1.85 109.153 178.669 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.47 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 33.1 t70 -69.44 -50.12 48.66 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 115.706 -0.679 . . . . 0.44 109.179 178.315 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.27 -17.67 54.63 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.68 -0.691 . . . . 1.08 110.574 179.058 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -77.96 -48.21 16.78 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.003 -0.544 . . . . 0.56 110.638 -179.495 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 23.3 m -70.32 -15.85 19.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.146 -0.479 . . . . 1.69 110.532 179.648 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.47 ' HG3' ' O ' ' A' ' 14' ' ' ASP . 73.2 mt-30 -64.01 -44.53 92.3 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.787 -0.642 . . . . 2.23 111.111 179.326 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -90.39 31.16 1.04 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.16 -0.473 . . . . 0.69 111.71 -179.298 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -118.96 70.96 0.84 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.001 0.429 . . . . 0.46 110.4 179.284 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 33.7 mmtp -76.5 -17.63 59.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.866 -0.606 . . . . 2.55 111.205 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -83.05 -10.94 58.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.212 -0.449 . . . . 1.8 110.907 -179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 65.44 14.3 59.72 Favored Glycine 0 C--N 1.33 0.236 0 C-N-CA 120.869 -0.681 . . . . 0.54 112.648 179.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 30.0 p -83.74 11.86 6.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.671 0.272 . . . . 1.1 111.205 -179.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 56.22 18.88 22.3 Favored Glycine 0 C--N 1.332 0.361 0 C-N-CA 120.709 -0.758 . . . . 0.37 111.596 -179.383 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.601 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 51.7 mtpt -135.43 155.26 50.84 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.501 -0.35 . . . . 1.75 110.334 -179.488 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 42.4 pt -120.9 140.65 44.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.871 0.367 . . . . 1.2 111.286 -179.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -57.97 135.95 57.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.153 -0.476 . . . . 1.04 110.612 179.651 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 5.7 t -64.69 -8.56 15.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.19 -0.459 . . . . 1.71 110.994 179.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 43.5 mtt180 -89.76 -11.21 42.89 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.043 -0.526 . . . . 3.53 110.851 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -107.57 -4.58 18.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.92 -0.582 . . . . 2.26 110.908 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.587 HD22 HD23 ' A' ' 63' ' ' LEU . 1.4 tm? -57.72 -51.0 71.32 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.355 -0.384 . . . . 1.95 110.311 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -53.59 -42.71 67.25 Favored Glycine 0 C--N 1.332 0.344 0 C-N-CA 120.617 -0.801 . . . . 0.32 111.692 179.438 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 94.9 m -63.88 -36.07 82.73 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.226 0.536 . . . . 1.01 109.868 179.038 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 38.8 tp -65.94 -24.05 66.74 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.369 -0.832 . . . . 1.85 110.773 -179.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.452 ' HG2' ' O ' ' A' ' 32' ' ' LEU . 79.9 mmm -80.36 -37.87 31.53 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.252 -0.431 . . . . 1.43 110.19 179.346 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 69.6 mtp180 -59.64 -44.34 93.53 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.942 -0.572 . . . . 3.27 110.964 179.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.436 HG21 HD12 ' A' ' 39' ' ' LEU . 1.3 t -64.23 -13.52 49.61 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.235 -0.439 . . . . 1.54 111.321 179.835 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.436 HD12 HG21 ' A' ' 38' ' ' THR . 10.8 mp -113.75 156.14 24.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.115 -0.493 . . . . 1.94 110.412 179.365 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -58.35 -5.69 2.67 Favored Glycine 0 CA--C 1.518 0.255 0 CA-C-N 116.014 -0.539 . . . . 0.69 113.759 -178.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 15.9 mp0 -88.29 130.91 34.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 117.107 0.453 . . . . 1.97 110.972 179.746 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -131.88 87.05 46.06 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.092 -0.503 . . . . 3.44 110.775 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -70.47 151.37 64.98 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 122.511 2.141 . . . . 0.59 112.275 -179.839 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 27.4 m -64.35 150.06 46.99 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.22 -0.445 . . . . 1.28 110.738 179.746 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -48.07 -54.51 12.86 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.562 -0.29 . . . . 2.7 111.336 -179.631 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.57 -53.27 54.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.264 -0.426 . . . . 1.15 111.745 -179.574 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -53.79 -46.03 70.9 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-O 120.938 0.399 . . . . 2.23 110.446 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.486 ' HA ' HD22 ' A' ' 51' ' ' LEU . 32.5 tp -57.27 -42.69 82.12 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.741 -0.663 . . . . 2.01 110.71 179.837 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -68.46 -30.19 69.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.227 -0.442 . . . . 1.68 111.095 -179.8 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -68.45 -53.55 22.81 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.382 -0.372 . . . . 0.62 110.965 179.551 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.539 HD11 HD13 ' A' ' 71' ' ' ILE . 1.0 OUTLIER -65.38 -34.87 79.34 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.318 -0.401 . . . . 1.11 110.979 179.931 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 34.9 mt -59.78 -44.73 94.58 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.134 0 CA-C-N 116.523 -0.308 . . . . 1.25 110.458 179.467 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.68 -32.47 73.81 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.236 -0.438 . . . . 1.24 110.53 179.624 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -66.53 -46.04 77.48 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.007 -0.542 . . . . 2.54 110.178 179.352 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . 0.407 ' HB3' ' HB3' ' A' ' 63' ' ' LEU . . . -76.21 -20.76 57.17 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.014 -0.539 . . . . 1.19 111.078 179.585 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -80.35 -31.74 37.89 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.277 -0.42 . . . . 1.95 110.985 -179.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -91.98 -12.95 31.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.053 -0.522 . . . . 3.19 110.763 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.484 ' C ' HD21 ' A' ' 58' ' ' ASN . 0.2 OUTLIER -81.2 -84.02 0.11 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.098 -0.501 . . . . 2.69 110.785 -179.852 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . 0.583 ' HB3' ' HZ1' ' A' ' 26' ' ' LYS . 15.7 m-80 -101.54 35.97 2.16 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.885 0.374 . . . . 2.05 110.805 -179.914 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.8 m120 62.27 -132.82 0.55 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.883 -0.599 . . . . 1.67 111.116 179.62 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -78.71 29.65 2.04 Favored Glycine 0 C--N 1.334 0.419 0 C-N-CA 120.638 -0.791 . . . . 0.86 112.526 -179.706 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.601 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -145.1 155.32 43.25 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.17 0.51 . . . . 0.49 111.338 179.829 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.587 HD23 HD22 ' A' ' 32' ' ' LEU . 2.1 pp -142.07 157.93 44.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.442 -0.799 . . . . 2.05 109.084 179.529 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . 0.464 ' OD1' ' HE3' ' A' ' 26' ' ' LYS . 0.7 OUTLIER -110.23 157.37 19.51 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.74 -0.384 . . . . 1.52 111.856 -177.411 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -39.28 -33.47 0.15 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.476 -0.784 . . . . 0.46 111.846 -179.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 2.8 m -64.25 -43.9 93.47 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 111.663 0.245 . . . . 1.41 111.663 -179.582 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -61.96 -55.14 32.49 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.853 0.359 . . . . 1.36 110.958 179.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -59.39 -49.7 76.78 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.041 -0.527 . . . . 0.61 111.376 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 6.3 t -61.14 -39.24 89.3 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-O 120.869 0.366 . . . . 1.41 110.692 -179.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . 0.502 ' O ' ' HB2' ' A' ' 73' ' ' ALA . . . -60.08 -42.86 98.65 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.648 -0.787 . . . . 0.41 111.85 179.783 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.539 HD13 HD11 ' A' ' 51' ' ' LEU . 64.8 mt -63.59 -51.23 72.92 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.688 0 CA-C-O 121.657 0.742 . . . . 1.13 109.294 177.997 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' MET . . . . . 0.503 ' O ' ' HB2' ' A' ' 76' ' ' MET . 14.2 mtp -53.73 -29.63 40.36 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.027 -0.988 . . . . 1.24 108.729 178.375 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.502 ' HB2' ' O ' ' A' ' 70' ' ' GLY . . . -72.14 -35.39 69.06 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.12 -0.945 . . . . 1.17 110.623 179.866 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.529 ' HG2' ' O ' ' A' ' 71' ' ' ILE . 0.1 OUTLIER -80.34 -32.83 37.75 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.338 -0.392 . . . . 1.91 111.73 -179.724 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -82.71 -42.72 17.72 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.082 0.468 . . . . 2.03 111.195 -178.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' MET . . . . . 0.503 ' HB2' ' O ' ' A' ' 72' ' ' MET . 80.7 mtp -69.89 -55.33 10.0 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.574 -0.739 . . . . 1.52 112.005 -179.299 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 80.6 mtt180 -61.4 -13.95 24.08 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.648 0.261 . . . . 5.25 111.328 -179.296 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -60.07 -17.28 38.36 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.328 -0.396 . . . . 4.01 111.381 -179.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' THR . . . . . 0.411 HG22 ' O ' ' A' ' 76' ' ' MET . 8.4 t -89.63 -15.17 33.31 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 111.953 0.353 . . . . 5.71 111.953 -179.189 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.76 -23.16 67.06 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.569 -0.287 . . . . 5.6 110.858 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.501 ' O ' ' HG2' ' A' ' 85' ' ' MET . 3.9 t 34.98 65.66 0.35 Allowed 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 116.058 -0.519 . . . . 7.48 111.298 -179.567 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -47.32 -24.23 0.72 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.51 -0.768 . . . . 9.74 112.3 -179.138 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -64.14 -55.28 22.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.753 0.311 . . . . 12.11 111.391 -179.78 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -64.03 -18.3 64.19 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.379 -0.373 . . . . 10.87 110.908 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' MET . . . . . 0.521 ' HB3' HD11 ' A' ' 145' ' ' ILE . 4.1 mmm -78.81 -48.03 15.55 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.104 -0.498 . . . . 11.09 110.059 -179.662 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 21.0 ttt180 -55.71 -39.0 70.45 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.517 -0.765 . . . . 16.05 110.134 179.272 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -65.2 -47.66 76.15 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.989 -0.551 . . . . 14.85 110.228 179.158 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -65.57 -24.26 67.05 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.057 -0.52 . . . . 14.11 111.332 179.781 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 86.7 t80 -73.83 -46.91 42.18 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.95 0.405 . . . . 16.42 110.852 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -60.65 -38.31 84.42 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.991 -0.549 . . . . 17.66 110.866 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 67.7 mt -70.98 -46.27 68.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.863 -0.608 . . . . 18.15 111.166 -179.631 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.43 ' HA ' HG21 ' A' ' 108' ' ' VAL . 0.7 OUTLIER -66.96 -26.67 66.94 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.382 -0.372 . . . . 18.34 111.099 -179.885 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 23.7 t0 -96.16 93.92 7.21 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.153 -0.476 . . . . 19.29 110.237 179.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -69.61 -11.46 60.85 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.083 -0.508 . . . . 22.47 111.354 -179.386 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 47.8 m-20 -101.71 167.75 9.9 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.341 -0.391 . . . . 23.34 110.94 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.07 5.18 57.66 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.842 -0.694 . . . . 22.77 112.072 179.513 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -70.84 -31.47 68.19 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.682 0.277 . . . . 23.0 111.267 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 92.37 27.25 15.81 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.686 -0.768 . . . . 20.02 112.519 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 90.1 m-85 -139.47 147.23 41.04 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.498 0.19 . . . . 20.56 110.632 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.449 ' HB ' ' HB ' ' A' ' 136' ' ' ILE . 71.1 mt -113.92 131.37 66.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 121.149 0.5 . . . . 19.37 111.223 179.789 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 79.4 p -114.02 157.8 41.09 Favored Pre-proline 0 C--N 1.326 -0.42 0 CA-C-N 115.509 -0.769 . . . . 22.65 110.049 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_exo -47.94 -31.55 15.9 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.068 1.845 . . . . 23.78 111.676 -179.658 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.57 -36.86 79.33 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.726 -0.67 . . . . 25.0 111.11 179.668 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -80.26 -36.68 34.23 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.938 -0.574 . . . . 22.31 109.889 -179.477 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.574 HD22 ' HB ' ' A' ' 121' ' ' ILE . 5.5 tt -62.12 -43.57 98.54 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.331 -0.85 . . . . 20.62 110.267 179.859 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.436 ' O ' HG13 ' A' ' 110' ' ' ILE . 61.1 ttt180 -65.59 -54.63 25.24 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.933 -0.576 . . . . 27.9 110.89 179.783 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 4.3 m-85 -49.38 -49.46 44.46 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.137 -0.483 . . . . 25.96 111.973 -179.454 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.43 HG21 ' HA ' ' A' ' 92' ' ' PHE . 83.6 t -64.46 -50.72 74.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.695 -0.23 . . . . 21.06 111.557 -179.475 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -53.15 -39.22 63.38 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.741 0.305 . . . . 20.93 110.739 -179.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.436 HG13 ' O ' ' A' ' 106' ' ' ARG . 82.7 mt -70.74 -29.59 38.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 120.999 0.428 . . . . 25.52 110.28 179.329 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -71.13 -39.73 71.83 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.828 -0.624 . . . . 23.32 110.741 179.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.422 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 38.2 mt -65.33 -32.57 74.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.043 -0.526 . . . . 21.07 110.664 179.879 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 126.87 -11.98 6.92 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.828 -0.701 . . . . 23.25 112.271 -179.854 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -91.06 114.49 27.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.743 0.306 . . . . 22.59 111.127 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.441 ' HD3' ' N ' ' A' ' 115' ' ' LYS . 3.8 mppt? -84.08 125.65 32.32 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.225 -0.443 . . . . 28.21 110.779 179.848 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . 0.444 HG12 ' OE1' ' A' ' 120' ' ' GLU . 2.4 m -135.57 147.27 28.79 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.241 -0.436 . . . . 24.75 111.44 -179.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' THR . . . . . 0.432 ' HG1' ' HG2' ' A' ' 120' ' ' GLU . 82.2 p -87.99 147.24 25.11 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.935 -0.575 . . . . 27.5 110.198 179.105 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -53.64 -19.93 4.63 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.259 -0.428 . . . . 27.03 111.576 -179.529 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 23.1 mm-40 -77.61 -55.69 5.15 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.01 0.374 . . . . 29.14 112.01 -179.264 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . 0.444 ' OE1' HG12 ' A' ' 116' ' ' VAL . 14.6 pt-20 -58.47 -41.69 85.82 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.636 0.255 . . . . 24.7 111.563 -179.306 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.574 ' HB ' HD22 ' A' ' 105' ' ' LEU . 45.7 pt -70.74 -33.59 53.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 C-N-CA 120.903 -0.319 . . . . 22.9 110.749 179.67 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -56.03 -50.98 69.41 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 120.768 0.318 . . . . 24.29 110.617 179.401 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.55 -43.35 99.02 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.204 -0.453 . . . . 24.74 110.736 179.797 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 51.0 ttp -54.66 -38.6 67.13 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.174 -0.466 . . . . 20.15 110.915 179.65 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.481 HG23 HD11 ' A' ' 136' ' ' ILE . 85.0 mt -68.47 -37.07 77.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.232 -0.44 . . . . 20.23 110.742 179.682 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 70.3 ttt180 -65.94 -30.08 70.59 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.155 -0.475 . . . . 25.57 110.637 179.677 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -74.67 -24.86 58.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.077 -0.511 . . . . 19.18 111.173 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.556 ' HB1' ' HB3' ' A' ' 144' ' ' MET . . . -100.58 -13.63 18.52 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.183 -0.462 . . . . 16.88 111.118 179.855 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -97.14 105.31 17.43 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.052 -0.522 . . . . 20.4 110.931 -179.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 -97.96 -33.94 11.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.931 -0.577 . . . . 21.43 111.153 -179.651 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -66.02 -13.86 60.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.365 -0.38 . . . . 23.37 110.777 -179.835 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.13 85.31 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.834 -0.698 . . . . 24.32 112.521 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -153.8 -19.53 0.14 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.661 0.267 . . . . 24.4 111.475 -179.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 87.21 16.25 61.09 Favored Glycine 0 N--CA 1.453 -0.211 0 C-N-CA 120.67 -0.776 . . . . 23.47 112.6 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 70.3 mtp -132.72 155.54 48.65 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.625 0.25 . . . . 22.91 110.539 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.481 HD11 HG23 ' A' ' 125' ' ' ILE . 50.5 mm -114.61 138.65 44.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.367 0.604 . . . . 18.67 112.076 -179.238 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . 0.48 ' N ' HG22 ' A' ' 136' ' ' ILE . 21.8 p30 -115.5 159.06 21.69 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.194 -0.912 . . . . 16.97 108.644 177.893 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 47.0 t80 -38.21 -24.67 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 112.416 0.524 . . . . 15.28 112.416 -178.789 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.472 ' N ' ' O ' ' A' ' 137' ' ' ASN . 47.2 mt-10 -80.44 -55.27 5.0 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.742 0.306 . . . . 14.82 111.19 -179.636 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -60.69 -28.4 68.6 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.319 -0.4 . . . . 17.46 110.738 -179.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.589 ' HA ' ' HE3' ' A' ' 144' ' ' MET . 86.5 t80 -72.46 -56.12 5.93 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.292 -0.413 . . . . 13.65 110.703 179.841 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . 0.419 HG22 ' CB ' ' A' ' 85' ' ' MET . 50.3 t -48.32 -37.01 7.09 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 CA-C-N 115.939 -0.573 . . . . 11.12 111.589 179.478 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 143' ' ' TRP . . . . . 0.491 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 92.7 t90 -71.11 -55.58 7.91 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.296 0.48 . . . . 14.4 112.296 -178.872 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 144' ' ' MET . . . . . 0.589 ' HE3' ' HA ' ' A' ' 141' ' ' PHE . 22.8 ptt? -63.11 -24.38 67.87 Favored 'General case' 0 N--CA 1.464 0.237 0 N-CA-C 112.957 0.725 . . . . 14.63 112.957 -177.808 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . 0.521 HD11 ' HB3' ' A' ' 85' ' ' MET . 48.6 pt -80.73 -40.48 19.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 N-CA-C 112.182 0.438 . . . . 11.62 112.182 -179.513 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 146' ' ' SER . . . . . 0.505 ' N ' HG13 ' A' ' 145' ' ' ILE . 86.4 p -59.38 -13.61 9.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.275 0.559 . . . . 8.66 110.436 -179.759 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 147' ' ' GLN . . . . . 0.491 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 4.4 mm-40 -105.34 26.71 9.08 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.304 -0.862 . . . . 11.87 111.529 -178.692 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . 0.618 ' HZ2' ' HB2' ' A' ' 148' ' ' LYS . 9.6 mtmp? . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.158 -0.925 . . . . 13.97 110.721 179.593 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 149' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 151' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 44.7 t . . . . . 0 N--CA 1.485 1.278 0 CA-C-O 120.744 0.307 . . . . 5.2 110.983 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -152.74 76.29 1.13 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.239 -0.437 . . . . 3.26 111.217 -179.828 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 20.1 mt -58.22 108.02 0.56 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.276 -0.42 . . . . 2.0 110.806 179.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 6.2 m -84.0 158.99 21.31 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.139 -0.482 . . . . 1.72 110.801 -179.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -47.63 -30.84 4.0 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 111.818 0.303 . . . . 2.2 111.818 -179.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.4 ' HG3' ' N ' ' A' ' 8' ' ' GLN . 11.0 pt-20 -76.58 -51.29 11.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.947 0.403 . . . . 1.35 110.916 -179.567 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . 0.4 ' N ' ' HG3' ' A' ' 7' ' ' GLU . 26.1 mt-30 -63.18 -36.08 82.44 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.025 -0.534 . . . . 2.34 110.682 179.924 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.541 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 97.1 mt -62.68 -52.09 63.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.959 -0.564 . . . . 1.27 110.65 179.859 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.25 -26.48 67.78 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.888 -0.596 . . . . 1.22 111.4 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -69.61 -56.93 5.91 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 111.889 0.329 . . . . 2.27 111.889 -179.161 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.541 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 4.1 p90 -76.47 -23.6 53.83 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 120.54 -0.464 . . . . 0.46 110.92 -179.557 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.427 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 18.1 tptm -66.33 -35.59 80.76 Favored 'General case' 0 C--N 1.332 -0.163 0 N-CA-C 109.145 -0.687 . . . . 1.85 109.145 178.911 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.423 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 23.5 t70 -68.03 -49.82 59.1 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 108.777 -0.823 . . . . 0.44 108.777 177.995 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.28 -13.95 52.82 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.303 -0.862 . . . . 1.08 110.453 178.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.428 ' HA ' HD11 ' A' ' 35' ' ' LEU . 83.4 t80 -79.65 -48.9 12.96 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.842 -0.617 . . . . 0.56 110.823 -179.629 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 19.7 m -67.89 -20.88 26.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 120.974 0.416 . . . . 1.69 110.415 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.423 ' HG2' ' O ' ' A' ' 14' ' ' ASP . 77.6 mm-40 -60.36 -32.82 71.63 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.827 -0.624 . . . . 2.23 111.455 179.334 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 82.3 m-85 -93.93 4.02 54.52 Favored 'General case' 0 N--CA 1.463 0.191 0 N-CA-C 111.721 0.267 . . . . 0.69 111.721 -179.578 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -101.79 87.21 3.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.002 0.43 . . . . 0.46 110.672 179.672 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -97.4 -15.0 20.88 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.9 -0.591 . . . . 2.55 111.322 -179.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -83.58 1.14 43.58 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.225 -0.443 . . . . 1.8 111.365 -179.547 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 63.67 16.07 58.43 Favored Glycine 0 C--N 1.331 0.268 0 C-N-CA 120.987 -0.625 . . . . 0.54 113.032 179.645 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 46.1 p -92.65 8.34 39.55 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.642 0.258 . . . . 1.1 111.124 179.838 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 57.1 18.19 26.35 Favored Glycine 0 C--N 1.331 0.304 0 C-N-CA 120.823 -0.703 . . . . 0.37 111.822 -179.677 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.456 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 35.7 mtpt -127.4 155.54 43.47 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.82 0.343 . . . . 1.75 111.06 -179.512 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 43.6 pt -116.67 134.72 59.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.272 -0.422 . . . . 1.2 111.601 -179.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -53.47 138.91 32.49 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.083 -0.508 . . . . 1.04 111.282 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.446 ' HG1' ' HB1' ' A' ' 55' ' ' ALA . 7.7 t -68.98 -5.39 21.35 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.073 -0.512 . . . . 1.71 111.161 -179.901 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 49.6 mtp180 -97.53 4.93 50.22 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.954 -0.566 . . . . 3.53 110.385 179.717 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -128.7 -1.49 5.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.864 -0.607 . . . . 2.26 110.824 -179.862 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -55.3 -54.15 47.11 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.158 -0.474 . . . . 1.95 110.495 179.834 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.41 ' O ' ' HG3' ' A' ' 37' ' ' ARG . . . -56.01 -42.25 86.59 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.578 -0.82 . . . . 0.32 111.815 179.433 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 56.6 m -55.63 -37.19 67.86 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.023 0.44 . . . . 1.01 110.256 179.291 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.428 HD11 ' HA ' ' A' ' 16' ' ' PHE . 1.2 tt -65.36 -36.23 83.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.681 -0.69 . . . . 1.85 110.031 179.386 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.495 ' SD ' ' HG3' ' A' ' 43' ' ' PRO . 25.1 mtp -78.2 -20.35 52.04 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.788 -0.642 . . . . 1.43 110.853 179.887 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.41 ' HG3' ' O ' ' A' ' 33' ' ' GLY . 62.3 mtp180 -77.57 -38.52 48.28 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.315 -0.402 . . . . 3.27 110.498 179.527 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.5 t -71.39 -13.31 61.81 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.222 -0.444 . . . . 1.54 110.943 179.588 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.43 ' HB3' ' OE1' ' A' ' 41' ' ' GLN . 10.9 mp -113.28 156.23 23.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.096 -0.502 . . . . 1.94 110.701 179.691 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -49.5 -20.69 2.67 Favored Glycine 0 CA--C 1.521 0.46 0 CA-C-N 115.679 -0.691 . . . . 0.69 114.303 -178.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.644 ' HG2' HE22 ' A' ' 75' ' ' GLN . 20.0 mp0 -60.78 139.06 58.04 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 117.382 0.591 . . . . 1.97 111.09 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 74.9 m-20 -130.97 78.51 73.32 Favored Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 116.179 -0.464 . . . . 3.44 110.966 179.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.495 ' HG3' ' SD ' ' A' ' 36' ' ' MET . 59.9 Cg_endo -68.97 147.59 68.3 Favored 'Trans proline' 0 C--N 1.343 0.259 0 C-N-CA 122.767 2.311 . . . . 0.59 112.256 179.757 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 63.5 m -68.9 143.34 54.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.339 -0.391 . . . . 1.28 110.59 179.505 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.451 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 8.9 tp10 -47.93 -55.32 10.2 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.612 0.244 . . . . 2.7 111.051 -179.601 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -55.09 -45.08 75.41 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.296 -0.411 . . . . 1.15 111.164 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -53.27 -53.8 45.49 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.278 -0.419 . . . . 2.23 110.704 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.432 ' HA ' HD22 ' A' ' 51' ' ' LEU . 12.3 mt -56.6 -38.14 71.62 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.313 -0.403 . . . . 2.01 110.47 179.44 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.451 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 84.0 mm-40 -67.25 -27.17 66.99 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.394 -0.366 . . . . 1.68 110.585 179.603 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 38.5 m-20 -77.35 -55.35 5.48 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.207 -0.451 . . . . 0.62 111.8 -179.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.547 HD13 HD12 ' A' ' 71' ' ' ILE . 1.1 pp -65.8 -35.88 81.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.497 -0.319 . . . . 1.11 111.8 -179.19 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 82.6 mt -71.21 -43.22 74.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.698 0.285 . . . . 1.25 111.016 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.58 -49.94 71.39 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.406 -0.361 . . . . 1.24 111.0 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -58.91 -36.15 74.23 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.892 0.377 . . . . 2.54 110.072 179.474 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . 0.446 ' HB1' ' HG1' ' A' ' 29' ' ' THR . . . -76.23 -19.63 58.18 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.077 -0.511 . . . . 1.19 110.767 179.217 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -79.16 -31.21 43.91 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.164 -0.471 . . . . 1.95 110.802 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 14.4 m120 -111.5 41.75 1.83 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.145 -0.48 . . . . 3.19 110.875 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.445 ' C ' HD21 ' A' ' 58' ' ' ASN . 0.2 OUTLIER -158.03 -63.42 0.09 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.076 -0.511 . . . . 2.69 110.519 179.985 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 25.2 m-80 -87.42 23.1 1.98 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.122 -0.49 . . . . 2.05 110.803 179.827 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 11.3 m120 66.27 -76.69 0.05 OUTLIER 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.009 -0.541 . . . . 1.67 111.086 -179.814 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -165.15 21.01 0.12 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.842 -0.694 . . . . 0.86 112.373 179.767 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.456 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -132.14 155.22 48.56 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.982 0.42 . . . . 0.49 111.406 -179.814 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 24.1 mt -123.88 152.38 42.43 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.837 -0.619 . . . . 2.05 110.403 179.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 19.9 m-80 -113.2 157.77 21.29 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.884 0.373 . . . . 1.52 111.132 -179.757 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -42.3 -37.71 1.6 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.67 -0.695 . . . . 0.46 111.158 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -72.32 -38.96 68.56 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.206 -0.452 . . . . 1.41 111.544 179.8 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -58.07 -51.2 70.66 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.026 0.441 . . . . 1.36 110.4 179.744 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.449 ' HE2' ' HB2' ' A' ' 12' ' ' PHE . 29.5 t80 -67.1 -46.83 73.03 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.739 -0.664 . . . . 0.61 110.797 179.904 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 10.6 m -55.12 -50.82 68.29 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.148 -0.478 . . . . 1.41 111.038 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -52.82 -52.4 39.1 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.891 -0.671 . . . . 0.41 112.007 179.799 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.547 HD12 HD13 ' A' ' 51' ' ' LEU . 70.2 mt -58.24 -50.28 78.95 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.601 0 CA-C-O 120.967 0.413 . . . . 1.13 110.8 179.204 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 2.3 mtp -43.39 -37.63 2.39 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.569 -0.741 . . . . 1.24 110.819 179.625 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.27 -55.28 10.98 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.118 -0.492 . . . . 1.17 111.133 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.519 ' HE2' HG22 ' A' ' 71' ' ' ILE . 57.7 pttt -59.8 -30.26 68.79 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.963 -0.562 . . . . 1.91 111.411 -179.389 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . 0.644 HE22 ' HG2' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -81.59 -46.46 14.39 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.289 -0.414 . . . . 2.03 111.919 -179.369 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 32.4 mtt -49.74 -48.03 50.38 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 116.328 -0.396 . . . . 1.52 111.632 -179.431 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 39.2 ptt180 -80.36 -42.47 22.84 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.093 0.405 . . . . 5.25 112.093 -179.174 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -61.85 -21.52 64.73 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.596 0.236 . . . . 4.01 111.385 -179.561 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 29.1 m -93.31 -72.56 0.6 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.498 -0.319 . . . . 5.71 111.4 -179.616 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . 0.532 ' HB2' ' HE3' ' A' ' 85' ' ' MET . 1.4 p30 -172.83 89.77 0.09 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.723 -0.217 . . . . 5.6 111.531 -179.874 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.52 ' O ' ' HG2' ' A' ' 85' ' ' MET . 1.7 t -49.6 93.3 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 120.972 0.415 . . . . 7.48 110.723 178.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.425 ' HB3' ' HH ' ' A' ' 138' ' ' TYR . 43.8 mt-10 -49.34 -19.88 0.58 Allowed 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 113.353 0.871 . . . . 9.74 113.353 -178.221 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -62.28 -55.87 24.05 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 120.992 0.425 . . . . 12.11 111.461 -179.423 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -69.63 -16.01 63.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.131 -0.486 . . . . 10.87 111.17 -179.525 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' MET . . . . . 0.532 ' HE3' ' HB2' ' A' ' 80' ' ' ASP . 2.8 mmm -82.61 -32.12 28.53 Favored 'General case' 0 CA--C 1.508 -0.639 0 CA-C-O 121.979 0.895 . . . . 11.09 108.84 -179.24 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 25.9 tpt180 -64.67 -50.12 68.28 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 113.655 -1.611 . . . . 16.05 110.037 179.404 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -65.54 -37.09 85.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.8 -0.636 . . . . 14.85 110.195 179.164 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.79 -31.13 69.92 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.973 -0.558 . . . . 14.11 111.128 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 87.6 t80 -68.04 -39.59 83.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.137 0.494 . . . . 16.42 110.373 179.789 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 65.7 mttm -65.83 -39.51 90.88 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.543 -0.753 . . . . 17.66 110.918 179.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 78.2 mt -70.46 -45.43 74.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.059 -0.518 . . . . 18.15 111.59 -179.755 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -67.51 -55.46 13.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.452 -0.34 . . . . 18.34 111.511 -179.503 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 27.9 t0 -58.35 109.14 0.72 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.879 0.371 . . . . 19.29 110.523 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.5 ' HG2' ' HB3' ' A' ' 104' ' ' GLU . 22.4 mmm180 -57.88 -37.0 73.18 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.967 -0.56 . . . . 22.47 111.129 -179.464 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . 0.412 ' HB2' ' OD1' ' A' ' 97' ' ' ASP . 0.3 OUTLIER -107.8 176.46 5.14 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.22 -0.445 . . . . 23.34 110.784 -179.78 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.03 5.34 57.79 Favored Glycine 0 N--CA 1.449 -0.433 0 C-N-CA 120.896 -0.668 . . . . 22.77 112.157 179.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.426 ' OD2' ' HB2' ' A' ' 99' ' ' PHE . 11.6 p-10 -58.8 -38.79 79.38 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.808 0.337 . . . . 23.0 110.98 -179.875 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 105.21 28.15 5.62 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.858 -0.687 . . . . 20.02 113.076 179.427 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . 0.426 ' HB2' ' OD2' ' A' ' 97' ' ' ASP . 59.8 m-85 -145.39 139.06 26.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.012 0.435 . . . . 20.56 111.622 179.89 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.408 ' HB ' ' HB ' ' A' ' 136' ' ' ILE . 84.3 mt -114.84 124.59 71.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 115.774 -0.648 . . . . 19.37 110.619 179.414 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 58.4 m -114.21 156.55 44.1 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.154 -0.475 . . . . 22.65 110.958 -179.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -41.25 -32.54 1.18 Allowed 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 122.723 2.282 . . . . 23.78 112.181 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.55 -51.08 62.53 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.1 0.476 . . . . 25.0 110.531 179.299 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . 0.5 ' HB3' ' HG2' ' A' ' 94' ' ' ARG . 45.0 mt-10 -69.57 -26.99 64.75 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.674 -0.694 . . . . 22.31 110.875 179.851 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.586 HD12 ' HE1' ' A' ' 124' ' ' MET . 5.8 tt -69.13 -55.83 9.51 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.333 -0.394 . . . . 20.62 111.161 -179.583 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.411 ' O ' HG13 ' A' ' 110' ' ' ILE . 7.1 ppt_? -62.49 -30.57 71.36 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.034 0.445 . . . . 27.9 110.597 -179.679 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -74.19 -36.59 64.02 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.785 -0.643 . . . . 25.96 112.043 -179.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.483 HG13 ' O ' ' A' ' 105' ' ' LEU . 7.2 p -80.0 -44.88 22.85 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 N-CA-C 111.947 0.351 . . . . 21.06 111.947 -179.352 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 12.0 mmt -52.69 -38.98 61.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.49 -0.323 . . . . 20.93 111.429 -179.587 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.411 HG13 ' O ' ' A' ' 106' ' ' ARG . 89.6 mt -65.65 -34.48 70.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.843 0.354 . . . . 25.52 110.538 179.488 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 69.7 m-20 -65.64 -22.93 66.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.09 -0.505 . . . . 23.32 110.444 179.559 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 7.5 mt -88.42 -27.87 21.28 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.954 -0.566 . . . . 21.07 110.531 179.722 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 106.22 10.8 29.02 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.896 -0.668 . . . . 23.25 112.217 -179.741 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -74.61 -34.86 62.9 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.65 0.262 . . . . 22.59 111.306 -179.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 57.3 tptt 53.85 90.69 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.119 -0.491 . . . . 28.21 110.76 -179.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . 0.401 ' HB ' HG22 ' A' ' 121' ' ' ILE . 3.3 m -124.23 156.33 31.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.919 -0.582 . . . . 24.75 111.698 -179.525 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' THR . . . . . 0.426 ' O ' HG12 ' A' ' 121' ' ' ILE . 61.9 p -99.22 147.16 25.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.696 -0.683 . . . . 27.5 110.272 179.676 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . 0.412 ' O ' ' HB2' ' A' ' 122' ' ' ASP . 14.8 m-20 -53.55 -17.67 2.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.258 -0.428 . . . . 27.03 111.439 -179.593 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -79.93 -55.71 4.77 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.739 0.304 . . . . 29.14 111.381 -179.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -61.79 -35.03 76.99 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.412 -0.358 . . . . 24.7 111.44 -179.539 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.46 ' O ' HG13 ' A' ' 125' ' ' ILE . 7.4 pt -78.01 -33.52 18.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 C-N-CA 120.976 -0.289 . . . . 22.9 111.174 -179.909 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.428 ' N ' HG13 ' A' ' 121' ' ' ILE . 12.7 t70 -55.85 -44.83 78.37 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.598 -0.519 . . . . 24.29 109.598 178.819 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -67.66 -42.59 81.95 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.621 -0.718 . . . . 24.74 110.214 179.073 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.586 ' HE1' HD12 ' A' ' 105' ' ' LEU . 54.7 ttp -58.1 -37.06 73.82 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.026 -0.533 . . . . 20.15 110.99 179.643 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.46 HG13 ' O ' ' A' ' 121' ' ' ILE . 77.3 mt -65.87 -45.32 91.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.278 -0.419 . . . . 20.23 110.38 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 61.3 ttt180 -58.68 -38.05 77.38 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.81 -0.632 . . . . 25.57 111.089 179.753 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -63.01 -28.12 69.89 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.205 -0.452 . . . . 19.18 111.076 -179.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.513 ' HB1' ' HB3' ' A' ' 144' ' ' MET . . . -103.44 -6.61 21.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.259 -0.428 . . . . 16.88 111.038 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 54.4 t0 -109.34 100.96 10.0 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.15 -0.477 . . . . 20.4 111.071 -179.583 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 92.6 m-85 -70.38 -48.82 54.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.948 -0.569 . . . . 21.43 111.018 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -64.99 -21.85 66.91 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.182 -0.463 . . . . 23.37 110.863 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 55.26 55.51 28.01 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.941 -0.647 . . . . 24.32 112.698 179.74 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -101.73 -7.07 22.93 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.826 0.346 . . . . 24.4 110.765 179.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 89.93 9.49 65.85 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.844 -0.693 . . . . 23.47 112.305 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 68.3 mtp -134.93 154.38 51.71 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.843 0.354 . . . . 22.91 110.835 -179.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.554 HG21 ' HB2' ' A' ' 140' ' ' GLU . 27.8 mm -114.87 144.0 23.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.1 -0.5 . . . . 18.67 111.812 -179.516 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . 0.485 HD21 ' H ' ' A' ' 139' ' ' GLU . 6.3 t30 -114.59 157.15 23.43 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.43 -0.805 . . . . 16.97 108.993 178.437 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.425 ' HH ' ' HB3' ' A' ' 82' ' ' GLU . 39.4 t80 -40.85 -24.08 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 111.821 0.304 . . . . 15.28 111.821 -179.828 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.485 ' H ' HD21 ' A' ' 137' ' ' ASN . 10.6 mm-40 -80.8 -56.25 4.26 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 120.818 0.342 . . . . 14.82 110.983 -179.359 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.554 ' HB2' HG21 ' A' ' 136' ' ' ILE . 39.5 mt-10 -59.09 -29.45 67.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.134 0.492 . . . . 17.46 109.892 179.539 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.441 ' CZ ' HG21 ' A' ' 145' ' ' ILE . 86.5 t80 -66.37 -55.41 16.0 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.585 -0.734 . . . . 13.65 109.834 179.141 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . 0.411 HG12 ' HG3' ' A' ' 85' ' ' MET . 55.3 t -47.67 -36.53 5.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.65 -0.704 . . . . 11.12 111.273 179.022 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 79.4 t90 -67.81 -55.97 10.98 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.833 0.679 . . . . 14.4 112.833 -178.656 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 144' ' ' MET . . . . . 0.513 ' HB3' ' HB1' ' A' ' 128' ' ' ALA . 15.5 ptt? -65.72 -28.72 69.26 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 113.348 0.87 . . . . 14.63 113.348 -177.564 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . 0.529 ' O ' ' HG2' ' A' ' 148' ' ' LYS . 49.2 pt -73.19 -42.05 58.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 C-N-CA 120.832 -0.347 . . . . 11.62 111.763 -179.388 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 146' ' ' SER . . . . . 0.52 ' N ' HG13 ' A' ' 145' ' ' ILE . 79.0 p -64.6 -13.03 51.52 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.227 0.536 . . . . 8.66 109.845 179.374 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 11.1 mm-40 -122.11 13.1 10.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.265 -0.88 . . . . 11.87 111.839 -178.355 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . 0.529 ' HG2' ' O ' ' A' ' 145' ' ' ILE . 19.2 pttp . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.162 -0.923 . . . . 13.97 110.914 179.611 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 149' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 151' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 56.5 m . . . . . 0 N--CA 1.486 1.362 0 CA-C-O 120.771 0.319 . . . . 5.2 110.929 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -163.79 148.83 10.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.173 -0.467 . . . . 3.26 110.886 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.439 HD12 ' SG ' ' A' ' 69' ' ' CYS . 56.2 mt -67.25 91.03 0.23 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.251 -0.431 . . . . 2.0 110.674 -179.98 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 58.8 p -80.02 -170.71 2.58 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.261 -0.427 . . . . 1.72 111.423 -179.679 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -66.15 -46.79 76.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.277 -0.42 . . . . 2.2 111.259 -179.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -71.9 -38.81 69.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.235 -0.439 . . . . 1.35 110.947 -179.519 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 15.9 mm100 -64.64 -44.38 90.65 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.108 -0.496 . . . . 2.34 110.676 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.506 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 45.7 mt -59.35 -50.47 79.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.376 -0.374 . . . . 1.27 110.484 179.598 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.89 -19.78 65.79 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.111 -0.495 . . . . 1.22 111.08 179.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -71.44 -56.2 6.42 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.231 -0.44 . . . . 2.27 111.887 -178.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.506 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 20.1 p90 -78.67 -27.96 45.24 Favored 'General case' 0 C--N 1.333 -0.122 0 C-N-CA 120.565 -0.454 . . . . 0.46 110.863 -179.823 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 27.3 tptp -61.83 -37.65 85.23 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.272 -0.64 . . . . 1.85 109.272 178.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -69.39 -49.93 50.82 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.719 -0.673 . . . . 0.44 109.488 178.483 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.26 -14.82 42.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.617 -0.72 . . . . 1.08 110.79 179.389 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 47.3 t80 -80.5 -51.84 8.32 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.975 -0.557 . . . . 0.56 110.863 -179.61 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 13.6 m -66.1 -19.55 25.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.091 0.472 . . . . 1.69 110.629 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 73.5 mm-40 -65.22 -21.8 66.8 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.648 -0.706 . . . . 2.23 111.37 179.588 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 -110.85 12.34 22.34 Favored 'General case' 0 N--CA 1.462 0.174 0 N-CA-C 112.026 0.38 . . . . 0.69 112.026 -179.499 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -100.96 92.55 5.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.023 0.44 . . . . 0.46 110.716 179.483 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -99.7 -1.13 38.66 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.885 -0.598 . . . . 2.55 111.222 -179.883 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -95.29 -23.19 17.33 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.186 -0.461 . . . . 1.8 111.465 -179.299 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.1 7.21 87.69 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.831 -0.7 . . . . 0.54 112.796 179.784 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 24.3 p -84.53 17.36 2.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.589 0.233 . . . . 1.1 111.172 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 57.48 18.0 28.27 Favored Glycine 0 C--N 1.332 0.332 0 C-N-CA 120.718 -0.753 . . . . 0.37 111.841 -179.475 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.641 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 44.8 mtpt -136.82 154.71 50.45 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.598 -0.301 . . . . 1.75 110.444 -179.443 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 44.1 pt -119.68 135.45 59.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 120.612 0.244 . . . . 1.2 111.048 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -49.17 132.12 19.54 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.499 -0.319 . . . . 1.04 110.894 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 5.9 t -61.03 -17.05 50.19 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.129 -0.487 . . . . 1.71 111.019 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 69.3 mtt180 -79.23 -2.67 42.22 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.826 -0.625 . . . . 3.53 110.653 179.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -116.83 -8.8 11.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.79 -0.641 . . . . 2.26 110.799 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -55.64 -48.09 75.55 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.155 -0.475 . . . . 1.95 110.228 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.46 ' HA2' HD12 ' A' ' 48' ' ' LEU . . . -56.1 -41.34 85.44 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.503 -0.856 . . . . 0.32 111.485 179.28 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 77.3 m -65.54 -28.91 69.51 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.066 0.46 . . . . 1.01 110.314 179.069 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.83 -35.07 72.31 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.751 -0.659 . . . . 1.85 110.593 -179.982 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.442 ' SD ' ' HG3' ' A' ' 43' ' ' PRO . 26.7 mtp -80.27 -21.62 42.53 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.224 -0.444 . . . . 1.43 110.648 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -77.0 -37.33 55.3 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.069 -0.514 . . . . 3.27 110.224 179.277 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 5.9 t -73.41 -12.17 60.72 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.802 -0.636 . . . . 1.54 110.636 179.266 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 65.5 mt -111.86 155.71 23.18 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.798 -0.637 . . . . 1.94 110.366 -179.895 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -50.73 -18.12 2.49 Favored Glycine 0 CA--C 1.52 0.352 0 CA-C-N 115.929 -0.578 . . . . 0.69 114.358 -178.737 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 26.7 mp0 -65.54 141.61 58.4 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 117.354 0.577 . . . . 1.97 111.352 -179.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 48.9 m-80 -129.29 72.65 81.96 Favored Pre-proline 0 C--N 1.331 -0.225 0 CA-C-N 116.196 -0.456 . . . . 3.44 110.857 179.393 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.442 ' HG3' ' SD ' ' A' ' 36' ' ' MET . 29.4 Cg_endo -60.83 148.96 90.54 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.719 2.28 . . . . 0.59 112.309 179.806 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 32.3 m -77.34 150.02 35.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.167 -0.469 . . . . 1.28 110.6 179.565 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -49.41 -55.23 13.79 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.573 0.225 . . . . 2.7 111.483 -179.556 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -55.89 -42.79 76.49 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.443 -0.344 . . . . 1.15 111.735 -179.497 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -62.29 -53.89 48.62 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.375 -0.375 . . . . 2.23 110.95 -179.57 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.46 HD12 ' HA2' ' A' ' 33' ' ' GLY . 14.5 tp -55.57 -42.22 74.42 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.009 -0.541 . . . . 2.01 111.168 -179.745 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 85.2 mm-40 -69.27 -32.13 71.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.47 -0.332 . . . . 1.68 111.281 -179.686 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 76.6 m-20 -70.62 -51.5 27.7 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.527 -0.306 . . . . 0.62 111.638 -179.727 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.447 HD23 ' HA ' ' A' ' 48' ' ' LEU . 1.8 pp -65.85 -41.16 92.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.624 -0.262 . . . . 1.11 111.508 -179.516 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 60.5 mt -62.79 -49.2 84.65 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-O 120.808 0.337 . . . . 1.25 110.477 179.51 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.77 -34.19 76.73 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.214 -0.448 . . . . 1.24 110.381 179.471 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -63.85 -50.22 69.7 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.008 -0.542 . . . . 2.54 110.145 179.305 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -71.99 -14.59 61.93 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.93 -0.577 . . . . 1.19 110.984 179.446 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -68.99 -55.4 10.98 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.303 -0.408 . . . . 1.95 111.301 -179.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 7.6 p30 -97.03 48.58 1.05 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.033 0.444 . . . . 3.19 111.083 -179.757 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 10.4 m120 -156.21 -41.31 0.08 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.721 -0.672 . . . . 2.69 110.719 179.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 21.6 m-80 -115.17 23.33 12.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.967 -0.56 . . . . 2.05 110.694 179.866 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 12.3 m120 65.87 -78.21 0.04 OUTLIER 'General case' 0 C--O 1.232 0.178 0 CA-C-N 115.869 -0.605 . . . . 1.67 111.052 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -159.24 23.21 0.3 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.671 -0.776 . . . . 0.86 112.729 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.641 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -126.93 155.19 43.47 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.348 0.594 . . . . 0.49 111.639 -179.938 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.506 HD11 ' N ' ' A' ' 64' ' ' ASN . 1.2 tm? -121.97 148.25 45.03 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.108 -0.951 . . . . 2.05 109.002 -179.714 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . 0.506 ' N ' HD11 ' A' ' 63' ' ' LEU . 0.1 OUTLIER -111.35 155.67 22.75 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.587 -0.445 . . . . 1.52 111.965 -178.561 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.457 ' O ' ' HB2' ' A' ' 69' ' ' CYS . 70.0 t80 -51.99 -31.52 29.83 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.638 -0.71 . . . . 0.46 110.713 179.491 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -77.13 -36.6 55.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.327 -0.397 . . . . 1.41 111.868 -179.914 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -63.68 -46.46 85.44 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 110.043 -0.354 . . . . 1.36 110.043 179.767 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.435 ' HE2' ' HB2' ' A' ' 12' ' ' PHE . 31.0 t80 -68.44 -51.52 42.76 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.183 -0.462 . . . . 0.61 110.472 179.263 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.457 ' HB2' ' O ' ' A' ' 65' ' ' PHE . 2.1 t -53.43 -45.86 69.57 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-O 120.945 0.402 . . . . 1.41 110.121 179.739 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -52.61 -51.27 44.84 Favored Glycine 0 N--CA 1.448 -0.542 0 CA-C-N 115.666 -0.697 . . . . 0.41 111.68 179.463 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.468 ' HA ' ' HG2' ' A' ' 74' ' ' LYS . 13.0 mt -61.9 -39.44 83.57 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.316 0 CA-C-O 121.026 0.441 . . . . 1.13 110.602 179.429 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 3.4 mtp -57.88 -30.21 65.66 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.802 -0.635 . . . . 1.24 110.096 179.618 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.25 -45.72 65.87 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.965 -0.561 . . . . 1.17 110.799 179.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.468 ' HG2' ' HA ' ' A' ' 71' ' ' ILE . 58.2 pttt -75.52 -25.46 57.26 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.194 -0.457 . . . . 1.91 111.767 -179.667 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . 0.502 ' O ' ' HB3' ' A' ' 78' ' ' GLU . 4.4 tt0 -82.53 -43.95 16.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.056 0.455 . . . . 2.03 110.851 -179.533 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' MET . . . . . 0.405 ' SD ' HD23 ' A' ' 4' ' ' LEU . 29.0 mtt -63.37 -40.28 96.84 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.787 -0.642 . . . . 1.52 111.41 179.751 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . 0.427 ' NE ' ' HA ' ' A' ' 74' ' ' LYS . 33.9 ptt180 -67.68 -31.07 70.79 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.321 -0.4 . . . . 5.25 111.248 -179.659 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.502 ' HB3' ' O ' ' A' ' 75' ' ' GLN . 2.9 tt0 -42.51 -35.34 1.04 Allowed 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.459 -0.337 . . . . 4.01 111.24 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 53.7 m -49.44 -55.32 13.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.152 -0.476 . . . . 5.71 110.887 179.636 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -96.78 -80.49 0.43 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.184 -0.462 . . . . 5.6 110.641 179.386 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.547 ' O ' ' HG3' ' A' ' 85' ' ' MET . 61.9 m 31.07 86.23 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 116.105 -0.498 . . . . 7.48 111.993 -179.671 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.441 ' HA ' ' SD ' ' A' ' 85' ' ' MET . 38.6 tt0 -44.88 -41.73 7.39 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.002 -0.544 . . . . 9.74 112.456 -179.163 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -55.92 -54.02 49.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.786 0.327 . . . . 12.11 111.623 -179.372 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -63.24 -18.75 63.89 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.305 -0.407 . . . . 10.87 111.386 -179.467 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' MET . . . . . 0.547 ' HG3' ' O ' ' A' ' 81' ' ' THR . 6.6 mtp -74.74 -35.62 62.62 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-O 121.185 0.517 . . . . 11.09 109.894 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 15.9 ttm180 -68.63 -51.46 41.97 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.542 -0.754 . . . . 16.05 110.295 179.457 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.413 ' HA ' ' HD3' ' A' ' 90' ' ' LYS . 16.2 mm-40 -58.41 -39.16 78.98 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.11 -0.496 . . . . 14.85 110.501 179.32 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -69.87 -33.02 71.68 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.006 -0.543 . . . . 14.11 110.568 179.543 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 52.8 t80 -66.78 -29.05 68.9 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.949 -0.568 . . . . 16.42 110.234 179.594 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.413 ' HD3' ' HA ' ' A' ' 87' ' ' GLU . 24.9 mtpp -73.32 -46.48 49.19 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.475 -0.784 . . . . 17.66 110.945 179.783 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 75.2 mt -58.6 -50.52 78.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.164 -0.471 . . . . 18.15 111.245 -179.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -64.08 -43.4 95.51 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.36 -0.382 . . . . 18.34 110.976 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 30.7 t0 -64.47 93.28 0.1 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.997 0.427 . . . . 19.29 110.297 179.621 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -56.48 -29.42 61.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.778 -0.646 . . . . 22.47 111.532 -179.269 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -101.12 177.97 4.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.874 0.369 . . . . 23.34 111.028 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -101.0 0.27 54.99 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.949 -0.643 . . . . 22.77 112.002 179.364 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -70.36 -22.36 62.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.701 0.286 . . . . 23.0 111.659 -179.691 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 86.39 45.45 5.56 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.705 -0.76 . . . . 20.02 112.492 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . 0.423 ' HA ' ' O ' ' A' ' 136' ' ' ILE . 99.6 m-85 -147.64 138.86 23.62 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.595 0.236 . . . . 20.56 111.04 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 53.7 mt -114.13 117.43 55.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 121.009 0.433 . . . . 19.37 110.756 179.407 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 68.1 m -114.11 157.32 42.49 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 115.736 -0.666 . . . . 22.65 111.046 -179.296 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . 0.43 ' HG3' HD12 ' A' ' 125' ' ' ILE . 94.4 Cg_exo -41.45 -36.57 2.92 Favored 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 122.602 2.201 . . . . 23.78 112.742 -179.832 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.32 -40.9 81.52 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.161 -0.472 . . . . 25.0 111.17 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -78.02 -22.85 48.64 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.835 -0.62 . . . . 22.31 109.878 -179.473 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.534 HD21 ' HB ' ' A' ' 121' ' ' ILE . 3.4 tt -77.0 -43.04 36.3 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 115.215 -0.902 . . . . 20.62 111.128 -179.445 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.418 ' O ' HG13 ' A' ' 110' ' ' ILE . 54.2 ttt180 -66.57 -48.27 70.15 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.468 -0.333 . . . . 27.9 110.346 179.463 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 8.5 m-85 -55.86 -50.69 69.9 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.159 -0.473 . . . . 25.96 111.492 -179.681 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.439 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 9.3 p -63.99 -43.13 97.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.582 0.229 . . . . 21.06 111.568 -179.623 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 9.0 mmt -58.98 -43.19 91.37 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 120.773 0.32 . . . . 20.93 111.013 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.418 HG13 ' O ' ' A' ' 106' ' ' ARG . 90.9 mt -67.33 -21.6 28.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.144 -0.48 . . . . 25.52 110.313 179.704 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 84.1 m-20 -79.74 -37.64 35.06 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.861 -0.609 . . . . 23.32 110.495 179.345 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.439 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 58.2 mt -59.64 -36.02 75.54 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.103 -0.499 . . . . 21.07 110.422 179.754 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 133.84 -15.88 4.55 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.858 -0.687 . . . . 23.25 112.22 -179.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -93.62 165.2 12.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.863 0.363 . . . . 22.59 111.227 -179.689 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -124.07 128.06 48.76 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.064 -0.517 . . . . 28.21 110.676 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . 0.417 ' HB ' HG23 ' A' ' 121' ' ' ILE . 2.8 m -135.57 146.79 29.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.207 -0.451 . . . . 24.75 111.624 -179.885 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 59.5 p -89.32 147.15 24.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.734 -0.666 . . . . 27.5 110.223 179.331 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -53.74 -19.04 3.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.21 -0.45 . . . . 27.03 111.411 -179.521 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -78.5 -54.64 5.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.405 -0.362 . . . . 29.14 111.575 -179.51 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -61.46 -37.92 85.34 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.557 -0.292 . . . . 24.7 111.769 -179.063 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.534 ' HB ' HD21 ' A' ' 105' ' ' LEU . 47.8 pt -74.32 -35.88 41.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 C-N-CA 120.689 -0.404 . . . . 22.9 111.062 179.99 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -58.72 -37.6 76.5 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.915 0.388 . . . . 24.29 110.365 179.251 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -69.53 -47.1 64.85 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.912 -0.585 . . . . 24.74 110.709 179.693 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 56.5 ttp -53.37 -38.71 63.59 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 116.246 -0.433 . . . . 20.15 110.76 179.658 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.486 HG23 HD13 ' A' ' 136' ' ' ILE . 79.7 mt -67.42 -42.99 87.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.118 -0.492 . . . . 20.23 110.473 179.686 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 3.2 tmt_? -61.87 -30.52 70.92 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.989 -0.551 . . . . 25.57 110.942 179.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -69.87 -28.01 65.29 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.354 -0.385 . . . . 19.18 111.127 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.544 ' HB3' ' HB3' ' A' ' 144' ' ' MET . . . -104.66 -6.73 20.17 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.087 -0.506 . . . . 16.88 111.347 -179.808 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . 0.409 ' OD1' ' N ' ' A' ' 132' ' ' GLY . 3.0 t0 -112.36 105.0 13.18 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.033 0.444 . . . . 20.4 111.431 -179.102 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 74.3 m-85 -71.51 -7.58 48.44 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.749 -0.659 . . . . 21.43 111.031 179.597 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -128.21 -7.62 5.35 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.091 -0.504 . . . . 23.37 110.718 179.914 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . 0.44 ' C ' ' H ' ' A' ' 134' ' ' GLY . . . 61.31 -84.93 0.03 OUTLIER Glycine 0 N--CA 1.447 -0.607 0 CA-C-N 115.703 -0.68 . . . . 24.32 112.049 -179.484 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . 0.468 ' OD2' ' HB2' ' A' ' 135' ' ' MET . 0.8 OUTLIER 44.08 17.14 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 123.43 0.692 . . . . 24.4 111.809 -179.669 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . 0.44 ' H ' ' C ' ' A' ' 132' ' ' GLY . . . 53.33 23.56 19.01 Favored Glycine 0 CA--C 1.522 0.487 0 CA-C-N 115.923 -0.58 . . . . 23.47 114.085 179.547 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' MET . . . . . 0.468 ' HB2' ' OD2' ' A' ' 133' ' ' ASP . 40.3 mtp -145.35 142.73 29.65 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 117.431 0.616 . . . . 22.91 110.828 179.408 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.547 HG23 ' HB2' ' A' ' 140' ' ' GLU . 29.9 mm -113.56 146.82 17.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 121.233 0.539 . . . . 18.67 111.586 -179.091 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -114.65 156.96 23.77 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.413 -0.812 . . . . 16.97 109.525 179.025 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 49.1 t80 -43.14 -21.48 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 111.789 0.292 . . . . 15.28 111.789 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -80.95 -56.35 4.17 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 120.949 0.404 . . . . 14.82 111.032 -179.517 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.547 ' HB2' HG23 ' A' ' 136' ' ' ILE . 58.6 mt-10 -61.9 -32.79 73.2 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.216 0.532 . . . . 17.46 110.104 179.797 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.491 ' HA ' ' HE1' ' A' ' 144' ' ' MET . 81.2 t80 -65.28 -54.15 33.48 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.586 -0.734 . . . . 13.65 109.854 178.951 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . 0.401 HG11 ' SD ' ' A' ' 85' ' ' MET . 2.5 t -48.89 -35.21 6.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.39 -0.823 . . . . 11.12 111.555 179.265 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 143' ' ' TRP . . . . . 0.489 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 92.0 t90 -69.27 -55.94 9.03 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.588 0.588 . . . . 14.4 112.588 -179.066 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 144' ' ' MET . . . . . 0.544 ' HB3' ' HB3' ' A' ' 128' ' ' ALA . 21.9 ptt? -64.26 -24.93 67.84 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 113.324 0.861 . . . . 14.63 113.324 -177.674 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . 0.516 HG13 ' N ' ' A' ' 146' ' ' SER . 39.7 pt -80.61 -38.27 17.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 111.993 0.368 . . . . 11.62 111.993 -179.51 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 146' ' ' SER . . . . . 0.516 ' N ' HG13 ' A' ' 145' ' ' ILE . 39.9 t -59.67 -13.55 10.25 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.225 0.536 . . . . 8.66 110.559 -179.883 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 147' ' ' GLN . . . . . 0.489 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 2.8 mm-40 -94.51 -22.8 18.0 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.402 -0.817 . . . . 11.87 111.032 -179.152 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 99.1 mttt . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.223 -0.894 . . . . 13.97 111.003 179.808 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 149' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 151' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 35.5 t . . . . . 0 N--CA 1.485 1.316 0 CA-C-O 120.765 0.317 . . . . 5.2 110.836 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 64.23 123.28 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.138 0 CA-C-N 115.974 -0.557 . . . . 3.26 111.072 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 18.5 mt -56.29 98.44 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.182 -0.463 . . . . 2.0 110.684 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.87 176.17 8.66 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.006 -0.543 . . . . 1.72 110.857 -179.813 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -62.59 -37.75 87.42 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.251 0.548 . . . . 2.2 110.32 179.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -75.38 -45.76 37.17 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.377 -0.829 . . . . 1.35 110.923 -179.634 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -62.46 -45.73 91.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.056 -0.52 . . . . 2.34 110.909 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.523 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 80.7 mt -57.46 -54.74 27.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.123 -0.49 . . . . 1.27 111.096 179.926 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.78 -24.08 65.5 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.246 -0.434 . . . . 1.22 111.88 -179.525 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -72.54 -56.19 5.76 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 112.135 0.42 . . . . 2.27 112.135 -179.08 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.523 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 5.2 p90 -76.98 -24.29 52.26 Favored 'General case' 0 C--N 1.332 -0.158 0 C-N-CA 120.614 -0.434 . . . . 0.46 110.728 -179.591 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.414 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 18.6 tptp -65.62 -39.77 91.85 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.259 -0.645 . . . . 1.85 109.259 178.87 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.435 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 17.9 t70 -68.1 -44.33 76.47 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 108.994 -0.743 . . . . 0.44 108.994 177.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.09 -15.11 62.8 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 115.249 -0.887 . . . . 1.08 110.42 179.275 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.414 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 74.1 t80 -79.6 -48.28 14.04 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.821 -0.627 . . . . 0.56 110.527 -179.734 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 30.1 m -66.01 -23.1 31.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 121.0 0.428 . . . . 1.69 110.253 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.435 ' HG2' ' O ' ' A' ' 14' ' ' ASP . 26.5 mm-40 -57.02 -45.79 82.82 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 115.791 -0.641 . . . . 2.23 111.799 179.358 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -85.63 22.5 1.58 Allowed 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 112.053 0.39 . . . . 0.69 112.053 -179.252 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -120.87 78.82 1.43 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.026 0.441 . . . . 0.46 110.815 179.646 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 11.4 mmmm -89.86 -24.71 21.33 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.854 -0.612 . . . . 2.55 110.999 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -67.54 -35.66 79.48 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.963 -0.562 . . . . 1.8 111.23 -179.608 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 101.83 3.51 52.17 Favored Glycine 0 C--N 1.331 0.255 0 C-N-CA 120.686 -0.768 . . . . 0.54 112.819 179.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 53.6 p -80.2 7.12 10.02 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.731 0.3 . . . . 1.1 111.202 179.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 56.96 19.42 30.11 Favored Glycine 0 C--N 1.333 0.405 0 C-N-CA 120.746 -0.74 . . . . 0.37 111.986 -179.611 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.438 ' C ' HE22 ' A' ' 62' ' ' GLN . 29.6 mtpt -126.34 155.7 41.64 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.696 0.284 . . . . 1.75 111.104 -179.593 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.442 HG13 ' HB2' ' A' ' 63' ' ' LEU . 41.3 pt -114.69 130.12 69.64 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 CA-C-O 120.915 0.388 . . . . 1.2 111.591 -179.843 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -54.53 134.36 46.35 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.091 -0.504 . . . . 1.04 111.161 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 6.1 t -66.82 -8.22 27.15 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.055 -0.52 . . . . 1.71 111.053 179.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 53.9 mtp180 -89.34 -1.19 57.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.912 -0.586 . . . . 3.53 110.491 179.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -127.62 2.05 6.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.808 -0.633 . . . . 2.26 110.971 -179.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.44 ' O ' ' HB3' ' A' ' 35' ' ' LEU . 2.7 tm? -57.09 -51.8 67.82 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.396 -0.365 . . . . 1.95 110.581 -179.791 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.455 ' O ' ' HG3' ' A' ' 37' ' ' ARG . . . -55.55 -44.22 85.75 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.376 -0.916 . . . . 0.32 111.443 179.236 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 87.9 m -56.32 -36.17 68.41 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.105 0.478 . . . . 1.01 110.22 179.124 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.44 ' HB3' ' O ' ' A' ' 32' ' ' LEU . 42.2 tp -65.92 -32.4 73.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.635 -0.712 . . . . 1.85 110.347 179.483 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 16.6 mtp -80.91 -20.17 42.72 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.744 -0.662 . . . . 1.43 110.812 179.793 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.455 ' HG3' ' O ' ' A' ' 33' ' ' GLY . 71.8 mtp180 -74.72 -43.36 55.47 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.344 -0.389 . . . . 3.27 110.646 179.753 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.3 t -65.74 -14.0 60.45 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.168 -0.469 . . . . 1.54 110.981 179.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.486 ' HB3' ' OE1' ' A' ' 41' ' ' GLN . 9.7 mp -113.9 156.14 24.5 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.028 -0.533 . . . . 1.94 110.539 179.491 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -55.15 -7.37 1.14 Allowed Glycine 0 CA--C 1.521 0.455 0 N-CA-C 114.931 0.732 . . . . 0.69 114.931 -178.497 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.486 ' OE1' ' HB3' ' A' ' 39' ' ' LEU . 16.0 mp0 -59.44 -79.72 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 117.86 0.83 . . . . 1.97 110.998 179.697 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 53.69 74.24 0.79 Allowed Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.216 -0.447 . . . . 3.44 111.118 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -71.42 -167.76 0.31 Allowed 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.509 2.14 . . . . 0.59 112.442 179.79 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.9 m -86.27 157.16 19.99 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.125 -0.489 . . . . 1.28 110.934 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -61.32 -55.05 36.1 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.677 0.275 . . . . 2.7 111.056 -179.745 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.57 -53.09 56.66 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.216 -0.447 . . . . 1.15 111.374 -179.843 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -54.87 -41.66 71.1 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.207 -0.451 . . . . 2.23 110.247 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.451 ' HA ' HD21 ' A' ' 51' ' ' LEU . 27.3 tp -60.61 -39.44 88.19 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.722 -0.672 . . . . 2.01 110.641 179.68 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 86.2 mm-40 -70.49 -30.8 67.68 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.145 -0.48 . . . . 1.68 110.823 179.769 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 30.4 m-20 -67.08 -49.31 65.48 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.208 -0.451 . . . . 0.62 111.481 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.451 HD21 ' HA ' ' A' ' 48' ' ' LEU . 1.0 OUTLIER -71.06 -38.96 72.49 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.637 -0.256 . . . . 1.11 111.401 -179.586 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 73.4 mt -65.88 -32.19 57.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 120.74 0.305 . . . . 1.25 110.636 179.607 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -68.66 -50.8 48.29 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.254 -0.43 . . . . 1.24 110.839 179.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -65.24 -32.91 74.82 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.892 0.377 . . . . 2.54 110.277 179.526 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . 0.439 ' HB3' HD22 ' A' ' 63' ' ' LEU . . . -79.85 -14.83 58.37 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.044 -0.525 . . . . 1.19 110.838 179.415 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -70.09 -39.41 75.6 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.189 -0.459 . . . . 1.95 110.84 179.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -82.64 -22.83 34.53 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.145 -0.48 . . . . 3.19 110.969 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -91.42 136.74 32.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.201 -0.454 . . . . 2.69 111.015 -179.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . 0.459 ' C ' ' H ' ' A' ' 61' ' ' GLY . 88.0 m-20 64.01 6.46 2.85 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.957 -0.565 . . . . 2.05 111.362 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 18.6 m-80 71.01 -27.03 0.17 Allowed 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 112.474 0.546 . . . . 1.67 112.474 179.244 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . 0.459 ' H ' ' C ' ' A' ' 59' ' ' ASN . . . 160.91 34.97 0.02 OUTLIER Glycine 0 C--N 1.33 0.23 0 C-N-CA 120.301 -0.952 . . . . 0.86 112.933 -179.937 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.498 ' HA ' HE21 ' A' ' 62' ' ' GLN . 0.0 OUTLIER -141.65 154.69 45.52 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.929 0.395 . . . . 0.49 111.167 179.663 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.442 ' HB2' HG13 ' A' ' 27' ' ' ILE . 17.9 mt -127.96 153.84 46.26 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.876 -0.602 . . . . 2.05 110.332 179.908 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -113.43 156.99 22.5 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 110.288 -0.264 . . . . 1.52 110.288 -179.91 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.472 ' O ' ' HB2' ' A' ' 69' ' ' CYS . 77.6 t80 -44.32 -34.6 2.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.813 0.34 . . . . 0.46 110.44 179.339 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.97 -33.7 57.62 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.088 -0.505 . . . . 1.41 111.926 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -64.67 -50.13 68.27 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.012 0.434 . . . . 1.36 110.062 179.208 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.469 ' HE2' ' HB2' ' A' ' 12' ' ' PHE . 31.3 t80 -64.8 -53.54 45.26 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.902 -0.59 . . . . 0.61 110.518 179.64 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.472 ' HB2' ' O ' ' A' ' 65' ' ' PHE . 0.1 OUTLIER -55.13 -41.38 71.65 Favored 'General case' 0 CA--C 1.521 -0.168 0 CA-C-O 120.827 0.346 . . . . 1.41 110.429 179.691 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -53.06 -46.56 61.58 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.791 -0.718 . . . . 0.41 111.392 179.375 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.471 ' HA ' ' HG2' ' A' ' 74' ' ' LYS . 11.3 mt -65.15 -38.53 82.91 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.421 0 CA-C-O 120.936 0.398 . . . . 1.13 110.314 178.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' MET . . . . . 0.503 ' O ' ' HG3' ' A' ' 76' ' ' MET . 79.4 mmm -61.99 -30.58 71.04 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.075 -0.511 . . . . 1.24 109.796 179.282 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -67.82 -43.31 79.9 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.807 -0.633 . . . . 1.17 110.278 179.512 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.471 ' HG2' ' HA ' ' A' ' 71' ' ' ILE . 64.1 pttt -75.63 -29.83 59.3 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.32 -0.4 . . . . 1.91 110.762 179.572 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 4.6 tt0 -73.0 -55.95 5.82 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.306 -0.406 . . . . 2.03 110.794 179.426 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' MET . . . . . 0.503 ' HG3' ' O ' ' A' ' 72' ' ' MET . 43.1 mtt -58.6 -31.95 68.53 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-O 120.933 0.397 . . . . 1.52 110.584 179.375 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 16.1 tpp180 -60.22 -27.86 67.53 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-N 115.794 -0.639 . . . . 5.25 111.232 -179.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -47.94 -23.24 0.73 Allowed 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 121.041 0.448 . . . . 4.01 111.389 179.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 6.7 t -62.65 -0.91 0.7 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.924 -0.58 . . . . 5.71 112.377 -179.185 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -162.52 -29.71 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.846 -0.161 . . . . 5.6 111.254 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.475 ' O ' ' HG3' ' A' ' 85' ' ' MET . 2.6 t 36.92 84.12 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 116.082 -0.508 . . . . 7.48 111.736 -179.558 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.481 ' HA ' ' SD ' ' A' ' 85' ' ' MET . 11.7 pt-20 -80.16 -15.85 56.16 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.044 -0.526 . . . . 9.74 112.29 -178.895 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -59.74 -55.71 30.87 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 120.988 0.423 . . . . 12.11 110.991 -179.829 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -67.99 -15.76 63.75 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.976 -0.556 . . . . 10.87 110.558 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' MET . . . . . 0.481 ' SD ' ' HA ' ' A' ' 82' ' ' GLU . 8.5 mtt -80.4 -34.44 36.29 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.089 -0.505 . . . . 11.09 110.302 -179.875 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 37.3 ttt180 -68.78 -46.76 67.89 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.747 -0.66 . . . . 16.05 109.875 179.454 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.453 ' O ' HG12 ' A' ' 91' ' ' ILE . 38.3 tt0 -59.45 -45.19 92.3 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.886 -0.597 . . . . 14.85 109.818 178.981 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.88 -35.28 80.64 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.832 -0.622 . . . . 14.11 111.074 179.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -58.55 -39.2 79.57 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.099 0.476 . . . . 16.42 110.237 179.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 58.7 mttp -68.41 -40.1 81.4 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.665 -0.698 . . . . 17.66 110.682 179.497 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.453 HG12 ' O ' ' A' ' 87' ' ' GLU . 42.0 mm -60.06 -38.54 77.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.086 -0.506 . . . . 18.15 111.287 -179.826 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.501 ' HA ' HG22 ' A' ' 108' ' ' VAL . 12.8 m-85 -79.21 -35.37 41.78 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.386 -0.37 . . . . 18.34 111.333 -179.798 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 46.4 t0 -79.22 108.16 12.51 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.9 0.381 . . . . 19.29 110.946 -179.64 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.13 -9.55 58.82 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.979 -0.555 . . . . 22.47 111.313 -179.639 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . 0.41 ' HB2' ' OD1' ' A' ' 97' ' ' ASP . 22.0 m-20 -117.18 168.08 10.62 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.888 0.375 . . . . 23.34 110.85 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -99.76 5.28 58.19 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.781 -0.723 . . . . 22.77 112.081 179.659 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.45 ' OD2' ' HB2' ' A' ' 99' ' ' PHE . 6.0 p-10 -63.27 -39.66 95.23 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.726 0.298 . . . . 23.0 111.061 -179.612 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 110.99 15.71 10.51 Favored Glycine 0 C--N 1.332 0.324 0 C-N-CA 120.659 -0.781 . . . . 20.02 112.921 179.727 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . 0.45 ' HB2' ' OD2' ' A' ' 97' ' ' ASP . 82.3 m-85 -139.69 152.12 46.45 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.892 0.377 . . . . 20.56 111.263 179.795 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.43 ' HB ' ' HB ' ' A' ' 136' ' ' ILE . 63.5 mt -114.68 132.13 64.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 115.964 -0.562 . . . . 19.37 110.8 179.71 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 35.2 p -114.35 155.96 45.06 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.206 -0.452 . . . . 22.65 110.756 -179.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_exo -40.54 -37.6 2.2 Favored 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 122.586 2.191 . . . . 23.78 112.567 -179.842 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.07 -49.52 77.02 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.131 0.491 . . . . 25.0 110.59 179.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -69.46 -32.75 71.88 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.612 -0.722 . . . . 22.31 110.694 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.518 HD11 HD11 ' A' ' 121' ' ' ILE . 3.4 tm? -62.24 -56.03 22.56 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.018 -0.537 . . . . 20.62 110.359 -179.775 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 3.2 ttp180 -56.06 -40.59 73.77 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.193 -0.458 . . . . 27.9 111.03 179.712 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -58.38 -46.9 85.47 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.189 0.44 . . . . 25.96 112.189 -179.316 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.52 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 17.6 t -78.77 -54.06 12.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 N-CA-C 111.967 0.358 . . . . 21.06 111.967 -179.1 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.485 ' HG3' ' CD1' ' A' ' 105' ' ' LEU . 1.1 mmt -47.03 -22.22 0.31 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 120.706 0.289 . . . . 20.93 111.4 -179.77 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 78.1 mt -95.26 -38.83 9.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 121.023 0.439 . . . . 25.52 110.354 178.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -58.57 -33.16 69.63 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.681 -0.69 . . . . 23.32 110.893 179.858 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.52 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 19.1 mt -66.7 -24.93 66.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.139 -0.482 . . . . 21.07 110.832 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 117.34 -7.99 15.92 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.945 -0.645 . . . . 23.25 112.49 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -82.54 127.43 33.32 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.718 0.294 . . . . 22.59 110.918 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -87.17 104.38 16.3 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.229 -0.441 . . . . 28.21 110.713 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . 0.47 ' HB ' HG21 ' A' ' 121' ' ' ILE . 3.2 m -123.42 149.94 27.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.158 -0.474 . . . . 24.75 111.504 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' THR . . . . . 0.435 ' O ' HG12 ' A' ' 121' ' ' ILE . 67.5 p -98.73 144.54 27.86 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.791 -0.64 . . . . 27.5 110.061 179.182 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . 0.469 ' HA ' HD13 ' A' ' 121' ' ' ILE . 5.7 m-20 -48.65 -23.08 0.9 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.051 -0.522 . . . . 27.03 111.775 -179.492 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -77.31 -55.74 5.15 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 111.743 0.275 . . . . 29.14 111.743 -179.394 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . 0.414 ' OE1' HG12 ' A' ' 116' ' ' VAL . 13.2 pt-20 -59.52 -38.43 80.96 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.624 -0.262 . . . . 24.7 111.588 -179.19 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.518 HD11 HD11 ' A' ' 105' ' ' LEU . 33.5 pt -73.15 -34.53 45.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 C-N-CA 120.996 -0.282 . . . . 22.9 111.515 -179.946 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -57.05 -46.23 82.61 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.91 -0.404 . . . . 24.29 109.91 179.513 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.86 -37.69 88.47 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.068 -0.515 . . . . 24.74 110.119 179.038 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 5.2 ttp -53.16 -48.41 68.01 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.034 -0.53 . . . . 20.15 110.676 179.237 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.405 HG22 HD12 ' A' ' 136' ' ' ILE . 76.8 mt -61.05 -43.13 95.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.026 -0.534 . . . . 20.23 110.449 179.711 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 29.3 ttm180 -61.76 -33.82 74.76 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.957 -0.565 . . . . 25.57 110.87 179.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -69.06 -19.17 64.08 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.983 -0.553 . . . . 19.18 111.171 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.608 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -113.5 -5.06 13.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.228 -0.442 . . . . 16.88 111.217 -179.922 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 18.9 t0 -107.02 101.61 11.02 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.071 0.462 . . . . 20.4 110.903 -179.679 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 85.6 m-85 -86.77 -42.72 13.1 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.797 -0.638 . . . . 21.43 111.374 -179.784 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -59.69 -23.72 63.35 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.314 -0.403 . . . . 23.37 110.909 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 64.25 78.21 0.21 Allowed Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.857 -0.687 . . . . 24.32 112.739 179.632 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -143.38 6.56 1.49 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.844 0.354 . . . . 24.4 110.794 179.568 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 67.58 20.06 71.58 Favored Glycine 0 C--N 1.331 0.289 0 C-N-CA 120.87 -0.681 . . . . 23.47 112.698 179.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 72.8 mtp -136.76 155.24 50.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.805 0.336 . . . . 22.91 110.636 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.53 HG23 ' HB2' ' A' ' 140' ' ' GLU . 43.6 mm -114.7 144.76 21.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 121.163 0.506 . . . . 18.67 111.51 -179.566 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . 0.448 ' ND2' ' H ' ' A' ' 138' ' ' TYR . 4.0 t-20 -114.58 156.59 24.39 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.44 -0.8 . . . . 16.97 109.031 178.744 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.448 ' H ' ' ND2' ' A' ' 137' ' ' ASN . 34.1 t80 -41.8 -24.07 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 120.864 0.364 . . . . 15.28 111.141 179.82 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.412 ' N ' ' O ' ' A' ' 137' ' ' ASN . 47.3 mt-10 -81.02 -55.35 4.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.113 -0.494 . . . . 14.82 110.632 179.928 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.53 ' HB2' HG23 ' A' ' 136' ' ' ILE . 36.9 mt-10 -57.38 -29.22 63.89 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.905 -0.589 . . . . 17.46 110.487 179.786 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.541 ' HA ' ' HE1' ' A' ' 144' ' ' MET . 86.0 t80 -71.68 -55.57 7.45 Favored 'General case' 0 C--N 1.334 -0.108 0 CA-C-N 116.06 -0.518 . . . . 13.65 110.122 179.322 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . 0.48 HG12 ' SD ' ' A' ' 85' ' ' MET . 6.7 t -46.69 -35.13 2.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 CA-C-N 115.748 -0.66 . . . . 11.12 111.507 179.217 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 143' ' ' TRP . . . . . 0.537 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 84.1 t90 -73.35 -55.82 5.89 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.215 0.45 . . . . 14.4 112.215 -179.092 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 144' ' ' MET . . . . . 0.608 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 20.1 ptt? -63.11 -19.97 64.93 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.916 0.709 . . . . 14.63 112.916 -177.884 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . 0.55 HG13 ' N ' ' A' ' 146' ' ' SER . 33.3 pt -81.44 -48.73 18.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 N-CA-C 112.02 0.378 . . . . 11.62 112.02 179.851 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 146' ' ' SER . . . . . 0.55 ' N ' HG13 ' A' ' 145' ' ' ILE . 29.3 t -63.95 -14.29 52.66 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-O 121.264 0.554 . . . . 8.66 109.999 -179.711 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 147' ' ' GLN . . . . . 0.537 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 7.6 mm-40 -124.67 18.25 8.74 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.188 -0.915 . . . . 11.87 110.268 -179.235 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . 0.529 ' HB2' ' HA ' ' A' ' 145' ' ' ILE . 14.8 ttpp . . . . . 0 C--O 1.249 1.043 0 CA-C-N 115.289 -0.869 . . . . 13.97 111.053 -179.684 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 149' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 151' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 55.1 m . . . . . 0 N--CA 1.485 1.303 0 CA-C-O 120.769 0.318 . . . . 5.2 110.854 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -102.81 153.18 20.43 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.23 -0.441 . . . . 3.26 110.894 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.441 HD11 ' SG ' ' A' ' 69' ' ' CYS . 72.5 mt -68.57 96.61 0.72 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.126 -0.488 . . . . 2.0 110.631 179.719 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -77.79 166.62 22.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.986 -0.552 . . . . 1.72 111.008 -179.653 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -52.52 -52.31 55.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.512 -0.313 . . . . 2.2 111.677 179.822 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -68.58 -40.16 80.65 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.049 0.452 . . . . 1.35 110.838 -179.374 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -60.63 -40.88 93.54 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.644 -0.707 . . . . 2.34 111.014 -179.837 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.505 ' HA ' ' CZ ' ' A' ' 12' ' ' PHE . 72.7 mt -63.58 -49.4 82.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.264 -0.426 . . . . 1.27 110.414 179.821 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.98 -18.96 65.63 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.949 -0.569 . . . . 1.22 110.849 179.658 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -71.76 -56.96 4.81 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 116.06 -0.518 . . . . 2.27 111.646 -179.117 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.505 ' CZ ' ' HA ' ' A' ' 9' ' ' ILE . 9.3 p90 -77.76 -26.65 49.97 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.595 -0.442 . . . . 0.46 110.751 -179.714 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.406 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 20.0 tptm -64.23 -36.71 84.97 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.234 -0.654 . . . . 1.85 109.234 178.639 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -67.46 -48.18 67.95 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.772 -0.649 . . . . 0.44 109.393 178.374 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.18 -14.81 61.5 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.884 -0.598 . . . . 1.08 110.952 179.002 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.406 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 36.9 t80 -79.16 -47.49 15.96 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.866 -0.606 . . . . 0.56 110.807 -179.4 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 31.6 m -70.18 -24.75 26.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.135 -0.484 . . . . 1.69 110.849 -179.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 76.6 mm-40 -60.58 -32.14 71.24 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.96 -0.564 . . . . 2.23 111.365 179.816 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 20.5 m-85 -85.93 -20.96 28.2 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.569 -0.287 . . . . 0.69 111.537 -179.57 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -80.19 90.13 5.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.934 0.397 . . . . 0.46 110.855 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 12.3 mmmm -100.18 4.49 44.43 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.03 -0.532 . . . . 2.55 111.218 -179.688 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -99.41 -36.72 9.49 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.225 -0.443 . . . . 1.8 111.233 -179.434 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 96.85 30.06 7.75 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.774 -0.727 . . . . 0.54 112.811 179.614 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 31.1 p -103.57 10.79 36.85 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.655 0.264 . . . . 1.1 111.166 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.93 15.96 30.12 Favored Glycine 0 C--N 1.331 0.282 0 C-N-CA 120.715 -0.755 . . . . 0.37 112.045 -179.67 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.463 ' HE3' ' HB3' ' A' ' 62' ' ' GLN . 5.1 mtmt -139.79 151.95 46.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.661 0.267 . . . . 1.75 110.712 -179.769 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 50.3 pt -119.28 136.25 57.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.49 -0.323 . . . . 1.2 111.251 -179.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -50.39 125.9 13.81 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.356 -0.384 . . . . 1.04 110.949 179.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 6.9 t -62.62 -16.15 55.23 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.119 -0.491 . . . . 1.71 111.036 -179.869 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 65.8 mtp180 -75.99 -18.79 59.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.082 -0.508 . . . . 3.53 110.353 179.701 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -104.28 0.57 29.45 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.707 -0.678 . . . . 2.26 110.478 179.621 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.411 ' O ' ' HG2' ' A' ' 36' ' ' MET . 0.9 OUTLIER -60.85 -49.49 77.26 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.025 -0.534 . . . . 1.95 110.311 179.936 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.444 ' HA2' HD12 ' A' ' 48' ' ' LEU . . . -54.18 -39.17 63.24 Favored Glycine 0 C--N 1.332 0.343 0 C-N-CA 120.502 -0.856 . . . . 0.32 111.347 179.077 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 94.2 m -66.24 -33.03 74.83 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.243 0.544 . . . . 1.01 109.963 178.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 65.6 tp -70.96 -20.68 62.42 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.536 -0.756 . . . . 1.85 110.701 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.411 ' HG2' ' O ' ' A' ' 32' ' ' LEU . 90.8 mmm -80.29 -49.64 11.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.259 -0.428 . . . . 1.43 111.104 179.757 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 10.6 ptm180 -60.62 -34.39 74.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.446 -0.343 . . . . 3.27 110.983 179.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 14.5 t -72.25 -13.16 61.45 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.065 0.46 . . . . 1.54 110.611 179.295 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 86.1 mt -113.11 156.91 22.34 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.581 -0.736 . . . . 1.94 110.487 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -44.35 -31.73 2.42 Favored Glycine 0 CA--C 1.52 0.345 0 C-N-CA 120.686 -0.769 . . . . 0.69 112.689 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -64.14 160.07 19.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.827 0.346 . . . . 1.97 110.965 179.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 17.6 p-10 -164.28 76.23 1.59 Allowed Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.153 -0.476 . . . . 3.44 110.739 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -66.19 150.18 85.07 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.642 2.228 . . . . 0.59 112.562 -179.712 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 19.6 m -71.29 157.06 38.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.04 -0.527 . . . . 1.28 110.469 179.588 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.418 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 0.9 OUTLIER -48.48 -54.76 13.01 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 111.608 0.225 . . . . 2.7 111.608 -179.703 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -48.16 -55.49 10.23 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.569 -0.287 . . . . 1.15 111.749 -179.496 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -56.74 -48.44 77.78 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.318 -0.401 . . . . 2.23 110.564 -179.785 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.515 ' HA ' HD22 ' A' ' 51' ' ' LEU . 14.3 tp -57.26 -35.65 70.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.116 -0.493 . . . . 2.01 110.888 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.418 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 37.0 mm-40 -72.57 -33.33 66.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.386 -0.37 . . . . 1.68 110.509 179.663 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 63.1 m-20 -69.31 -54.11 16.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.083 -0.508 . . . . 0.62 111.707 -179.725 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.515 HD22 ' HA ' ' A' ' 48' ' ' LEU . 1.2 pp -63.78 -44.08 94.44 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 112.077 0.399 . . . . 1.11 112.077 -179.123 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 76.8 mt -64.1 -44.94 97.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.742 0.306 . . . . 1.25 111.081 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.77 -52.42 63.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.322 -0.399 . . . . 1.24 111.152 -179.821 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -60.38 -34.05 73.34 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.423 -0.353 . . . . 2.54 110.637 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -77.78 -15.8 58.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.366 -0.379 . . . . 1.19 110.914 179.553 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -80.3 -51.3 9.07 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.252 -0.431 . . . . 1.95 111.309 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 9.5 p30 -88.44 30.4 0.89 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.423 -0.353 . . . . 3.19 111.504 -179.416 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -149.34 -18.09 0.28 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.39 -0.368 . . . . 2.69 110.971 179.534 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 25.2 m-80 -135.79 21.38 3.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.217 -0.447 . . . . 2.05 110.731 179.887 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 11.2 m120 61.49 -86.38 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.928 -0.578 . . . . 1.67 111.522 179.821 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -146.53 4.28 1.07 Allowed Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.564 -0.827 . . . . 0.86 112.833 -179.683 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.463 ' HB3' ' HE3' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -114.96 150.41 35.79 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.03 0.443 . . . . 0.49 111.093 179.863 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.423 ' O ' ' HB3' ' A' ' 26' ' ' LYS . 0.5 OUTLIER -118.02 153.02 34.38 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.603 -0.726 . . . . 2.05 109.96 -179.939 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . 0.454 ' N ' ' OD1' ' A' ' 64' ' ' ASN . 0.6 OUTLIER -112.59 156.49 22.59 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.648 0.261 . . . . 1.52 111.304 -178.388 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -48.54 -38.93 21.71 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.142 -0.481 . . . . 0.46 110.919 179.862 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.22 -33.07 71.23 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.502 -0.317 . . . . 1.41 111.065 179.779 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.411 ' HB2' ' HG ' ' A' ' 63' ' ' LEU . 12.9 mm-40 -66.32 -47.42 73.57 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.312 0.577 . . . . 1.36 109.547 178.616 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.417 ' HE2' ' HB2' ' A' ' 12' ' ' PHE . 27.1 t80 -63.3 -55.35 25.45 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.297 -0.865 . . . . 0.61 110.504 179.282 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.441 ' SG ' HD11 ' A' ' 4' ' ' LEU . 0.5 OUTLIER -56.18 -39.1 71.86 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.001 -0.545 . . . . 1.41 110.222 179.609 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -53.27 -50.25 53.02 Favored Glycine 0 N--CA 1.451 -0.343 0 CA-C-N 115.637 -0.711 . . . . 0.41 112.148 179.682 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.523 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 11.6 mt -65.48 -44.09 94.29 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.36 0 CA-C-O 121.136 0.494 . . . . 1.13 110.66 179.632 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' MET . . . . . 0.467 ' O ' ' HB2' ' A' ' 76' ' ' MET . 21.4 mtp -53.27 -33.07 51.63 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.9 -0.591 . . . . 1.24 109.654 179.613 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.11 -44.63 68.6 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.99 -0.55 . . . . 1.17 110.791 179.479 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.523 ' HG2' ' O ' ' A' ' 71' ' ' ILE . 0.0 OUTLIER -65.96 -33.25 75.38 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.394 -0.366 . . . . 1.91 111.58 -179.355 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . 0.428 ' O ' ' HG2' ' A' ' 78' ' ' GLU . 8.3 tt0 -83.16 -55.42 4.36 Favored 'General case' 0 CA--C 1.521 -0.135 0 CA-C-O 121.235 0.541 . . . . 2.03 111.14 -179.153 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' MET . . . . . 0.467 ' HB2' ' O ' ' A' ' 72' ' ' MET . 84.0 mtp -58.23 -20.96 46.12 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.12 -0.946 . . . . 1.52 112.633 -178.82 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 53.5 mtt180 -63.24 -13.91 43.26 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.371 0.508 . . . . 5.25 112.371 -179.585 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.436 ' O ' ' HG3' ' A' ' 78' ' ' GLU . 11.9 pt-20 -63.48 77.97 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 121.094 0.473 . . . . 4.01 111.555 -179.688 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 95.6 m -166.38 -47.18 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.22 -0.445 . . . . 5.71 110.94 -179.72 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -118.75 -0.63 11.23 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.027 -0.533 . . . . 5.6 111.25 -179.441 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.495 ' O ' ' HG2' ' A' ' 85' ' ' MET . 5.2 t 32.89 61.82 0.37 Allowed 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 121.039 0.447 . . . . 7.48 111.64 179.971 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -41.33 -41.84 2.05 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.552 -0.749 . . . . 9.74 112.743 -179.025 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -55.52 -53.37 57.25 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 111.861 0.319 . . . . 12.11 111.861 -179.171 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -64.26 -15.64 60.52 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.36 -0.382 . . . . 10.87 111.572 -179.308 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' MET . . . . . 0.495 ' HG2' ' O ' ' A' ' 81' ' ' THR . 13.3 mmm -81.02 -36.6 30.39 Favored 'General case' 0 CA--C 1.511 -0.537 0 CA-C-O 121.738 0.78 . . . . 11.09 109.304 -178.837 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 6.2 tpt180 -64.2 -52.67 57.75 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.246 -1.343 . . . . 16.05 110.353 179.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -58.6 -36.11 73.48 Favored 'General case' 0 C--O 1.233 0.187 0 N-CA-C 109.754 -0.462 . . . . 14.85 109.754 178.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.75 -36.47 80.6 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.049 -0.523 . . . . 14.11 110.589 178.688 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 94.7 t80 -72.3 -16.82 61.9 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 116.014 -0.539 . . . . 16.42 110.465 179.711 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 16.8 tttt -79.46 -49.03 12.92 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 115.572 -0.74 . . . . 17.66 110.684 -179.625 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 65.7 mt -71.71 -44.79 68.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.809 -0.632 . . . . 18.15 111.517 -179.708 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.444 ' HA ' HG23 ' A' ' 108' ' ' VAL . 2.5 m-85 -61.11 -44.29 97.58 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.396 -0.365 . . . . 18.34 111.314 -179.656 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 45.7 t0 -72.33 105.03 3.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.386 -0.37 . . . . 19.29 110.354 179.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.529 ' HG2' ' HB3' ' A' ' 104' ' ' GLU . 19.7 mmm180 -59.42 -53.79 54.07 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.007 -0.542 . . . . 22.47 110.933 -179.561 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . 0.419 ' HB2' ' OD1' ' A' ' 97' ' ' ASP . 0.6 OUTLIER -86.24 170.82 11.76 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.068 -0.515 . . . . 23.34 110.722 -179.88 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -97.74 5.53 62.06 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.901 -0.666 . . . . 22.77 112.155 179.866 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.419 ' OD1' ' HB2' ' A' ' 95' ' ' ASP . 6.5 p-10 -56.97 -43.82 82.02 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.734 0.302 . . . . 23.0 111.109 -179.777 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 114.61 20.84 5.65 Favored Glycine 0 CA--C 1.518 0.241 0 C-N-CA 120.837 -0.697 . . . . 20.02 112.869 179.633 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . 0.402 ' HA ' ' O ' ' A' ' 136' ' ' ILE . 98.5 m-85 -144.98 145.76 31.66 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.785 0.326 . . . . 20.56 111.071 179.861 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 56.2 mt -114.6 130.4 69.03 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 CA-C-N 116.208 -0.451 . . . . 19.37 110.679 179.429 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 68.6 m -114.41 156.06 45.0 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-N 116.148 -0.478 . . . . 22.65 110.684 -179.666 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_exo -43.59 -37.55 8.2 Favored 'Trans proline' 0 C--N 1.349 0.564 0 C-N-CA 122.38 2.053 . . . . 23.78 112.492 -179.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -62.21 -43.5 98.68 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.096 0.474 . . . . 25.0 110.657 179.569 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . 0.529 ' HB3' ' HG2' ' A' ' 94' ' ' ARG . 43.8 mt-10 -73.82 -35.91 64.91 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.636 -0.711 . . . . 22.31 110.545 179.827 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.575 HD21 ' HB ' ' A' ' 121' ' ' ILE . 35.7 tp -60.75 -40.6 93.06 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.625 -0.716 . . . . 20.62 110.873 -179.606 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.482 ' HG3' HD13 ' A' ' 110' ' ' ILE . 8.7 ttm180 -69.98 -46.57 64.9 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.28 -0.418 . . . . 27.9 110.449 179.16 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -56.18 -41.83 76.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.992 -0.549 . . . . 25.96 111.58 -179.511 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.517 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 5.3 p -73.2 -49.23 39.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 C-N-CA 121.057 -0.257 . . . . 21.06 111.627 -179.516 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -50.5 -45.75 56.65 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.804 0.335 . . . . 20.93 110.667 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.482 HD13 ' HG3' ' A' ' 106' ' ' ARG . 42.4 mt -70.06 -30.16 42.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.174 -0.467 . . . . 25.52 110.185 179.31 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -68.18 -29.71 68.64 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.735 -0.666 . . . . 23.32 110.538 179.475 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.517 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 62.6 mt -72.97 -40.63 65.13 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.02 -0.536 . . . . 21.07 110.451 179.829 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 136.8 -1.59 3.21 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.941 -0.647 . . . . 23.25 112.331 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -117.02 130.73 56.87 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.926 0.393 . . . . 22.59 111.298 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 9.8 ptpp? -88.18 153.3 21.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.136 -0.484 . . . . 28.21 110.928 179.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . 0.422 ' HB ' HG23 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -152.1 155.6 6.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.03 -0.532 . . . . 24.75 111.314 -179.814 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' THR . . . . . 0.446 ' O ' HG12 ' A' ' 121' ' ' ILE . 73.0 p -94.42 138.41 32.39 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.935 -0.575 . . . . 27.5 110.186 179.671 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 22.2 m-20 -50.0 -19.63 0.76 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.017 -0.538 . . . . 27.03 111.571 -179.49 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -77.48 -55.24 5.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.47 -0.332 . . . . 29.14 111.842 -179.414 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -62.48 -41.15 98.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.479 -0.328 . . . . 24.7 111.773 -179.091 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.575 ' HB ' HD21 ' A' ' 105' ' ' LEU . 15.1 pt -70.35 -38.14 73.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 C-N-CA 120.982 -0.287 . . . . 22.9 111.412 -179.431 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.405 ' N ' HG13 ' A' ' 121' ' ' ILE . 17.0 t70 -63.16 -32.87 74.36 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.928 0.394 . . . . 24.29 110.27 179.303 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 22.3 mm-40 -65.79 -46.97 76.7 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.012 -0.54 . . . . 24.74 110.53 179.541 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 55.5 ttp -56.73 -39.14 73.4 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.084 -0.507 . . . . 20.15 110.853 179.526 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 66.6 mt -64.92 -42.05 93.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.983 0.421 . . . . 20.23 110.301 179.61 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 35.2 ttp180 -59.14 -46.12 89.18 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.745 -0.662 . . . . 25.57 110.875 179.517 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -63.43 -29.73 70.97 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.832 -0.622 . . . . 19.18 111.237 -179.551 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.512 ' HB1' ' HB3' ' A' ' 144' ' ' MET . . . -91.48 -13.84 31.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.852 0.358 . . . . 16.88 111.079 179.829 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . 0.405 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 5.9 t70 -101.04 105.86 17.1 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.123 -0.49 . . . . 20.4 110.924 -179.723 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -89.6 -41.36 12.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.951 -0.568 . . . . 21.43 111.609 -179.6 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -59.95 -26.14 65.75 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.867 0.365 . . . . 23.37 110.769 -179.614 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 72.05 79.34 0.44 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.804 -0.712 . . . . 24.32 112.87 179.782 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 13.3 p-10 -138.83 -33.28 0.65 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.651 0.263 . . . . 24.4 111.031 179.641 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 108.21 7.91 29.99 Favored Glycine 0 N--CA 1.452 -0.233 0 C-N-CA 120.799 -0.715 . . . . 23.47 112.669 179.892 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 63.9 mtp -130.71 155.53 46.46 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.622 0.249 . . . . 22.91 110.508 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.503 HG22 ' HB2' ' A' ' 140' ' ' GLU . 46.6 mm -114.69 143.34 24.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 121.207 0.527 . . . . 18.67 111.973 -179.501 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . 0.443 ' O ' ' N ' ' A' ' 139' ' ' GLU . 28.9 p-10 -115.71 157.94 23.54 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.282 -0.872 . . . . 16.97 108.749 178.257 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 48.7 t80 -39.33 -24.23 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 112.312 0.486 . . . . 15.28 112.312 -179.358 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.443 ' N ' ' O ' ' A' ' 137' ' ' ASN . 12.8 mm-40 -80.77 -56.29 4.24 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 120.742 0.306 . . . . 14.82 111.45 -179.55 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.503 ' HB2' HG22 ' A' ' 136' ' ' ILE . 44.0 mt-10 -62.1 -25.57 67.79 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.149 0.499 . . . . 17.46 110.015 179.788 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.535 ' HA ' ' HE3' ' A' ' 144' ' ' MET . 63.7 t80 -70.13 -55.29 9.78 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.618 -0.719 . . . . 13.65 110.111 179.235 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . 0.41 HG23 ' CB ' ' A' ' 85' ' ' MET . 43.6 t -47.83 -44.21 10.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.697 -0.683 . . . . 11.12 111.463 179.736 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 84.2 t90 -63.77 -55.34 23.89 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.406 0.521 . . . . 14.4 112.406 -178.883 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 144' ' ' MET . . . . . 0.535 ' HE3' ' HA ' ' A' ' 141' ' ' PHE . 18.8 ptt? -61.31 -35.48 77.49 Favored 'General case' 0 N--CA 1.463 0.191 0 N-CA-C 112.726 0.639 . . . . 14.63 112.726 -177.921 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . 0.464 HD13 ' HB3' ' A' ' 85' ' ' MET . 13.9 pt -76.53 -23.07 15.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 C-N-CA 120.809 -0.357 . . . . 11.62 111.721 -179.388 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 146' ' ' SER . . . . . 0.423 ' HB3' ' NE2' ' A' ' 147' ' ' GLN . 48.0 t -67.64 -29.84 69.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.99 0.424 . . . . 8.66 110.245 179.945 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 147' ' ' GLN . . . . . 0.423 ' NE2' ' HB3' ' A' ' 146' ' ' SER . 13.9 mm-40 -91.61 -21.9 20.57 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.728 -0.669 . . . . 11.87 111.38 -179.759 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . 0.436 ' HG3' ' O ' ' A' ' 144' ' ' MET . 88.1 mttt . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.264 -0.874 . . . . 13.97 111.098 179.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 149' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 151' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 81.0 p . . . . . 0 N--CA 1.486 1.344 0 CA-C-O 120.656 0.265 . . . . 5.2 110.943 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 65.26 148.18 0.04 OUTLIER 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 116.053 -0.522 . . . . 3.26 111.268 179.863 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.439 HD13 ' HE2' ' A' ' 76' ' ' MET . 6.9 mp -79.01 66.35 4.43 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.202 -0.454 . . . . 2.0 110.624 179.448 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -66.19 -153.71 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.846 0.355 . . . . 1.72 111.242 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -80.3 -54.95 5.26 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.116 0.484 . . . . 2.2 110.537 -179.561 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -70.29 -28.59 65.31 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.722 -0.672 . . . . 1.35 110.199 179.812 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -66.57 -48.17 70.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.675 -0.693 . . . . 2.34 110.565 179.575 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.525 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 64.5 mt -60.28 -40.68 84.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.08 -0.509 . . . . 1.27 110.885 179.831 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -77.12 -18.79 57.66 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.979 0.418 . . . . 1.22 110.673 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -72.24 -56.26 5.83 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.865 -0.607 . . . . 2.27 111.751 -179.154 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.525 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 8.3 p90 -75.99 -26.83 57.1 Favored 'General case' 0 C--N 1.333 -0.152 0 C-N-CA 120.577 -0.449 . . . . 0.46 110.758 -179.843 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 26.1 tptp -64.12 -37.05 86.04 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 109.467 -0.568 . . . . 1.85 109.467 178.74 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -70.12 -46.79 64.06 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.857 -0.61 . . . . 0.44 109.691 178.666 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.69 -19.9 66.01 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.903 -0.59 . . . . 1.08 110.392 179.246 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -79.4 -39.15 33.16 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.573 -0.739 . . . . 0.56 110.522 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -71.57 -26.04 25.63 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.701 0 CA-C-N 115.939 -0.573 . . . . 1.69 111.05 -179.888 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 82.2 mm-40 -61.13 -29.48 69.8 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.793 -0.64 . . . . 2.23 111.357 -179.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 47.9 m-85 -93.16 -6.95 46.71 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.596 -0.275 . . . . 0.69 111.338 -179.792 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -97.85 89.62 4.66 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.889 0.376 . . . . 0.46 110.697 179.395 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -99.52 -21.18 16.03 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.042 -0.526 . . . . 2.55 111.266 -179.759 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -78.05 -11.08 59.88 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.262 -0.426 . . . . 1.8 111.193 -179.711 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.5 7.45 87.1 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.765 -0.731 . . . . 0.54 112.814 179.702 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 76.2 p -76.67 5.36 7.68 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.674 0.273 . . . . 1.1 111.146 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 56.15 23.84 41.58 Favored Glycine 0 C--N 1.332 0.331 0 C-N-CA 120.811 -0.709 . . . . 0.37 111.73 -179.608 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.639 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 36.1 mtpt -136.09 155.87 49.56 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.725 0.298 . . . . 1.75 111.346 -179.244 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.432 ' N ' HE22 ' A' ' 62' ' ' GLN . 44.3 pt -117.93 129.8 73.77 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.2 0 CA-C-O 120.951 0.405 . . . . 1.2 111.367 179.876 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -52.47 141.3 20.33 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.186 -0.461 . . . . 1.04 111.29 -179.732 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 38.7 p -66.69 -12.84 60.09 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.852 -0.613 . . . . 1.71 111.254 -179.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 39.0 mtp180 -89.43 5.34 45.73 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.974 -0.557 . . . . 3.53 110.676 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -124.57 -7.92 7.43 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.081 -0.509 . . . . 2.26 111.296 -179.537 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.501 HD21 HD11 ' A' ' 63' ' ' LEU . 1.2 tm? -56.15 -52.73 63.31 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.553 -0.294 . . . . 1.95 110.746 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -53.95 -44.9 72.16 Favored Glycine 0 C--N 1.33 0.244 0 C-N-CA 120.598 -0.81 . . . . 0.32 111.979 179.701 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 45.2 m -60.55 -32.52 71.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.037 0.446 . . . . 1.01 110.512 179.432 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -69.06 -31.36 70.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.815 -0.63 . . . . 1.85 110.701 -179.99 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 69.7 mmm -76.96 -24.86 52.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.205 -0.452 . . . . 1.43 110.325 179.766 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -71.32 -48.43 50.52 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.256 -0.429 . . . . 3.27 110.581 179.319 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.2 t -64.52 -13.81 54.28 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.037 -0.529 . . . . 1.54 111.21 179.847 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 10.4 mp -113.54 156.38 23.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.187 -0.46 . . . . 1.94 110.441 179.778 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -50.2 -18.32 2.14 Favored Glycine 0 CA--C 1.52 0.38 0 CA-C-N 115.827 -0.624 . . . . 0.69 114.175 -179.014 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 11.8 mp0 -64.61 163.09 14.35 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 117.42 0.61 . . . . 1.97 111.105 -179.881 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -165.21 72.27 1.41 Allowed Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 115.932 -0.576 . . . . 3.44 110.834 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -66.61 164.22 29.81 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.648 2.232 . . . . 0.59 112.437 -179.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 44.2 m -82.58 152.05 26.12 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.028 -0.533 . . . . 1.28 110.752 179.757 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -45.47 -52.52 10.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.441 -0.345 . . . . 2.7 111.344 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.95 -47.82 70.9 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.215 -0.448 . . . . 1.15 111.592 -179.738 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -53.38 -55.0 28.54 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.391 -0.368 . . . . 2.23 111.282 -179.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 39.6 mt -57.98 -44.86 87.35 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.537 -0.302 . . . . 2.01 110.955 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 83.5 mm-40 -62.56 -29.88 70.91 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.728 0.299 . . . . 1.68 111.288 -179.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -76.09 -52.59 9.83 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.345 -0.389 . . . . 0.62 111.903 -179.285 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 2.2 pp -68.94 -38.19 79.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.567 -0.288 . . . . 1.11 111.602 -179.133 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 85.0 mt -65.06 -53.28 43.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.628 -0.26 . . . . 1.25 110.969 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.5 -35.47 79.47 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.799 0.333 . . . . 1.24 111.145 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -62.92 -55.16 28.48 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.319 -0.401 . . . . 2.54 110.535 179.734 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -71.18 -14.83 62.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.076 -0.511 . . . . 1.19 111.348 179.777 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -65.98 -51.93 54.01 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.435 -0.348 . . . . 1.95 110.979 -179.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 28.7 p-10 -94.58 22.22 6.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.215 -0.448 . . . . 3.19 111.352 -179.649 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 12.1 m120 -134.36 -5.26 2.62 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.371 -0.377 . . . . 2.69 110.979 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 34.3 m-80 -146.4 14.35 1.26 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.34 -0.391 . . . . 2.05 111.046 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 28.4 m-80 62.96 7.69 2.79 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.027 -0.533 . . . . 1.67 111.845 179.578 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 108.0 38.66 1.97 Allowed Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.617 -0.801 . . . . 0.86 112.945 179.49 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.639 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -144.21 155.51 43.92 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.974 0.416 . . . . 0.49 111.195 179.749 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.501 HD11 HD21 ' A' ' 32' ' ' LEU . 8.4 mt -128.37 153.99 46.47 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-N 116.033 -0.53 . . . . 2.05 110.395 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -112.43 156.38 22.64 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 121.143 -0.223 . . . . 1.52 110.696 -179.633 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -42.74 -32.44 0.6 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.285 -0.416 . . . . 0.46 111.074 179.646 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.49 -41.27 55.82 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.209 -0.45 . . . . 1.41 112.012 -179.727 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -63.36 -52.76 60.38 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.323 -0.399 . . . . 1.36 110.493 -179.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.458 ' O ' ' HG3' ' A' ' 72' ' ' MET . 17.8 t80 -59.69 -55.16 37.87 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.933 -0.576 . . . . 0.61 110.478 179.312 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 8.4 t -55.72 -41.96 74.61 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-N 116.077 -0.51 . . . . 1.41 110.468 179.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -48.81 -55.36 11.5 Favored Glycine 0 N--CA 1.45 -0.378 0 CA-C-N 115.462 -0.79 . . . . 0.41 111.952 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.417 ' HA ' ' HG2' ' A' ' 74' ' ' LYS . 9.3 mt -64.41 -36.9 78.57 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 CA-C-O 120.897 0.379 . . . . 1.13 110.422 179.386 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' MET . . . . . 0.458 ' HG3' ' O ' ' A' ' 68' ' ' PHE . 42.4 mtp -60.57 -28.67 68.64 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.87 -0.604 . . . . 1.24 110.055 179.27 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.31 -47.23 62.06 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.672 -0.694 . . . . 1.17 110.433 179.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.417 ' HG2' ' HA ' ' A' ' 71' ' ' ILE . 54.2 pttt -75.14 -24.71 58.02 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.196 -0.457 . . . . 1.91 111.203 179.671 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -80.13 -55.39 4.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.18 -0.464 . . . . 2.03 111.452 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' MET . . . . . 0.439 ' HE2' HD13 ' A' ' 4' ' ' LEU . 11.5 mtm -63.36 -29.78 71.03 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 116.296 -0.411 . . . . 1.52 111.16 -179.754 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 63.6 ttt180 -69.64 -19.93 63.6 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.026 0.441 . . . . 5.25 110.598 179.409 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 -86.29 -49.41 7.7 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.942 -0.572 . . . . 4.01 111.29 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 96.3 m -76.51 87.65 3.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.294 -0.412 . . . . 5.71 111.567 -179.396 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.4 p-10 -178.61 -65.98 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.974 -0.557 . . . . 5.6 111.021 179.634 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.612 ' O ' ' HG3' ' A' ' 85' ' ' MET . 96.7 m 58.11 90.26 0.05 OUTLIER 'General case' 0 C--O 1.226 -0.156 0 CA-C-N 116.388 -0.369 . . . . 7.48 110.249 -179.322 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.505 ' HA ' ' SD ' ' A' ' 85' ' ' MET . 11.8 pt-20 -76.9 -20.65 55.97 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 113.362 0.875 . . . . 9.74 113.362 -177.895 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.408 ' HG3' ' N ' ' A' ' 84' ' ' GLU . 10.9 pt-20 -59.61 -54.8 42.31 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.949 -0.3 . . . . 12.11 111.579 -179.245 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.474 ' HG2' HG23 ' A' ' 81' ' ' THR . 13.0 pt-20 -68.21 -14.39 62.95 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.772 0.32 . . . . 10.87 111.099 -179.678 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' MET . . . . . 0.612 ' HG3' ' O ' ' A' ' 81' ' ' THR . 20.2 mtt -77.66 -52.66 8.62 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.224 -0.444 . . . . 11.09 110.75 -179.5 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 28.2 ttp180 -58.48 -46.92 85.65 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.961 -0.563 . . . . 16.05 110.402 179.862 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.433 ' HA ' ' HE2' ' A' ' 90' ' ' LYS . 1.4 tm-20 -55.78 -48.97 74.41 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 121.146 0.498 . . . . 14.85 109.976 178.917 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -63.76 -28.3 69.78 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.823 -0.626 . . . . 14.11 110.984 179.631 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 70.6 t80 -67.97 -38.02 82.24 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.018 0.437 . . . . 16.42 110.315 179.586 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.433 ' HE2' ' HA ' ' A' ' 87' ' ' GLU . 44.1 mtmt -64.05 -43.77 94.53 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.837 -0.62 . . . . 17.66 110.496 179.583 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 58.2 mt -63.76 -45.59 96.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.172 -0.467 . . . . 18.15 111.254 -179.922 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.519 ' HA ' HG22 ' A' ' 108' ' ' VAL . 6.3 m-85 -70.82 -14.7 62.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.473 -0.33 . . . . 18.34 111.449 -179.688 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -105.8 106.3 16.73 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.897 0.379 . . . . 19.29 110.868 179.791 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.67 -49.56 18.0 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.006 -0.543 . . . . 22.47 111.106 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -74.36 167.52 21.49 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.206 -0.452 . . . . 23.34 110.907 -179.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -94.19 5.16 71.42 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.886 -0.673 . . . . 22.77 112.033 179.609 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -67.89 -27.23 66.48 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.757 0.313 . . . . 23.0 111.189 -179.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 87.43 34.41 10.49 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.796 -0.716 . . . . 20.02 112.506 179.658 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . 0.49 ' HA ' ' O ' ' A' ' 136' ' ' ILE . 96.4 m-85 -141.08 147.46 38.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.663 0.268 . . . . 20.56 110.982 -179.954 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.504 ' HB ' ' HB ' ' A' ' 136' ' ' ILE . 58.3 mt -114.48 122.44 68.6 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 CA-C-N 116.24 -0.436 . . . . 19.37 111.265 -179.904 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 23.3 m -115.04 156.7 44.93 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 115.781 -0.645 . . . . 22.65 110.338 179.796 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 92.1 Cg_exo -41.18 -33.16 1.26 Allowed 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.408 2.072 . . . . 23.78 112.764 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.76 -41.73 87.29 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.249 -0.432 . . . . 25.0 111.498 -179.776 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -79.87 -49.53 11.81 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.863 -0.608 . . . . 22.31 110.114 -179.482 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.489 HD22 ' HE2' ' A' ' 124' ' ' MET . 49.3 tp -51.95 -32.56 33.78 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.274 -0.875 . . . . 20.62 110.922 179.515 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 7.3 tmm_? -77.39 -48.23 17.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.754 -0.657 . . . . 27.9 110.987 -179.747 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 66.2 t80 -58.82 -34.41 71.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.215 -0.448 . . . . 25.96 111.557 -179.636 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.519 HG22 ' HA ' ' A' ' 92' ' ' PHE . 46.5 t -80.26 -53.71 12.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 N-CA-C 112.352 0.501 . . . . 21.06 112.352 -178.719 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.403 ' SD ' HG21 ' A' ' 116' ' ' VAL . 1.5 mtt -47.06 -37.44 9.47 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 111.858 0.318 . . . . 20.93 111.858 -179.333 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 89.2 mt -64.7 -35.02 73.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.773 0.32 . . . . 25.52 110.928 179.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -67.61 -39.1 84.77 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.185 -0.461 . . . . 23.32 110.598 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.4 HD13 ' N ' ' A' ' 112' ' ' LEU . 8.6 mp -67.29 -43.25 82.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.987 -0.551 . . . . 21.07 110.822 -179.971 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 117.98 21.16 4.26 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.771 -0.728 . . . . 23.25 112.617 179.636 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -83.16 -23.01 33.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.566 0.222 . . . . 22.59 111.352 -179.841 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp 50.21 85.39 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.278 -0.419 . . . . 28.21 110.994 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . 0.415 HG11 ' OE1' ' A' ' 120' ' ' GLU . 8.8 m -129.17 155.79 41.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.138 -0.483 . . . . 24.75 111.844 -179.545 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' THR . . . . . 0.447 ' O ' HG12 ' A' ' 121' ' ' ILE . 57.8 p -100.62 148.48 24.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.673 -0.694 . . . . 27.5 110.084 179.072 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . 0.442 ' HA ' HD11 ' A' ' 121' ' ' ILE . 9.2 m-20 -51.83 -19.48 1.72 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.363 -0.38 . . . . 27.03 111.727 -179.37 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -78.95 -55.43 5.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.441 -0.345 . . . . 29.14 111.755 -179.443 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . 0.415 ' OE1' HG11 ' A' ' 116' ' ' VAL . 14.5 pt-20 -60.84 -39.33 88.7 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.569 -0.287 . . . . 24.7 111.754 -179.245 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.553 HG13 ' N ' ' A' ' 122' ' ' ASP . 9.5 pt -69.86 -46.69 73.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 120.918 -0.313 . . . . 22.9 111.517 -179.69 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.553 ' N ' HG13 ' A' ' 121' ' ' ILE . 13.7 t70 -50.95 -41.11 58.83 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.835 0.35 . . . . 24.29 110.529 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -61.84 -54.37 43.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.045 -0.525 . . . . 24.74 110.131 179.189 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.489 ' HE2' HD22 ' A' ' 105' ' ' LEU . 5.4 tmm? -51.2 -34.26 31.04 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 115.817 -0.629 . . . . 20.15 110.745 179.357 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.453 HD11 HD21 ' A' ' 105' ' ' LEU . 69.9 mt -65.01 -41.3 91.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.0 -0.546 . . . . 20.23 110.448 179.519 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 55.3 ttt180 -57.62 -38.26 74.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.745 -0.661 . . . . 25.57 110.402 179.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -61.69 -48.21 81.81 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.647 -0.706 . . . . 19.18 111.186 179.622 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.54 ' HB3' ' HB3' ' A' ' 144' ' ' MET . . . -81.73 -7.38 59.59 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.097 -0.502 . . . . 16.88 111.167 -179.674 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -100.42 107.23 18.92 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.221 -0.445 . . . . 20.4 110.857 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 68.9 m-85 -94.06 -42.76 8.84 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.684 -0.689 . . . . 21.43 111.128 -179.748 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -55.9 -34.48 65.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.053 -0.521 . . . . 23.37 111.048 -179.627 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 81.17 72.24 1.24 Allowed Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.858 -0.686 . . . . 24.32 112.589 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -143.08 -5.54 0.87 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.717 0.294 . . . . 24.4 111.305 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 77.47 8.8 87.1 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.795 -0.717 . . . . 23.47 112.536 179.839 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 61.9 mtp -121.34 155.33 34.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.752 0.311 . . . . 22.91 110.516 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.514 HG21 ' N ' ' A' ' 137' ' ' ASN . 38.7 mm -115.61 142.33 29.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 121.217 0.532 . . . . 18.67 112.092 -179.434 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . 0.514 ' N ' HG21 ' A' ' 136' ' ' ILE . 54.3 t30 -115.71 157.54 24.12 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.323 -0.853 . . . . 16.97 108.985 178.431 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 45.7 t80 -39.7 -24.62 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 120.628 0.251 . . . . 15.28 111.604 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.443 ' N ' ' O ' ' A' ' 137' ' ' ASN . 46.7 mt-10 -80.79 -55.42 4.82 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.724 0.297 . . . . 14.82 110.803 -179.871 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.506 ' HB2' HG21 ' A' ' 136' ' ' ILE . 29.6 mt-10 -58.66 -35.64 72.87 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.152 0.501 . . . . 17.46 110.256 179.614 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.594 ' HA ' ' HE3' ' A' ' 144' ' ' MET . 86.9 t80 -65.39 -55.43 18.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.658 -0.701 . . . . 13.65 110.296 179.484 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . 0.522 ' HA ' HD13 ' A' ' 145' ' ' ILE . 2.6 t -48.53 -34.18 5.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.55 -0.75 . . . . 11.12 111.78 179.366 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 143' ' ' TRP . . . . . 0.487 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 92.5 t90 -71.53 -55.51 7.69 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.577 0.584 . . . . 14.4 112.577 -178.79 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 144' ' ' MET . . . . . 0.594 ' HE3' ' HA ' ' A' ' 141' ' ' PHE . 21.5 ptt? -63.33 -26.53 68.8 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 112.819 0.674 . . . . 14.63 112.819 -177.675 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . 0.522 HD13 ' HA ' ' A' ' 142' ' ' VAL . 47.4 pt -81.01 -37.67 16.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 112.318 0.488 . . . . 11.62 112.318 -179.525 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 146' ' ' SER . . . . . 0.507 ' N ' HG13 ' A' ' 145' ' ' ILE . 33.2 t -59.32 -14.25 10.92 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.32 0.581 . . . . 8.66 110.583 -179.537 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 147' ' ' GLN . . . . . 0.487 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 3.5 mm-40 -100.58 -20.5 15.66 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.298 -0.865 . . . . 11.87 111.245 -178.993 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 68.5 mttm . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.179 -0.915 . . . . 13.97 110.87 179.744 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 149' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 151' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 88.2 p . . . . . 0 N--CA 1.486 1.356 0 CA-C-O 120.835 0.35 . . . . 5.2 110.995 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -164.92 50.85 0.11 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.134 -0.484 . . . . 3.26 110.496 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 15.6 mt -58.45 119.45 7.0 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.846 -0.615 . . . . 2.0 111.051 -179.756 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 75.0 p -69.41 -169.11 0.19 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.103 -0.499 . . . . 1.72 111.44 -179.65 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -76.25 -38.26 56.54 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.35 -0.386 . . . . 2.2 111.025 -179.565 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -72.75 -42.45 64.04 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.143 -0.48 . . . . 1.35 110.928 -179.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -60.16 -47.81 84.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.144 -0.48 . . . . 2.34 110.645 179.758 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.554 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 82.4 mt -57.38 -52.23 59.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.863 -0.608 . . . . 1.27 111.195 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.91 -23.67 65.41 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.276 -0.42 . . . . 1.22 112.024 -179.411 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -71.42 -57.36 4.51 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 111.865 0.32 . . . . 2.27 111.865 -179.124 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.554 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 17.2 p90 -77.52 -23.43 50.19 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 120.47 -0.492 . . . . 0.46 110.645 -179.546 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.437 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 19.9 tptm -66.94 -36.07 81.4 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 109.229 -0.656 . . . . 1.85 109.229 178.528 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -67.89 -46.3 72.02 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 108.75 -0.833 . . . . 0.44 108.75 178.081 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.03 -14.46 61.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.488 -0.778 . . . . 1.08 110.188 178.628 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.437 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 49.9 t80 -80.0 -52.16 8.18 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.819 -0.628 . . . . 0.56 110.683 -179.839 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 24.6 m -63.43 -24.95 37.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.118 -0.492 . . . . 1.69 110.516 -179.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 61.3 mm-40 -57.7 -28.67 64.04 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.671 -0.695 . . . . 2.23 111.331 179.544 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -105.23 36.53 2.45 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.665 0.269 . . . . 0.69 111.472 -179.692 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -129.69 68.9 1.42 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.157 0.503 . . . . 0.46 110.396 179.398 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -83.07 5.14 23.4 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.655 -0.702 . . . . 2.55 111.222 -179.727 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -103.0 -2.77 27.03 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.367 -0.379 . . . . 1.8 111.193 -179.519 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 63.23 17.89 59.85 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.828 -0.701 . . . . 0.54 112.812 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 37.5 p -92.18 8.39 38.24 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.71 0.291 . . . . 1.1 111.242 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 54.14 21.45 18.26 Favored Glycine 0 C--N 1.333 0.383 0 C-N-CA 120.732 -0.747 . . . . 0.37 111.79 -179.445 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.639 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 36.5 mtpt -133.96 155.76 49.37 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.549 -0.326 . . . . 1.75 110.551 -179.295 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.457 ' N ' HE22 ' A' ' 62' ' ' GLN . 49.1 pt -118.73 130.89 72.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 120.901 0.382 . . . . 1.2 111.684 -179.781 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -54.1 135.68 43.1 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.226 -0.443 . . . . 1.04 111.025 179.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.3 t -63.11 -22.2 66.7 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.047 -0.524 . . . . 1.71 111.223 -179.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 41.1 mtp180 -77.74 -3.89 43.56 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.082 -0.508 . . . . 3.53 110.459 179.774 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -113.53 -5.43 13.45 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.942 -0.572 . . . . 2.26 111.142 -179.804 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.57 -44.76 95.84 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 110.15 -0.315 . . . . 1.95 110.15 179.65 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -58.43 -43.39 95.86 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.332 -0.937 . . . . 0.32 110.976 178.828 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 44.8 m -65.16 -30.72 71.66 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.494 -0.558 . . . . 1.01 109.494 178.544 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 13.7 tp -64.21 -35.4 80.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.382 -0.826 . . . . 1.85 109.506 179.247 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.516 ' HG3' ' HG3' ' A' ' 43' ' ' PRO . 20.3 mmt -66.4 -41.28 89.56 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 115.535 -0.757 . . . . 1.43 109.895 178.852 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 59.8 mtp180 -63.5 -26.95 68.95 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.628 -0.715 . . . . 3.27 109.93 179.075 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.498 HG21 HD12 ' A' ' 39' ' ' LEU . 2.5 m -79.32 -16.56 56.16 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.536 -0.757 . . . . 1.54 110.025 179.322 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.498 HD12 HG21 ' A' ' 38' ' ' THR . 10.3 mp -113.99 157.74 22.07 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.261 -0.881 . . . . 1.94 110.225 179.861 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -74.03 36.33 0.91 Allowed Glycine 0 CA--C 1.519 0.319 0 C-N-CA 120.498 -0.858 . . . . 0.69 112.439 179.485 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.459 ' H ' ' C ' ' A' ' 39' ' ' LEU . 4.5 mm100 -89.29 -70.57 0.65 Allowed 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.831 0.348 . . . . 1.97 111.306 -179.88 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 60.24 67.48 1.64 Allowed Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 115.945 -0.57 . . . . 3.44 110.488 -179.189 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.516 ' HG3' ' HG3' ' A' ' 36' ' ' MET . 69.3 Cg_endo -72.8 -172.86 1.04 Allowed 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.68 2.253 . . . . 0.59 112.466 -179.88 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -93.01 150.35 20.6 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.936 -0.574 . . . . 1.28 111.003 179.684 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.474 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 15.6 mt-10 -54.6 -46.13 73.77 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.524 -0.307 . . . . 2.7 110.645 179.685 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -55.69 -52.94 62.16 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.302 -0.408 . . . . 1.15 111.067 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -54.62 -47.26 73.65 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.182 -0.463 . . . . 2.23 110.893 -179.884 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.461 HD21 HD13 ' A' ' 52' ' ' ILE . 15.3 mt -60.39 -45.29 94.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.323 -0.399 . . . . 2.01 110.971 179.746 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.474 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 33.0 mm-40 -63.08 -33.67 75.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.693 0.282 . . . . 1.68 111.145 -179.717 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -72.12 -54.03 10.97 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.214 0.45 . . . . 0.62 112.214 -179.299 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 3.2 pp -69.99 -41.26 74.63 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.127 0.417 . . . . 1.11 112.127 -178.768 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.461 HD13 HD21 ' A' ' 48' ' ' LEU . 86.6 mt -65.3 -38.72 83.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-O 120.485 0.183 . . . . 1.25 111.093 -179.654 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.65 -37.91 83.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.89 0.376 . . . . 1.24 110.516 179.487 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -64.38 -40.89 96.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.069 -0.514 . . . . 2.54 109.994 179.164 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -80.16 -14.76 58.22 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.968 -0.56 . . . . 1.19 111.021 179.241 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -66.57 -49.96 64.69 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.262 -0.426 . . . . 1.95 110.948 -179.885 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 34.9 m-80 -85.88 34.85 0.61 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.151 -0.477 . . . . 3.19 110.806 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -157.41 151.57 24.73 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.165 -0.47 . . . . 2.69 110.757 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 4.1 m120 63.25 10.3 4.57 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.981 -0.554 . . . . 2.05 111.404 179.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 15.2 m120 62.74 13.33 6.34 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.336 -0.393 . . . . 1.67 111.845 179.702 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 104.67 38.5 2.55 Favored Glycine 0 C--N 1.33 0.247 0 C-N-CA 120.551 -0.833 . . . . 0.86 112.763 179.419 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.639 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -142.5 155.61 45.06 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.991 0.424 . . . . 0.49 110.886 179.688 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 29.0 mt -127.19 154.22 45.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.233 -0.44 . . . . 2.05 110.92 -179.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . 0.493 ' OD1' ' HE3' ' A' ' 26' ' ' LYS . 0.3 OUTLIER -114.37 157.33 22.98 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.665 -0.494 . . . . 1.52 109.665 179.113 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 90.6 t80 -41.19 -33.88 0.41 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.578 0.228 . . . . 0.46 111.361 179.871 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 8.2 m -70.78 -39.84 72.95 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.505 -0.316 . . . . 1.41 111.622 -179.766 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -59.71 -55.75 30.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.126 0.489 . . . . 1.36 110.804 179.668 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 25.3 t80 -63.77 -52.26 61.15 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.649 -0.705 . . . . 0.61 111.145 -179.646 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 19.4 t -53.87 -40.85 66.92 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-O 121.378 0.609 . . . . 1.41 109.886 179.577 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -53.38 -46.6 64.09 Favored Glycine 0 CA--C 1.503 -0.704 0 CA-C-N 114.909 -1.041 . . . . 0.41 111.719 179.523 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.513 ' HA ' ' HG2' ' A' ' 74' ' ' LYS . 44.8 mt -73.42 -45.86 50.89 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.93 0 CA-C-O 120.863 0.364 . . . . 1.13 111.44 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' MET . . . . . 0.416 ' O ' ' HB2' ' A' ' 76' ' ' MET . 0.1 OUTLIER -52.18 -33.45 40.73 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.816 -0.629 . . . . 1.24 110.181 179.235 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.91 -51.07 43.88 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.729 -0.669 . . . . 1.17 110.874 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.513 ' HG2' ' HA ' ' A' ' 71' ' ' ILE . 63.6 pttt -69.63 -27.27 64.92 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 120.85 0.357 . . . . 1.91 111.622 -179.82 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . 0.448 ' NE2' ' HB3' ' A' ' 43' ' ' PRO . 30.8 tt0 -80.63 -55.11 5.07 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.24 -0.436 . . . . 2.03 111.816 -179.141 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' MET . . . . . 0.416 ' HB2' ' O ' ' A' ' 72' ' ' MET . 31.6 mtm -53.94 -47.39 71.32 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.313 -0.403 . . . . 1.52 111.166 -179.514 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 40.8 mmt180 -70.12 -34.17 72.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.535 -0.302 . . . . 5.25 110.525 179.704 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.506 ' HG2' HG21 ' A' ' 79' ' ' THR . 41.3 tt0 57.87 -85.79 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.928 -0.578 . . . . 4.01 111.254 179.83 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' THR . . . . . 0.506 HG21 ' HG2' ' A' ' 78' ' ' GLU . 63.7 p -130.06 130.28 44.69 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.411 -0.359 . . . . 5.71 111.052 -179.917 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -104.23 22.23 15.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.146 -0.479 . . . . 5.6 111.239 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.429 ' O ' ' HG3' ' A' ' 85' ' ' MET . 75.4 m 60.03 89.39 0.07 Allowed 'General case' 0 N--CA 1.461 0.105 0 CA-C-N 116.323 -0.398 . . . . 7.48 110.571 -179.717 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.536 ' HA ' ' SD ' ' A' ' 85' ' ' MET . 44.9 mt-10 -79.78 -16.69 55.07 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 112.534 0.568 . . . . 9.74 112.534 -178.713 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -69.18 -55.85 9.38 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.697 0.284 . . . . 12.11 111.638 -179.402 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -63.42 -15.23 56.99 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.922 0.392 . . . . 10.87 111.061 -179.798 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' MET . . . . . 0.536 ' SD ' ' HA ' ' A' ' 82' ' ' GLU . 19.0 mtt -80.18 -53.81 6.33 Favored 'General case' 0 CA--C 1.514 -0.405 0 CA-C-N 116.087 -0.506 . . . . 11.09 110.224 -179.65 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.497 ' HE ' ' HZ1' ' A' ' 90' ' ' LYS . 38.4 ttt180 -51.56 -41.04 60.84 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.28 -0.873 . . . . 16.05 110.378 179.362 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -72.15 -35.17 69.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.122 -0.49 . . . . 14.85 110.423 179.274 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -69.17 -28.3 66.29 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.123 -0.49 . . . . 14.11 111.051 179.713 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 86.3 t80 -73.82 -46.21 46.6 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.322 -0.399 . . . . 16.42 110.445 179.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.497 ' HZ1' ' HE ' ' A' ' 86' ' ' ARG . 90.5 mttt -58.25 -38.14 76.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.015 -0.539 . . . . 17.66 110.309 179.32 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 86.2 mt -75.69 -38.63 38.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.697 -0.683 . . . . 18.15 111.314 -179.782 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.4 ' O ' ' NE ' ' A' ' 94' ' ' ARG . 0.2 OUTLIER -66.14 -56.85 9.37 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.494 -0.321 . . . . 18.34 111.108 -179.621 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.561 ' HA ' HH21 ' A' ' 94' ' ' ARG . 44.1 t0 -49.11 123.44 7.25 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-O 120.789 0.328 . . . . 19.29 110.253 -179.884 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.671 ' H ' ' HE ' ' A' ' 94' ' ' ARG . 0.0 OUTLIER -91.84 -7.44 49.41 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.209 -0.45 . . . . 22.47 111.848 -178.513 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -126.55 -176.68 3.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.921 0.391 . . . . 23.34 110.904 179.788 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.45 0.7 55.71 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.916 -0.659 . . . . 22.77 112.229 179.643 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.93 -37.98 89.44 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.758 0.313 . . . . 23.0 111.239 -179.86 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 95.55 20.53 26.71 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.853 -0.689 . . . . 20.02 112.6 179.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . 0.407 ' HA ' ' O ' ' A' ' 136' ' ' ILE . 95.7 m-85 -136.32 151.77 49.96 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.702 0.286 . . . . 20.56 110.803 179.855 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.477 ' HB ' ' HB ' ' A' ' 136' ' ' ILE . 45.7 mt -114.96 133.04 62.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-O 121.096 0.474 . . . . 19.37 111.66 -179.606 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 75.7 m -114.57 156.06 45.19 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 115.576 -0.738 . . . . 22.65 110.119 179.2 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_exo -42.45 -47.53 7.38 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.529 2.153 . . . . 23.78 112.699 -179.454 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -59.61 -42.89 93.66 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.199 0.523 . . . . 25.0 111.045 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -65.51 -55.13 19.49 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.655 -0.702 . . . . 22.31 109.796 -179.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.568 HD22 ' HE2' ' A' ' 124' ' ' MET . 40.6 tp -49.26 -34.63 15.6 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.002 -0.999 . . . . 20.62 110.325 179.443 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.406 ' O ' HG13 ' A' ' 110' ' ' ILE . 2.4 tmm_? -69.86 -35.99 75.15 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.591 -0.732 . . . . 27.9 110.873 -179.781 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 68.0 t80 -67.0 -48.53 68.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.064 -0.516 . . . . 25.96 112.213 -179.389 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.432 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 99.3 t -67.92 -48.79 73.65 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 N-CA-C 112.103 0.408 . . . . 21.06 112.103 -179.045 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.481 ' HE2' HD13 ' A' ' 112' ' ' LEU . 2.2 mmt -45.23 -33.92 2.57 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 120.839 0.352 . . . . 20.93 110.833 179.987 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.406 HG13 ' O ' ' A' ' 106' ' ' ARG . 67.2 mt -74.05 -44.38 50.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.105 -0.498 . . . . 25.52 110.766 179.501 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 81.2 m-20 -59.56 -24.97 64.16 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.947 -0.57 . . . . 23.32 110.699 179.641 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.481 HD13 ' HE2' ' A' ' 109' ' ' MET . 64.0 mt -75.67 -32.52 60.19 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.94 -0.573 . . . . 21.07 110.626 179.997 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 121.71 -2.77 11.03 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.821 -0.704 . . . . 23.25 112.847 179.596 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -109.87 122.5 47.67 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.896 0.379 . . . . 22.59 111.379 -179.76 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 63.8 tttm -80.24 142.71 34.37 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.073 -0.512 . . . . 28.21 110.601 179.65 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . 0.455 ' HB ' HG21 ' A' ' 121' ' ' ILE . 1.9 m -150.09 155.51 7.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 121.074 0.464 . . . . 24.75 111.791 -179.697 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' THR . . . . . 0.413 ' O ' HG12 ' A' ' 121' ' ' ILE . 61.5 p -100.03 144.13 29.43 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.706 -0.679 . . . . 27.5 110.153 179.169 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -51.38 -18.98 1.16 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.265 -0.425 . . . . 27.03 111.698 -179.449 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -78.23 -54.08 6.63 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.575 -0.284 . . . . 29.14 111.647 -179.579 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -63.86 -40.34 96.35 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 111.808 0.299 . . . . 24.7 111.808 -179.146 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.52 HG13 ' N ' ' A' ' 122' ' ' ASP . 11.4 pt -70.64 -41.65 77.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 C-N-CA 121.025 -0.27 . . . . 22.9 111.588 -179.524 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.52 ' N ' HG13 ' A' ' 121' ' ' ILE . 21.4 t70 -58.7 -37.36 75.92 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.975 0.417 . . . . 24.29 110.161 179.568 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -65.82 -41.87 91.32 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.973 -0.558 . . . . 24.74 110.067 179.285 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.568 ' HE2' HD22 ' A' ' 105' ' ' LEU . 67.7 ttp -57.97 -36.56 72.76 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.069 -0.514 . . . . 20.15 110.057 178.969 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.417 HG23 HD13 ' A' ' 136' ' ' ILE . 84.1 mt -63.21 -42.64 97.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.799 -0.637 . . . . 20.23 109.822 179.203 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 1.8 tmm_? -58.06 -52.0 67.35 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.512 -0.767 . . . . 25.57 110.335 179.406 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -54.59 -23.57 17.5 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.124 -0.944 . . . . 19.18 111.78 -179.894 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.614 ' HB1' ' HB3' ' A' ' 144' ' ' MET . . . -107.53 -10.58 15.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.839 0.352 . . . . 16.88 111.497 -179.776 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 27.6 t0 -98.36 106.14 18.38 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.218 -0.446 . . . . 20.4 110.932 -179.529 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 34.5 m-85 -85.41 -48.47 8.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.845 -0.616 . . . . 21.43 111.287 -179.59 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -60.14 -21.9 62.17 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.174 -0.466 . . . . 23.37 111.38 -179.656 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 60.75 77.01 0.2 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.654 -0.784 . . . . 24.32 112.614 179.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 13.1 p-10 -133.82 -15.83 2.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.848 0.356 . . . . 24.4 110.786 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 93.14 10.43 59.67 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.854 -0.688 . . . . 23.47 112.391 -179.887 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 38.1 mtp -131.31 154.52 48.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.606 0.241 . . . . 22.91 110.551 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.514 HG22 ' HB2' ' A' ' 140' ' ' GLU . 36.9 mm -114.86 144.23 22.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 121.331 0.586 . . . . 18.67 111.992 -179.256 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . 0.48 ' N ' HG22 ' A' ' 136' ' ' ILE . 48.9 t30 -114.8 157.06 23.77 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.069 -0.969 . . . . 16.97 108.94 178.364 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 7.9 t80 -41.71 -23.14 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 120.663 0.268 . . . . 15.28 111.524 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.425 ' N ' ' O ' ' A' ' 137' ' ' ASN . 44.5 mt-10 -80.22 -56.01 4.52 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.684 0.278 . . . . 14.82 110.946 -179.806 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.514 ' HB2' HG22 ' A' ' 136' ' ' ILE . 34.1 mt-10 -59.23 -31.39 69.01 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.155 0.502 . . . . 17.46 110.23 179.629 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.599 ' HA ' ' HE2' ' A' ' 144' ' ' MET . 89.0 t80 -69.34 -55.48 10.29 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.503 -0.771 . . . . 13.65 110.271 179.568 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . 0.524 HG23 ' HB3' ' A' ' 85' ' ' MET . 2.4 t -44.43 -42.38 2.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.569 -0.741 . . . . 11.12 112.036 179.075 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 143' ' ' TRP . . . . . 0.479 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 92.6 t90 -69.94 -56.09 7.94 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.329 0.492 . . . . 14.4 112.329 -178.849 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 144' ' ' MET . . . . . 0.614 ' HB3' ' HB1' ' A' ' 128' ' ' ALA . 20.3 ptt? -61.72 -21.17 64.26 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 113.27 0.841 . . . . 14.63 113.27 -177.723 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . 0.591 ' HA ' ' HB2' ' A' ' 148' ' ' LYS . 38.0 pt -80.79 -43.9 21.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 C-N-CA 120.619 -0.432 . . . . 11.62 111.813 -179.939 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 146' ' ' SER . . . . . 0.467 ' N ' HG13 ' A' ' 145' ' ' ILE . 31.2 t -63.07 -14.69 51.33 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.297 0.57 . . . . 8.66 109.933 179.602 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 147' ' ' GLN . . . . . 0.479 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 2.4 mm-40 -119.52 2.8 11.25 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.171 -0.922 . . . . 11.87 110.488 -179.232 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . 0.591 ' HB2' ' HA ' ' A' ' 145' ' ' ILE . 26.3 ttpp . . . . . 0 C--O 1.25 1.084 0 CA-C-O 118.249 -0.882 . . . . 13.97 110.987 -179.793 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 149' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 151' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 53.5 p . . . . . 0 N--CA 1.487 1.397 0 CA-C-O 120.704 0.288 . . . . 5.2 110.984 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 55.31 69.22 0.76 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.164 -0.471 . . . . 3.26 111.279 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.415 ' HG ' ' HE2' ' A' ' 12' ' ' PHE . 7.9 mp -54.42 93.28 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.942 -0.572 . . . . 2.0 110.896 179.457 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 36.9 p -78.63 -173.39 3.38 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.208 -0.451 . . . . 1.72 111.538 -179.77 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -63.68 -42.91 97.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.272 -0.422 . . . . 2.2 111.515 -179.664 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -69.83 -42.44 73.6 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.082 0.467 . . . . 1.35 110.51 -179.615 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 28.0 mt-30 -63.84 -41.39 97.83 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.564 -0.744 . . . . 2.34 110.671 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.483 ' HA ' ' CZ ' ' A' ' 12' ' ' PHE . 45.8 mt -60.71 -51.95 67.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.034 -0.53 . . . . 1.27 110.57 179.592 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.94 -23.19 66.2 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.022 -0.535 . . . . 1.22 111.376 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -69.8 -56.64 6.6 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 111.903 0.334 . . . . 2.27 111.903 -179.224 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.483 ' CZ ' ' HA ' ' A' ' 9' ' ' ILE . 11.0 p90 -78.83 -26.92 44.2 Favored 'General case' 0 C--N 1.332 -0.187 0 C-N-CA 120.491 -0.484 . . . . 0.46 110.879 -179.78 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 19.4 tptm -63.67 -34.68 78.4 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.208 -0.664 . . . . 1.85 109.208 178.701 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.414 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 18.2 t70 -70.23 -53.34 17.4 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.644 -0.707 . . . . 0.44 109.206 178.384 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.0 -14.29 22.03 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.535 -0.757 . . . . 1.08 110.749 179.165 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 41.8 t80 -80.34 -52.84 7.21 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.957 -0.565 . . . . 0.56 110.961 -179.746 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 23.3 m -66.97 -17.92 23.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.076 -0.511 . . . . 1.69 110.787 -179.595 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.414 ' HG2' ' O ' ' A' ' 14' ' ' ASP . 74.0 mm-40 -65.95 -29.52 69.93 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.81 -0.632 . . . . 2.23 111.636 179.857 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 36.4 m-85 -101.24 18.34 20.19 Favored 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 111.818 0.303 . . . . 0.69 111.818 -179.665 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -115.23 80.37 1.42 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.966 0.413 . . . . 0.46 110.798 179.424 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 14.1 tppt? -87.82 -29.39 20.99 Favored 'General case' 0 N--CA 1.441 -0.918 0 CA-C-N 115.878 -0.601 . . . . 2.55 110.66 -179.872 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -68.07 -16.72 64.14 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.116 -0.493 . . . . 1.8 111.404 -179.473 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.39 9.67 86.82 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.731 -0.747 . . . . 0.54 112.937 179.703 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 34.6 p -79.65 8.18 7.04 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.619 0.247 . . . . 1.1 111.012 179.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 55.43 21.43 27.12 Favored Glycine 0 C--N 1.333 0.379 0 C-N-CA 120.733 -0.746 . . . . 0.37 111.707 -179.58 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.636 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 53.9 mtpt -134.88 155.13 51.22 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.577 -0.311 . . . . 1.75 110.775 -179.091 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.626 HG13 ' HB2' ' A' ' 63' ' ' LEU . 20.5 pt -115.52 127.7 73.01 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.317 0 CA-C-O 120.921 0.391 . . . . 1.2 111.964 -178.963 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -53.09 139.84 27.32 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.1 -0.5 . . . . 1.04 111.427 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.401 ' HA ' HD11 ' A' ' 63' ' ' LEU . 7.3 t -65.72 -20.9 66.45 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.992 -0.549 . . . . 1.71 111.454 -179.749 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.478 ' H ' ' HD3' ' A' ' 30' ' ' ARG . 0.0 OUTLIER -83.6 5.08 25.59 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.881 0.372 . . . . 3.53 110.48 179.64 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -120.29 -6.65 9.85 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.845 -0.616 . . . . 2.26 111.006 -179.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.484 HD13 HD12 ' A' ' 51' ' ' LEU . 10.3 tt -58.46 -51.5 69.57 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 116.482 -0.326 . . . . 1.95 110.791 179.751 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.4 ' HA2' HD21 ' A' ' 48' ' ' LEU . . . -52.7 -48.07 57.07 Favored Glycine 0 C--N 1.332 0.331 0 C-N-CA 120.33 -0.938 . . . . 0.32 111.335 179.405 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.468 ' HA ' ' HG2' ' A' ' 37' ' ' ARG . 88.6 m -57.94 -36.65 72.81 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.394 0.616 . . . . 1.01 109.54 178.493 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.5 -32.1 73.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.087 -0.961 . . . . 1.85 110.297 179.532 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 23.7 mmt -73.83 -26.72 60.74 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.891 -0.595 . . . . 1.43 110.316 179.388 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.468 ' HG2' ' HA ' ' A' ' 34' ' ' THR . 17.9 mmt180 -66.78 -50.86 61.33 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.818 -0.628 . . . . 3.27 110.271 179.566 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.428 HG23 ' HG ' ' A' ' 39' ' ' LEU . 7.9 t -65.05 -12.62 52.55 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.772 -0.649 . . . . 1.54 111.313 179.833 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.451 ' C ' ' H ' ' A' ' 41' ' ' GLN . 64.8 mt -112.77 156.32 23.05 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.205 -0.452 . . . . 1.94 110.614 -179.825 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -67.45 10.68 0.94 Allowed Glycine 0 CA--C 1.521 0.441 0 C-N-CA 121.022 -0.608 . . . . 0.69 113.141 -179.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.451 ' H ' ' C ' ' A' ' 39' ' ' LEU . 15.8 mm-40 -67.4 -79.03 0.05 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.92 0.39 . . . . 1.97 111.122 179.798 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 56.44 68.7 2.09 Favored Pre-proline 0 C--N 1.331 -0.217 0 CA-C-N 115.923 -0.581 . . . . 3.44 111.065 -179.628 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.555 ' HG2' HD23 ' A' ' 48' ' ' LEU . 61.5 Cg_endo -71.9 -171.53 0.69 Allowed 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.687 2.258 . . . . 0.59 112.346 179.86 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 38.1 m -94.87 152.42 18.39 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.161 -0.472 . . . . 1.28 110.639 179.716 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.406 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 37.4 tt0 -48.85 -53.07 20.91 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.574 -0.285 . . . . 2.7 111.28 -179.651 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -46.92 -54.69 9.49 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.298 -0.41 . . . . 1.15 111.424 -179.752 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -54.91 -50.29 69.17 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.358 -0.383 . . . . 2.23 110.82 179.876 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.555 HD23 ' HG2' ' A' ' 43' ' ' PRO . 0.1 OUTLIER -55.82 -36.09 67.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.115 -0.493 . . . . 2.01 111.032 -179.879 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.406 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 28.5 mm-40 -75.88 -32.16 59.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.256 -0.429 . . . . 1.68 111.247 -179.707 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 64.7 m-20 -70.1 -55.42 9.5 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.464 -0.334 . . . . 0.62 111.09 -179.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.495 HD22 ' HA ' ' A' ' 48' ' ' LEU . 1.9 pp -59.19 -39.44 82.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.314 -0.403 . . . . 1.11 111.116 -179.923 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 35.8 mt -64.52 -40.8 90.31 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-O 120.636 0.255 . . . . 1.25 110.594 179.429 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.89 -30.92 71.2 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.383 -0.371 . . . . 1.24 111.003 179.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -80.46 -47.33 14.49 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.105 -0.498 . . . . 2.54 111.394 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -75.49 -14.86 60.45 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.351 0.5 . . . . 1.19 112.351 -179.16 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -69.31 -38.71 78.37 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.705 0.288 . . . . 1.95 111.065 -179.486 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 30.6 m-80 -95.25 28.79 2.71 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.346 -0.388 . . . . 3.19 110.563 179.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.588 HD21 ' N ' ' A' ' 59' ' ' ASN . 0.2 OUTLIER -148.92 138.43 21.8 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.109 -0.496 . . . . 2.69 110.542 -179.679 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . 0.588 ' N ' HD21 ' A' ' 58' ' ' ASN . 77.4 m-20 62.68 14.58 7.33 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.181 -0.463 . . . . 2.05 111.118 179.909 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 22.3 m-80 58.47 13.62 2.58 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.034 -0.53 . . . . 1.67 111.711 179.469 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 113.78 48.22 0.59 Allowed Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.564 -0.827 . . . . 0.86 113.045 179.483 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.636 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -146.22 153.8 41.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.109 0.48 . . . . 0.49 111.198 179.513 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.626 ' HB2' HG13 ' A' ' 27' ' ' ILE . 16.3 mt -126.6 156.71 40.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.631 -0.713 . . . . 2.05 110.549 -179.623 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . 0.437 ' OD1' ' HE3' ' A' ' 26' ' ' LYS . 0.1 OUTLIER -112.68 156.6 22.48 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 121.023 -0.271 . . . . 1.52 110.447 179.674 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.413 ' O ' ' HB2' ' A' ' 69' ' ' CYS . 83.9 t80 -45.59 -32.51 2.35 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.751 0.31 . . . . 0.46 110.998 179.639 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -80.39 -36.86 33.28 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 112.16 0.43 . . . . 1.41 112.16 -179.555 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -62.71 -51.54 66.79 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.473 0.654 . . . . 1.36 109.802 179.478 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.424 ' O ' ' HG3' ' A' ' 72' ' ' MET . 35.3 t80 -61.66 -48.13 82.23 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.999 -1.0 . . . . 0.61 110.578 179.378 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.413 ' HB2' ' O ' ' A' ' 65' ' ' PHE . 7.8 t -57.96 -48.36 80.18 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.156 -0.475 . . . . 1.41 110.528 179.86 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -48.47 -48.6 27.81 Favored Glycine 0 N--CA 1.45 -0.415 0 CA-C-N 115.72 -0.673 . . . . 0.41 112.03 179.863 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.538 HG23 ' HE2' ' A' ' 74' ' ' LYS . 15.3 mt -63.49 -43.65 98.46 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.362 0 CA-C-O 121.153 0.502 . . . . 1.13 110.504 179.41 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' MET . . . . . 0.424 ' HG3' ' O ' ' A' ' 68' ' ' PHE . 49.6 mtp -58.34 -26.67 63.38 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.637 -0.71 . . . . 1.24 110.076 179.535 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -72.55 -43.66 63.18 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.003 -0.544 . . . . 1.17 110.704 179.557 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.538 ' HE2' HG23 ' A' ' 71' ' ' ILE . 48.7 pttt -73.9 -30.29 62.52 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.234 -0.439 . . . . 1.91 111.125 -179.877 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -80.45 -47.19 14.7 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.112 0.412 . . . . 2.03 112.112 -179.694 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' MET . . . . . 0.41 ' HB2' ' O ' ' A' ' 72' ' ' MET . 48.2 mtp -68.83 -29.81 68.22 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 112.065 0.395 . . . . 1.52 112.065 -179.0 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 28.2 ptt180 -67.51 -14.38 62.88 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.461 0.172 . . . . 5.25 111.207 -179.772 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.439 ' HG2' HG23 ' A' ' 79' ' ' THR . 43.1 tt0 -41.03 -77.02 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.228 -0.442 . . . . 4.01 111.663 -179.523 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' THR . . . . . 0.439 HG23 ' HG2' ' A' ' 78' ' ' GLU . 41.8 p -139.82 142.56 36.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.871 0.367 . . . . 5.71 111.442 -179.797 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -169.08 -8.05 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.986 -0.552 . . . . 5.6 110.596 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.454 ' HG1' ' H ' ' A' ' 83' ' ' GLU . 5.7 t -102.27 122.74 44.8 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.027 -0.533 . . . . 7.48 111.042 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -55.87 -17.65 6.91 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.917 -0.583 . . . . 9.74 112.232 -179.034 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.454 ' H ' ' HG1' ' A' ' 81' ' ' THR . 13.6 mm-40 -68.43 -56.37 8.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.917 0.389 . . . . 12.11 111.264 -179.583 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -72.99 -15.29 61.54 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.114 0.483 . . . . 10.87 110.379 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' MET . . . . . 0.54 ' HB3' HG22 ' A' ' 142' ' ' VAL . 15.0 mtt -76.37 -48.4 20.04 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.83 -0.623 . . . . 11.09 110.393 -179.779 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.417 ' O ' ' HG3' ' A' ' 90' ' ' LYS . 19.9 ttt180 -62.82 -41.95 99.52 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.546 -0.539 . . . . 16.05 109.546 179.354 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -55.16 -43.47 74.29 Favored 'General case' 0 C--O 1.233 0.214 0 N-CA-C 109.402 -0.592 . . . . 14.85 109.402 178.525 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.54 -28.37 67.74 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.541 -0.754 . . . . 14.11 110.667 179.132 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 82.4 t80 -66.84 -39.12 87.53 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 116.231 -0.44 . . . . 16.42 110.472 179.638 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.44 ' HZ1' ' HB3' ' A' ' 90' ' ' LYS . 2.7 mtpm? -64.48 -49.14 72.57 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.27 0.557 . . . . 17.66 110.269 179.327 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 60.6 mt -62.96 -45.13 99.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.255 -0.884 . . . . 18.15 111.479 -179.228 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.409 ' CG ' HG11 ' A' ' 108' ' ' VAL . 0.6 OUTLIER -68.28 -18.65 64.59 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.252 -0.431 . . . . 18.34 111.59 -179.378 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 48.2 t0 -99.01 103.9 15.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.049 0.452 . . . . 19.29 110.702 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.516 ' HB2' ' HG2' ' A' ' 104' ' ' GLU . 0.0 OUTLIER -67.68 -11.63 58.72 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.773 -0.649 . . . . 22.47 111.681 -179.461 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . 0.446 ' HB2' ' OD1' ' A' ' 97' ' ' ASP . 28.2 m-20 -116.65 166.98 11.49 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.986 0.422 . . . . 23.34 111.193 -179.789 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.61 5.15 56.81 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.973 -0.632 . . . . 22.77 112.375 179.498 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.446 ' OD1' ' HB2' ' A' ' 95' ' ' ASP . 7.6 p-10 -61.68 -38.13 86.67 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.665 0.269 . . . . 23.0 111.13 -179.691 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 111.34 18.73 7.93 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.738 -0.744 . . . . 20.02 112.749 179.843 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . 0.431 ' HA ' ' O ' ' A' ' 136' ' ' ILE . 92.3 m-85 -145.35 153.48 41.28 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 120.622 0.249 . . . . 20.56 110.854 179.803 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 63.9 mt -114.01 139.76 38.09 Favored 'Isoleucine or valine' 0 C--O 1.231 0.107 0 CA-C-O 121.014 0.435 . . . . 19.37 111.312 -179.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 16.5 m -121.77 156.22 59.25 Favored Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 115.747 -0.66 . . . . 22.65 110.434 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_exo -43.56 -32.95 4.11 Favored 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.498 2.132 . . . . 23.78 112.508 -179.753 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -62.55 -48.75 78.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.095 0.474 . . . . 25.0 111.248 179.91 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . 0.516 ' HG2' ' HB2' ' A' ' 94' ' ' ARG . 33.5 mt-10 -73.08 -42.15 63.33 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.652 -0.704 . . . . 22.31 110.193 -179.662 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -48.89 -54.33 15.82 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.425 -0.807 . . . . 20.62 109.624 179.794 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.48 ' HB2' HD11 ' A' ' 121' ' ' ILE . 17.1 ttp180 -58.29 -51.11 71.15 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.19 -0.914 . . . . 27.9 110.844 179.851 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 50.3 t80 -56.23 -26.35 50.91 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.029 -0.532 . . . . 25.96 112.012 -179.147 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.469 HG23 ' O ' ' A' ' 104' ' ' GLU . 58.8 t -80.55 -55.38 8.67 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.16 0 N-CA-C 112.549 0.574 . . . . 21.06 112.549 -179.063 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' MET . . . . . 0.487 ' SD ' HG23 ' A' ' 116' ' ' VAL . 0.1 OUTLIER -48.58 -47.42 39.68 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.277 0.561 . . . . 20.93 110.48 -179.347 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.415 HD13 ' HG3' ' A' ' 106' ' ' ARG . 27.7 mt -60.27 -30.79 46.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.257 -0.883 . . . . 25.52 111.187 -179.806 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . 0.415 HD21 HH21 ' A' ' 94' ' ' ARG . 92.6 m-20 -72.9 -28.99 62.81 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.22 -0.445 . . . . 23.32 110.846 179.29 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 6.5 mt -76.06 -27.64 57.33 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.159 -0.473 . . . . 21.07 110.695 -179.889 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 121.77 12.1 5.64 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.865 -0.683 . . . . 23.25 112.441 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -117.51 135.21 54.09 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.86 0.362 . . . . 22.59 111.133 -179.843 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -93.54 134.99 35.25 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.114 -0.494 . . . . 28.21 110.6 179.783 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . 0.487 HG23 ' SD ' ' A' ' 109' ' ' MET . 8.6 m -144.58 155.44 14.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 121.116 0.484 . . . . 24.75 111.986 -179.562 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 45.1 p -100.9 150.38 22.91 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.486 -0.779 . . . . 27.5 109.939 178.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -54.65 -19.74 6.72 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.736 0.303 . . . . 27.03 111.361 -179.66 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -78.73 -54.19 6.35 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.28 -0.418 . . . . 29.14 111.824 -179.364 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . 0.44 ' OE1' HG12 ' A' ' 116' ' ' VAL . 13.5 pt-20 -61.34 -36.52 80.39 Favored 'General case' 0 C--O 1.233 0.237 0 N-CA-C 111.612 0.227 . . . . 24.7 111.612 -179.171 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.5 HG13 ' N ' ' A' ' 122' ' ' ASP . 22.0 pt -73.47 -37.61 51.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 C-N-CA 121.041 -0.264 . . . . 22.9 111.017 179.86 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.5 ' N ' HG13 ' A' ' 121' ' ' ILE . 17.4 t70 -59.36 -38.36 80.23 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.991 0.425 . . . . 24.29 110.179 179.27 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -65.35 -49.97 67.36 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.863 -0.608 . . . . 24.74 110.474 179.542 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.415 ' SD ' ' HE2' ' A' ' 148' ' ' LYS . 56.3 ttp -52.44 -46.01 66.23 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.375 -0.375 . . . . 20.15 110.717 179.641 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.504 HG22 HD12 ' A' ' 136' ' ' ILE . 79.2 mt -61.6 -33.48 57.43 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 CA-C-N 116.072 -0.513 . . . . 20.23 110.742 179.476 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 16.7 tpt85 -65.74 -36.14 82.73 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.261 -0.427 . . . . 25.57 110.994 -179.613 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -62.48 -43.5 98.67 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.939 -0.573 . . . . 19.18 111.663 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.661 ' HB1' ' HB3' ' A' ' 144' ' ' MET . . . -87.75 -18.64 28.97 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.303 -0.408 . . . . 16.88 111.756 -179.301 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . 0.447 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 22.3 t70 -93.75 106.65 18.61 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.027 0.441 . . . . 20.4 111.124 -179.627 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 79.1 m-85 -91.6 -33.0 15.29 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.824 -0.626 . . . . 21.43 110.669 179.839 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -64.12 -18.74 64.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.12 -0.491 . . . . 23.37 110.555 179.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 64.98 19.1 65.36 Favored Glycine 0 N--CA 1.45 -0.388 0 CA-C-N 115.632 -0.713 . . . . 24.32 112.467 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 7.8 p30 -86.29 3.89 41.35 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.608 0.242 . . . . 24.4 111.458 -179.749 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 62.09 23.28 63.74 Favored Glycine 0 N--CA 1.453 -0.221 0 C-N-CA 120.653 -0.785 . . . . 23.47 112.369 -179.854 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 92.8 mmm -130.73 145.54 51.97 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 110.36 -0.237 . . . . 22.91 110.36 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.504 HD12 HG22 ' A' ' 125' ' ' ILE . 50.4 mm -115.44 145.36 21.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.325 0.583 . . . . 18.67 112.104 -179.555 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . 0.471 ' O ' ' N ' ' A' ' 139' ' ' GLU . 29.1 p-10 -122.99 158.43 30.51 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.157 -0.929 . . . . 16.97 108.753 178.239 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 18.0 t80 -38.5 -23.72 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 112.193 0.442 . . . . 15.28 112.193 -179.746 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.471 ' N ' ' O ' ' A' ' 137' ' ' ASN . 45.0 mt-10 -80.46 -56.14 4.39 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.678 0.275 . . . . 14.82 111.517 -179.454 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.459 ' HB2' HG22 ' A' ' 136' ' ' ILE . 34.3 mt-10 -63.13 -34.94 78.69 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.077 0.465 . . . . 17.46 110.506 179.944 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.511 ' HA ' ' HE1' ' A' ' 144' ' ' MET . 88.0 t80 -63.74 -55.51 22.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.746 -0.661 . . . . 13.65 110.51 179.725 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . 0.54 HG22 ' HB3' ' A' ' 85' ' ' MET . 4.6 t -48.28 -42.54 11.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.79 -0.641 . . . . 11.12 111.732 179.353 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 143' ' ' TRP . . . . . 0.463 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 83.4 t90 -61.76 -55.32 31.36 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.53 0.567 . . . . 14.4 112.53 -178.704 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 144' ' ' MET . . . . . 0.661 ' HB3' ' HB1' ' A' ' 128' ' ' ALA . 11.9 ptt? -64.02 -40.04 95.45 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 112.797 0.666 . . . . 14.63 112.797 -177.653 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . 0.455 HG21 ' CZ ' ' A' ' 141' ' ' PHE . 37.2 pt -65.42 -29.09 46.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 N-CA-C 111.931 0.345 . . . . 11.62 111.931 -179.268 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 146' ' ' SER . . . . . 0.466 ' HB3' ' NE2' ' A' ' 147' ' ' GLN . 41.7 t -69.09 -32.98 72.8 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.901 0.381 . . . . 8.66 110.459 -179.751 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 147' ' ' GLN . . . . . 0.466 ' NE2' ' HB3' ' A' ' 146' ' ' SER . 8.6 mm-40 -95.98 -16.04 21.94 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.912 -0.585 . . . . 11.87 111.478 -179.895 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . 0.447 ' HG3' ' O ' ' A' ' 144' ' ' MET . 68.9 mttt . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.293 -0.861 . . . . 13.97 111.183 179.661 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 149' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 151' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.6 m . . . . . 0 N--CA 1.486 1.331 0 CA-C-O 120.847 0.356 . . . . 5.2 110.851 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -151.97 133.23 14.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.079 -0.51 . . . . 3.26 110.751 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.43 ' HA ' ' NE2' ' A' ' 8' ' ' GLN . 39.3 mt -67.4 91.69 0.27 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.322 -0.399 . . . . 2.0 110.602 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 66.4 p -66.49 -159.94 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.81 -0.632 . . . . 1.72 111.651 -179.635 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -76.78 -45.22 29.77 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.345 -0.389 . . . . 2.2 110.948 -179.508 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.409 ' HG3' ' H ' ' A' ' 8' ' ' GLN . 0.0 OUTLIER -71.79 -39.26 70.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.99 -0.55 . . . . 1.35 110.687 -179.782 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . 0.43 ' NE2' ' HA ' ' A' ' 4' ' ' LEU . 29.1 mt-30 -60.94 -47.33 86.93 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.961 -0.563 . . . . 2.34 110.659 179.696 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.437 ' HA ' ' CZ ' ' A' ' 12' ' ' PHE . 66.8 mt -59.7 -54.3 36.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.087 -0.506 . . . . 1.27 110.897 179.712 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.31 -18.7 51.43 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.253 -0.43 . . . . 1.22 111.682 -179.707 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -74.21 -56.87 4.4 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.617 0.246 . . . . 2.27 111.65 -179.491 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.437 ' CZ ' ' HA ' ' A' ' 9' ' ' ILE . 9.5 p90 -79.4 -20.85 46.6 Favored 'General case' 0 C--N 1.332 -0.158 0 C-N-CA 120.598 -0.441 . . . . 0.46 110.747 -179.9 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.409 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 19.7 tptm -70.28 -39.32 74.98 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.204 -0.665 . . . . 1.85 109.204 178.644 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -64.93 -47.53 77.4 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 108.735 -0.839 . . . . 0.44 108.735 177.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.45 -28.88 70.12 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.429 -0.805 . . . . 1.08 110.02 178.581 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.409 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 30.1 t80 -67.33 -40.98 85.97 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.546 -0.752 . . . . 0.56 110.238 179.364 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -68.83 -28.27 39.11 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.784 0 CA-C-N 115.73 -0.668 . . . . 1.69 110.972 -179.82 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 83.7 mm-40 -61.5 -33.11 73.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.597 -0.729 . . . . 2.23 111.332 -179.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -93.74 -5.83 47.48 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.497 -0.319 . . . . 0.69 111.45 -179.617 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -95.14 78.39 3.51 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.901 0.382 . . . . 0.46 110.467 179.301 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 29.7 mmmt -90.94 -33.24 15.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.945 -0.57 . . . . 2.55 111.19 -179.636 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -62.43 -23.98 67.16 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.226 -0.443 . . . . 1.8 111.177 -179.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 87.09 11.41 69.88 Favored Glycine 0 N--CA 1.453 -0.213 0 C-N-CA 120.758 -0.734 . . . . 0.54 112.627 179.774 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 30.3 p -86.1 11.26 12.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.778 0.323 . . . . 1.1 111.139 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 55.26 25.11 39.14 Favored Glycine 0 C--N 1.332 0.327 0 C-N-CA 120.813 -0.708 . . . . 0.37 112.227 -179.824 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.598 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 42.5 mtpt -134.09 155.8 49.4 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.788 0.327 . . . . 1.75 111.032 -179.58 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.501 HG13 ' HB2' ' A' ' 63' ' ' LEU . 30.8 pt -114.96 136.18 52.47 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.325 0 N-CA-C 112.27 0.47 . . . . 1.2 112.27 -178.825 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.92 135.35 57.55 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.262 -0.426 . . . . 1.04 111.343 179.734 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 9.9 t -65.75 -23.35 66.72 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.996 -0.547 . . . . 1.71 111.179 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 29.9 mtp180 -77.79 -2.57 37.02 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.069 -0.514 . . . . 3.53 110.372 179.556 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -111.79 -6.18 14.33 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.759 -0.655 . . . . 2.26 110.872 179.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -51.78 -50.94 59.73 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.944 -0.571 . . . . 1.95 110.46 179.675 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -58.78 -43.02 96.73 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.63 -0.795 . . . . 0.32 111.828 179.515 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 31.1 m -59.15 -32.24 69.7 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.989 0.424 . . . . 1.01 110.516 179.428 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.3 mt -67.51 -41.23 84.76 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 115.851 -0.613 . . . . 1.85 110.643 179.771 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.55 ' HG3' ' HG3' ' A' ' 43' ' ' PRO . 14.6 mmt -66.91 -25.66 66.48 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.013 -0.539 . . . . 1.43 110.741 179.894 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -74.85 -47.82 28.27 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.855 -0.611 . . . . 3.27 110.954 179.453 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.493 HG21 ' HG ' ' A' ' 39' ' ' LEU . 9.9 t -70.52 -13.69 62.21 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.98 0.419 . . . . 1.54 111.033 179.758 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.493 ' HG ' HG21 ' A' ' 38' ' ' THR . 57.4 mt -113.85 156.65 23.53 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.92 -0.582 . . . . 1.94 110.626 -179.798 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -52.92 -11.44 1.36 Allowed Glycine 0 CA--C 1.521 0.45 0 C-N-CA 121.178 -0.534 . . . . 0.69 113.269 -179.764 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -58.63 166.03 1.99 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.931 0.396 . . . . 1.97 111.181 179.673 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 46.3 t30 -172.55 73.72 0.44 Allowed Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 115.884 -0.598 . . . . 3.44 110.513 179.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.55 ' HG3' ' HG3' ' A' ' 36' ' ' MET . 83.1 Cg_endo -80.18 158.34 23.33 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.741 2.294 . . . . 0.59 112.712 -179.779 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.0 p -67.83 146.32 53.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.98 -0.555 . . . . 1.28 110.932 179.55 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.1 tt0 -48.38 -49.23 35.51 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.86 0.362 . . . . 2.7 110.791 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.22 -44.81 88.37 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.998 -0.546 . . . . 1.15 111.127 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -54.28 -46.42 72.7 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.248 -0.433 . . . . 2.23 110.935 -179.939 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 37.8 mt -60.84 -45.16 95.59 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.337 -0.392 . . . . 2.01 110.826 179.702 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 81.7 mm-40 -64.67 -27.51 68.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.455 -0.339 . . . . 1.68 111.161 -179.674 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 43.5 m-20 -74.8 -55.07 6.21 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.477 -0.328 . . . . 0.62 111.633 -179.652 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 2.4 pp -67.38 -41.12 85.55 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.468 -0.333 . . . . 1.11 111.701 -179.316 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 76.9 mt -62.77 -45.88 97.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 120.637 0.256 . . . . 1.25 110.853 -179.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.89 -33.68 75.19 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.886 0.374 . . . . 1.24 110.516 179.53 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -63.6 -44.31 94.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.985 -0.552 . . . . 2.54 110.004 179.302 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -79.7 -16.89 54.85 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.915 -0.584 . . . . 1.19 110.871 179.253 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -73.55 -43.0 60.95 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.122 -0.49 . . . . 1.95 111.035 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -102.87 47.83 0.88 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.143 -0.48 . . . . 3.19 111.118 -179.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -167.55 -55.17 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.2 -0.454 . . . . 2.69 110.927 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 38.2 m-80 -97.4 24.85 6.12 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.171 -0.468 . . . . 2.05 110.751 179.846 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 8.0 m120 64.81 -80.08 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 115.89 -0.595 . . . . 1.67 111.239 179.904 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -165.88 18.97 0.1 OUTLIER Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.804 -0.712 . . . . 0.86 112.418 179.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.598 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -128.31 155.49 44.55 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.96 0.409 . . . . 0.49 111.373 -179.837 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.501 ' HB2' HG13 ' A' ' 27' ' ' ILE . 14.8 mt -126.09 155.46 41.56 Favored 'General case' 0 C--O 1.222 -0.361 0 CA-C-N 115.834 -0.621 . . . . 2.05 110.7 -179.631 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . 0.467 ' HB2' ' HG3' ' A' ' 67' ' ' GLU . 1.4 m-20 -111.68 156.51 21.75 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.652 -0.249 . . . . 1.52 110.552 -179.607 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 90.0 t80 -43.86 -39.53 3.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.427 -0.351 . . . . 0.46 111.399 -179.524 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -70.48 -39.07 74.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.528 -0.306 . . . . 1.41 111.67 -179.878 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.467 ' HG3' ' HB2' ' A' ' 64' ' ' ASN . 14.0 mt-10 -62.06 -53.64 52.66 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.426 0.631 . . . . 1.36 109.695 179.523 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.425 ' O ' ' HG2' ' A' ' 72' ' ' MET . 31.3 t80 -59.69 -54.98 40.05 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.934 -1.03 . . . . 0.61 110.497 179.309 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 36.2 t -51.02 -53.97 28.81 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-N 116.169 -0.469 . . . . 1.41 110.458 179.506 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -41.82 -54.71 4.22 Favored Glycine 0 N--CA 1.451 -0.305 0 CA-C-N 115.281 -0.872 . . . . 0.41 112.462 179.702 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.494 HG22 ' HE2' ' A' ' 74' ' ' LYS . 14.0 mt -64.84 -48.91 82.41 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.26 0 CA-C-O 121.037 0.446 . . . . 1.13 110.946 179.692 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' MET . . . . . 0.425 ' HG2' ' O ' ' A' ' 68' ' ' PHE . 81.2 mmm -47.79 -36.82 12.32 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.833 -0.622 . . . . 1.24 110.042 179.289 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.491 ' O ' ' HG3' ' A' ' 77' ' ' ARG . . . -63.73 -55.34 23.99 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.415 -0.812 . . . . 1.17 110.974 179.407 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.494 ' HE2' HG22 ' A' ' 71' ' ' ILE . 61.1 pttt -60.17 -33.32 72.03 Favored 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 112.017 0.377 . . . . 1.91 112.017 -179.199 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 65.1 mt-30 -78.82 -51.96 9.0 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 111.77 0.285 . . . . 2.03 111.77 -179.873 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 2.2 mmm -56.7 -19.07 14.71 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 116.336 -0.393 . . . . 1.52 111.68 -179.431 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . 0.491 ' HG3' ' O ' ' A' ' 73' ' ' ALA . 67.1 mtm180 -45.22 -34.54 2.85 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 120.762 0.315 . . . . 5.25 110.792 179.054 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -71.32 82.67 0.76 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.127 -0.488 . . . . 4.01 110.562 179.482 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 13.5 t -157.29 -8.93 0.09 Allowed 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.971 0.415 . . . . 5.71 110.943 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -107.3 139.46 41.73 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.835 -0.62 . . . . 5.6 110.9 179.631 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.595 ' O ' ' HG3' ' A' ' 85' ' ' MET . 13.5 m -141.64 79.69 1.69 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.985 -0.552 . . . . 7.48 110.692 179.209 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -39.54 -49.51 2.14 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 115.381 -0.827 . . . . 9.74 112.973 -178.589 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -56.7 -43.62 80.71 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.86 0.362 . . . . 12.11 111.199 -179.463 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -75.25 -14.53 60.53 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.058 -0.519 . . . . 10.87 111.248 -179.596 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' MET . . . . . 0.595 ' HG3' ' O ' ' A' ' 81' ' ' THR . 4.5 mtt -80.55 -30.69 37.06 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 121.181 0.515 . . . . 11.09 110.081 -179.889 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 20.9 ttt180 -78.81 -45.44 20.91 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.383 -0.826 . . . . 16.05 110.6 -179.697 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -66.14 -42.58 88.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.125 -0.489 . . . . 14.85 110.872 179.63 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.1 -39.26 86.7 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.24 -0.436 . . . . 14.11 111.257 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -59.2 -42.24 90.44 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.043 0.449 . . . . 16.42 110.61 179.86 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.542 ' HZ1' ' HB3' ' A' ' 90' ' ' LYS . 5.5 mtpm? -63.32 -43.15 98.62 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.707 -0.679 . . . . 17.66 111.274 179.798 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 83.4 mt -62.67 -50.58 79.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.188 -0.46 . . . . 18.15 111.624 -179.531 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -64.67 -38.74 92.03 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.559 -0.291 . . . . 18.34 111.332 -179.504 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 29.3 t0 -66.27 91.97 0.18 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.046 0.45 . . . . 19.29 110.27 179.597 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 2.7 mmp_? -62.05 -2.31 0.89 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.692 -0.686 . . . . 22.47 112.156 -179.316 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 40.8 m-20 -124.78 177.95 5.73 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.942 0.401 . . . . 23.34 110.968 179.66 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.55 -4.41 54.81 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.947 -0.644 . . . . 22.77 111.947 179.29 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.88 -39.25 87.44 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.76 0.314 . . . . 23.0 111.324 -179.919 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 104.2 40.72 2.21 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.741 -0.742 . . . . 20.02 112.312 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . 0.44 ' HA ' ' O ' ' A' ' 136' ' ' ILE . 95.6 m-85 -143.62 142.04 30.87 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.675 0.274 . . . . 20.56 110.86 -179.96 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.491 ' HB ' ' HB ' ' A' ' 136' ' ' ILE . 56.6 mt -114.22 120.94 65.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.196 0 CA-C-O 121.069 0.462 . . . . 19.37 111.1 -179.937 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 31.8 p -114.38 156.18 44.81 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 115.799 -0.637 . . . . 22.65 110.564 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -40.58 -36.06 1.69 Allowed 'Trans proline' 0 C--N 1.349 0.589 0 C-N-CA 122.592 2.195 . . . . 23.78 112.66 -179.6 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.436 ' O ' ' HG3' ' A' ' 106' ' ' ARG . . . -68.04 -55.41 12.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.078 0.466 . . . . 25.0 111.172 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -62.49 -31.1 71.79 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.924 -0.58 . . . . 22.31 110.956 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.542 HD22 ' HB ' ' A' ' 121' ' ' ILE . 37.2 tp -68.42 -55.28 12.44 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.715 -0.675 . . . . 20.62 112.004 -178.45 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.441 ' HB3' HD11 ' A' ' 121' ' ' ILE . 0.3 OUTLIER -57.07 -40.22 76.46 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.758 0.313 . . . . 27.9 111.485 -179.003 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 21.1 t80 -58.02 -54.17 49.93 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.361 -0.381 . . . . 25.96 111.255 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 48.3 t -67.9 -40.73 83.98 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.197 0 CA-C-N 116.725 -0.216 . . . . 21.06 111.332 -179.764 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -50.8 -38.6 49.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.846 0.355 . . . . 20.93 110.791 179.972 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.717 ' HA ' ' HA ' ' A' ' 114' ' ' GLU . 88.0 mt -67.27 -24.12 31.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.044 -0.525 . . . . 25.52 111.244 179.648 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -72.56 -21.27 61.18 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.069 -0.514 . . . . 23.32 110.354 179.167 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 6.2 mp -93.76 -84.8 0.3 Allowed 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.168 -0.469 . . . . 21.07 111.415 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . 0.465 ' O ' ' HG2' ' A' ' 114' ' ' GLU . . . -117.49 -1.64 17.88 Favored Glycine 0 C--N 1.334 0.435 0 C-N-CA 120.702 -0.761 . . . . 23.25 112.696 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . 0.717 ' HA ' ' HA ' ' A' ' 110' ' ' ILE . 9.1 pt-20 42.62 -170.12 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 114.284 1.216 . . . . 22.59 114.284 179.137 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . 0.676 ' HB3' ' HZ3' ' A' ' 115' ' ' LYS . 3.4 mmmp? 66.11 54.64 0.96 Allowed 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 114.535 -1.212 . . . . 28.21 111.548 -179.81 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . 0.492 ' HB ' HG22 ' A' ' 121' ' ' ILE . 1.5 m -130.11 115.38 32.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.998 -0.546 . . . . 24.75 110.991 178.837 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' THR . . . . . 0.431 ' HG1' ' HG2' ' A' ' 120' ' ' GLU . 72.9 p -69.32 146.69 51.99 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.186 -0.461 . . . . 27.5 110.257 179.713 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . 0.459 ' HA ' HD12 ' A' ' 121' ' ' ILE . 9.2 m-20 -53.63 -17.46 2.19 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.244 -0.434 . . . . 27.03 111.102 -179.897 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -79.77 -55.48 4.97 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.299 -0.41 . . . . 29.14 111.81 -179.559 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . 0.445 ' OE1' HG11 ' A' ' 116' ' ' VAL . 13.5 pt-20 -58.07 -43.69 87.1 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 120.551 0.215 . . . . 24.7 111.395 -179.311 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.542 ' HB ' HD22 ' A' ' 105' ' ' LEU . 1.8 pt -68.68 -40.17 81.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 C-N-CA 121.037 -0.265 . . . . 22.9 111.127 179.795 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.412 ' H ' HG13 ' A' ' 121' ' ' ILE . 16.9 t70 -61.41 -42.05 98.12 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.753 0.311 . . . . 24.29 110.5 179.583 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -57.71 -45.09 86.19 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.24 -0.436 . . . . 24.74 110.264 179.419 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 58.6 ttp -57.57 -37.15 72.66 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.068 -0.515 . . . . 20.15 110.292 179.1 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.46 HG23 HD13 ' A' ' 136' ' ' ILE . 64.4 mt -66.66 -42.3 89.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 115.858 -0.61 . . . . 20.23 110.414 179.386 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 66.0 ttt180 -59.6 -37.29 78.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.794 -0.639 . . . . 25.57 110.931 179.739 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -63.99 -33.16 75.11 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.054 -0.521 . . . . 19.18 111.344 -179.762 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.66 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -95.86 -17.55 21.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.474 -0.33 . . . . 16.88 111.305 -179.824 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . 0.412 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 14.4 t0 -94.31 100.51 12.54 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.211 -0.449 . . . . 20.4 110.761 -179.852 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 88.1 m-85 -85.34 -43.07 14.01 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.899 -0.591 . . . . 21.43 111.462 -179.446 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -60.05 -24.19 64.35 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.413 -0.358 . . . . 23.37 110.798 -179.714 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 66.17 78.02 0.25 Allowed Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.91 -0.662 . . . . 24.32 112.855 179.655 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -135.29 -27.1 1.23 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.769 0.318 . . . . 24.4 110.935 179.715 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 102.9 13.47 29.37 Favored Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.82 -0.705 . . . . 23.47 112.681 179.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 70.2 mtp -133.05 153.63 51.32 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.677 0.275 . . . . 22.91 110.586 179.805 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.542 HG23 ' HB2' ' A' ' 140' ' ' GLU . 42.3 mm -114.95 145.65 20.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 121.282 0.563 . . . . 18.67 111.987 -179.579 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' ASN . . . . . 0.425 ' O ' ' N ' ' A' ' 139' ' ' GLU . 1.0 OUTLIER -119.93 157.19 29.29 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.171 -0.922 . . . . 16.97 108.965 178.136 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 79.9 t80 -39.99 -23.96 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 112.06 0.393 . . . . 15.28 112.06 -179.6 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . 0.425 ' N ' ' O ' ' A' ' 137' ' ' ASN . 38.5 mt-10 -80.76 -56.13 4.35 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 120.697 0.284 . . . . 14.82 111.18 -179.223 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.542 ' HB2' HG23 ' A' ' 136' ' ' ILE . 59.8 mt-10 -60.46 -34.8 74.53 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.341 -0.391 . . . . 17.46 110.353 -179.927 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.539 ' HA ' ' HE2' ' A' ' 144' ' ' MET . 85.3 t80 -63.96 -55.0 25.67 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.0 -0.545 . . . . 13.65 110.125 179.174 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 142' ' ' VAL . . . . . 0.493 HG22 ' HB3' ' A' ' 85' ' ' MET . 2.6 t -47.91 -36.82 5.89 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-N 115.464 -0.789 . . . . 11.12 111.79 179.306 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 143' ' ' TRP . . . . . 0.514 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 91.5 t90 -69.79 -55.96 8.43 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.824 0.675 . . . . 14.4 112.824 -178.737 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 144' ' ' MET . . . . . 0.66 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 18.7 ptt? -63.91 -23.57 67.4 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 113.175 0.805 . . . . 14.63 113.175 -177.521 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 145' ' ' ILE . . . . . 0.518 HG13 ' N ' ' A' ' 146' ' ' SER . 49.2 pt -80.49 -40.7 19.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 N-CA-C 112.399 0.518 . . . . 11.62 112.399 -179.28 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 146' ' ' SER . . . . . 0.518 ' N ' HG13 ' A' ' 145' ' ' ILE . 78.7 p -61.21 -13.79 20.88 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.181 0.515 . . . . 8.66 110.55 -179.71 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 147' ' ' GLN . . . . . 0.514 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 6.3 mm-40 -98.49 -19.11 17.84 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.377 -0.828 . . . . 11.87 111.289 -179.16 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 99.1 mttt . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.234 -0.889 . . . . 13.97 110.959 179.749 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 149' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 151' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.502 HD12 ' SD ' ' A' ' 76' ' ' MET . 0.6 OUTLIER . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.705 0.288 . . . . 1.27 110.35 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 74.0 p -70.01 -177.63 1.39 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.42 -0.355 . . . . 1.1200000000000001 111.341 -179.766 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -63.41 -48.02 79.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.435 -0.348 . . . . 2.2000000000000002 111.492 -179.616 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -67.14 -41.54 85.91 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.976 0.417 . . . . 1.3500000000000001 110.906 -179.425 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 21.6 mm-40 -64.28 -45.63 87.2 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.822 -0.627 . . . . 2.2200000000000002 111.037 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.532 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 56.5 mt -58.1 -51.16 74.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.432 -0.349 . . . . 0.54000000000000004 110.543 179.526 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.87 -19.26 65.7 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.149 -0.478 . . . . 0.5 111.189 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -72.44 -56.57 5.21 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.275 -0.42 . . . . 2.27 111.777 -179.275 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.532 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 28.1 p90 -79.03 -24.41 43.67 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 120.532 -0.467 . . . . 0.37 110.625 -179.739 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 19.7 tptm -66.62 -37.13 84.23 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 109.174 -0.676 . . . . 1.23 109.174 178.525 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.519 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 27.4 t70 -66.97 -50.7 61.48 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 109.121 -0.696 . . . . 0.44 109.121 178.332 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.81 -14.51 59.43 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.679 -0.692 . . . . 0.28999999999999998 110.612 179.042 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 75.5 t80 -80.08 -47.76 14.31 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.845 -0.616 . . . . 0.47999999999999998 110.647 -179.677 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 26.8 m -69.65 -20.49 23.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.142 -0.481 . . . . 1.1100000000000001 110.302 179.525 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.519 ' HG3' ' O ' ' A' ' 14' ' ' ASP . 74.5 mt-30 -58.97 -35.5 73.3 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.729 -0.669 . . . . 1.6000000000000001 111.02 179.434 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 88.1 m-85 -105.91 44.16 1.07 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.276 -0.42 . . . . 0.64000000000000001 111.509 -179.499 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -135.27 70.4 1.44 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.017 0.437 . . . . 0.44 110.72 179.463 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.438 ' N ' ' HD2' ' A' ' 21' ' ' LYS . 0.9 OUTLIER -78.24 -25.95 47.09 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.92 -0.582 . . . . 2.1000000000000001 110.89 179.983 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -70.3 -11.75 61.12 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.011 -0.54 . . . . 1.8 111.213 -179.625 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.46 17.22 66.27 Favored Glycine 0 C--N 1.33 0.208 0 C-N-CA 120.857 -0.687 . . . . 0.46000000000000002 112.898 179.655 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 60.0 p -90.39 8.24 34.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.751 0.31 . . . . 0.40000000000000002 111.181 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 57.93 19.59 37.8 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.854 -0.688 . . . . 0.33000000000000002 112.126 -179.702 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.513 ' HD3' ' OD1' ' A' ' 64' ' ' ASN . 20.7 mtmm -128.23 154.54 45.74 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.928 0.394 . . . . 1.1000000000000001 111.205 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.43 HG13 ' O ' ' A' ' 27' ' ' ILE . 45.7 pt -120.64 129.27 75.79 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.111 -0.495 . . . . 0.5 110.823 179.567 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -53.24 134.88 39.17 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.803 0.335 . . . . 0.29999999999999999 110.882 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 5.9 t -61.2 -17.19 51.89 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.096 -0.502 . . . . 1.03 110.869 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 59.1 mtt180 -78.79 -19.12 52.91 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.885 -0.598 . . . . 3.0800000000000001 110.488 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 33.3 mm-40 -97.28 -2.05 43.42 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.656 -0.702 . . . . 2.2599999999999998 110.9 179.813 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.556 HD23 HD22 ' A' ' 63' ' ' LEU . 0.4 OUTLIER -55.64 -54.79 39.84 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.908 -0.587 . . . . 1.3700000000000001 110.956 -179.956 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -56.14 -39.4 80.57 Favored Glycine 0 C--N 1.331 0.274 0 C-N-CA 120.654 -0.784 . . . . 0.32000000000000001 112.152 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 32.1 m -65.4 -35.96 82.51 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.995 0.426 . . . . 0.31 110.645 179.584 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 24.4 tp -68.52 -36.62 79.11 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.896 -0.593 . . . . 1.24 110.677 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.539 ' HG3' ' HG3' ' A' ' 43' ' ' PRO . 23.2 mmt -62.27 -42.0 98.96 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.273 -0.421 . . . . 1.1000000000000001 109.925 179.098 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -63.92 -33.39 75.59 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.771 -0.65 . . . . 2.6899999999999999 109.691 179.033 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.4 m -72.57 -16.92 61.75 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.315 -0.857 . . . . 1.0600000000000001 110.385 179.352 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 95.1 mt -114.0 157.24 22.73 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.663 -0.698 . . . . 1.26 110.641 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -52.98 -9.88 0.93 Allowed Glycine 0 CA--C 1.521 0.434 0 C-N-CA 120.997 -0.62 . . . . 0.68999999999999995 113.245 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 73.6 mm-40 -66.29 174.45 2.64 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.941 0.401 . . . . 1.97 111.314 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -173.01 67.91 0.37 Allowed Pre-proline 0 C--N 1.331 -0.231 0 CA-C-N 115.805 -0.634 . . . . 2.6600000000000001 110.336 179.688 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.539 ' HG3' ' HG3' ' A' ' 36' ' ' MET . 47.0 Cg_endo -67.87 148.09 75.97 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.595 2.197 . . . . 0.51000000000000001 112.332 -179.8 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 12.4 m -64.68 154.26 37.13 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.09 -0.505 . . . . 0.72999999999999998 110.543 179.811 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.401 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 7.1 tp10 -49.62 -55.07 14.96 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.681 0.276 . . . . 2.7000000000000002 111.22 -179.404 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.63 -46.03 70.34 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.227 -0.442 . . . . 0.46000000000000002 111.507 -179.726 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -51.38 -54.52 25.71 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.335 -0.393 . . . . 2.23 111.146 -179.8 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 47.3 mt -56.9 -40.91 77.17 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.731 0.3 . . . . 1.3600000000000001 111.019 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.401 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 79.5 mm-40 -66.16 -27.56 68.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.885 0.374 . . . . 1.22 111.0 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 30.2 m-20 -76.73 -52.8 8.93 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.106 -0.497 . . . . 0.62 111.85 -179.397 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.4 pp -69.37 -35.45 75.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.481 -0.327 . . . . 0.39000000000000001 111.879 -179.033 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 72.8 mt -69.36 -48.59 66.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.64 0.257 . . . . 0.5 111.138 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.99 -37.37 82.25 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.882 0.372 . . . . 0.58999999999999997 110.757 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -66.58 -51.65 54.09 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.081 -0.509 . . . . 2.54 110.52 179.616 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -67.25 -14.9 63.34 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.01 -0.541 . . . . 0.53000000000000003 111.055 179.891 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -74.34 -27.29 60.62 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.283 -0.417 . . . . 1.95 110.932 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -118.28 7.83 12.13 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.173 -0.467 . . . . 2.48 110.813 179.836 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 57.3 t30 -122.97 -12.68 7.95 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.196 -0.456 . . . . 2.48 110.977 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -140.46 27.18 2.1 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.218 -0.446 . . . . 2.0499999999999998 110.886 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 4.0 m-20 62.01 -85.18 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.917 -0.583 . . . . 1.47 111.118 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -151.85 -3.05 0.19 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.755 -0.736 . . . . 0.42999999999999999 112.409 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 9.4 mm-40 -115.05 154.9 28.01 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.07 0.462 . . . . 0.38 111.071 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.587 ' HG ' ' HB2' ' A' ' 67' ' ' GLU . 0.8 OUTLIER -119.6 156.17 30.89 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.691 -0.686 . . . . 1.4299999999999999 109.96 -179.795 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ASN . . . . . 0.588 ' HB2' ' HG2' ' A' ' 67' ' ' GLU . 52.7 m-80 -111.26 156.4 21.55 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 121.098 0.475 . . . . 1.1899999999999999 111.719 -178.674 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 84.0 t80 -48.11 -41.64 26.98 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.348 -0.842 . . . . 0.40000000000000002 109.96 178.757 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.68 -36.22 82.01 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.483 -0.781 . . . . 0.81000000000000005 111.337 179.421 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.588 ' HG2' ' HB2' ' A' ' 64' ' ' ASN . 8.8 mm-40 -64.69 -55.04 22.51 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.192 -0.458 . . . . 1.3600000000000001 110.004 179.524 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.436 ' HD1' HD21 ' A' ' 32' ' ' LEU . 43.4 t80 -59.2 -54.18 49.89 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.829 -0.623 . . . . 0.51000000000000001 110.541 179.378 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 35.2 t -52.77 -49.31 65.81 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 116.119 -0.491 . . . . 0.75 110.276 179.526 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -43.84 -50.72 7.23 Favored Glycine 0 N--CA 1.451 -0.342 0 CA-C-N 115.613 -0.721 . . . . 0.40999999999999998 112.23 179.225 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.87 HG23 ' HE2' ' A' ' 74' ' ' LYS . 13.5 mt -66.81 -51.4 55.98 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.261 0 CA-C-O 120.912 0.386 . . . . 0.51000000000000001 110.78 179.41 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' MET . . . . . 0.454 ' O ' ' HG3' ' A' ' 76' ' ' MET . 83.8 mmm -45.91 -36.47 5.45 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.932 -0.576 . . . . 1.01 109.766 179.192 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -63.21 -55.03 28.4 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.253 -0.885 . . . . 0.69999999999999996 110.622 179.312 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.87 ' HE2' HG23 ' A' ' 71' ' ' ILE . 58.6 pttt -61.0 -28.62 69.17 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.296 -0.411 . . . . 1.3799999999999999 110.84 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 91.2 mt-30 -77.68 -42.17 35.49 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.233 -0.439 . . . . 1.98 111.266 179.438 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' MET . . . . . 0.502 ' SD ' HD12 ' A' ' 4' ' ' LEU . 2.8 mtt . . . . . 0 N--CA 1.446 -0.628 0 CA-C-N 116.258 -0.428 . . . . 1.2 110.919 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.575 ' O ' ' HG2' ' A' ' 85' ' ' MET . 9.7 t . . . . . 0 C--O 1.226 -0.144 0 N-CA-C 110.503 -0.184 . . . . 7.29 110.503 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -66.55 -23.43 66.22 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 112.558 0.577 . . . . 9.7400000000000002 112.558 -178.741 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -64.45 -56.05 16.79 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-O 121.102 0.477 . . . . 12.109999999999999 111.809 -179.137 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -59.21 -19.31 44.42 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.865 -0.607 . . . . 10.869999999999999 111.118 -179.458 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' MET . . . . . 0.616 ' CB ' HG22 ' A' ' 142' ' ' VAL . 2.0 mmt -74.71 -49.85 19.66 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.137 -0.483 . . . . 11.09 110.609 -179.574 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 46.5 ttt180 -54.85 -43.17 72.81 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.036 -0.529 . . . . 15.52 110.075 179.775 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 25.3 mm-40 -60.37 -42.42 95.79 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.139 0.495 . . . . 14.85 109.973 178.829 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -69.85 -23.08 63.23 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.749 -0.66 . . . . 14.109999999999999 111.075 179.586 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 88.5 t80 -68.98 -41.56 77.75 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.389 -0.369 . . . . 15.73 110.419 179.784 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 50.0 mtmt -68.7 -39.13 80.64 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.92 -0.582 . . . . 17.66 110.646 179.552 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 81.7 mt -68.23 -44.48 84.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.038 -0.528 . . . . 18.149999999999999 111.441 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -67.69 -55.66 12.33 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.526 -0.306 . . . . 18.34 111.366 -179.646 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 41.8 t0 -55.32 99.08 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.823 0.344 . . . . 19.289999999999999 110.409 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.535 ' HG2' ' HB3' ' A' ' 104' ' ' GLU . 21.9 mmm180 -55.86 -33.08 64.21 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.125 -0.488 . . . . 22.25 110.955 -179.399 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.439 ' HB2' ' OD1' ' A' ' 97' ' ' ASP . 6.2 m-20 -101.71 170.13 8.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.189 -0.46 . . . . 23.34 110.929 -179.793 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.45 5.38 57.15 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.794 -0.717 . . . . 22.0 112.384 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.439 ' OD1' ' HB2' ' A' ' 95' ' ' ASP . 5.0 p-10 -58.7 -39.06 79.66 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.706 0.289 . . . . 22.280000000000001 111.307 -179.755 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 114.06 17.12 7.45 Favored Glycine 0 C--N 1.331 0.279 0 C-N-CA 120.698 -0.763 . . . . 19.93 112.91 179.66 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 99.2 m-85 -145.12 152.56 40.26 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 120.74 0.305 . . . . 20.300000000000001 110.829 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 61.2 mt -114.33 138.22 45.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 116.299 -0.41 . . . . 19.370000000000001 111.069 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 41.7 m -114.61 156.13 45.15 Favored Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 115.988 -0.551 . . . . 22.489999999999998 110.939 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_exo -41.76 -39.56 5.13 Favored 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 122.49 2.127 . . . . 23.0 112.281 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.71 -50.2 73.38 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.971 -0.559 . . . . 24.559999999999999 110.613 179.465 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' GLU . . . . . 0.535 ' HB3' ' HG2' ' A' ' 94' ' ' ARG . 44.3 mt-10 -64.53 -28.37 69.6 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.442 -0.799 . . . . 22.23 111.188 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.536 HD23 ' HB ' ' A' ' 121' ' ' ILE . 38.0 tp -64.97 -55.5 18.7 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.285 -0.416 . . . . 20.359999999999999 111.429 -179.076 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.615 ' HB3' HD13 ' A' ' 121' ' ' ILE . 14.6 ptt180 -64.32 -38.76 92.2 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.852 0.358 . . . . 27.190000000000001 110.531 179.893 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 107' ' ' PHE . . . . . 0.452 ' N ' ' HG3' ' A' ' 106' ' ' ARG . 1.7 t80 -54.55 -39.37 67.64 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.957 -0.565 . . . . 25.359999999999999 111.022 -179.544 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.474 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 76.8 t -80.15 -49.65 18.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.521 -0.308 . . . . 21.059999999999999 111.37 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -50.03 -35.54 25.29 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.389 -0.369 . . . . 20.93 111.08 -179.835 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 78.1 mt -75.92 -31.22 21.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.333 -0.394 . . . . 25.129999999999999 110.565 179.505 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 95.2 m-20 -67.8 -43.34 79.9 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.07 -0.514 . . . . 23.32 110.812 179.507 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.474 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 6.2 mt -66.25 -45.33 80.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.069 -0.514 . . . . 21.07 110.826 -179.841 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 137.95 -0.15 2.61 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.922 -0.656 . . . . 23.050000000000001 112.278 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -88.61 104.63 17.02 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.734 0.302 . . . . 22.59 111.201 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -74.04 113.71 11.54 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.298 -0.41 . . . . 27.960000000000001 110.506 179.526 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 116' ' ' VAL . . . . . 0.413 HG12 ' OE1' ' A' ' 120' ' ' GLU . 5.3 m -138.35 155.2 28.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 121.004 0.431 . . . . 24.75 111.789 -179.574 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 117' ' ' THR . . . . . 0.417 ' O ' HG12 ' A' ' 121' ' ' ILE . 64.0 p -99.18 156.76 16.8 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.702 -0.681 . . . . 27.239999999999998 110.448 179.24 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -58.68 -21.4 54.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.41 -0.359 . . . . 26.629999999999999 111.507 -179.658 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -76.31 -55.38 5.61 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 111.874 0.324 . . . . 29.140000000000001 111.874 -179.269 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 120' ' ' GLU . . . . . 0.413 ' OE1' HG12 ' A' ' 116' ' ' VAL . 15.2 pt-20 -61.71 -39.44 91.5 Favored 'General case' 0 C--O 1.234 0.237 0 N-CA-C 111.679 0.251 . . . . 24.190000000000001 111.679 -179.33 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.615 HD13 ' HB3' ' A' ' 106' ' ' ARG . 18.7 pt -71.19 -34.88 56.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 C-N-CA 120.959 -0.297 . . . . 22.329999999999998 111.251 -179.709 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 122' ' ' ASP . . . . . 0.498 ' N ' HG13 ' A' ' 121' ' ' ILE . 15.0 t70 -59.01 -43.84 91.61 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.953 0.406 . . . . 24.289999999999999 110.292 179.583 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -63.85 -42.24 97.61 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.89 -0.596 . . . . 24.739999999999998 110.413 179.44 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.436 ' CE ' HD21 ' A' ' 105' ' ' LEU . 65.1 ttp -56.59 -34.04 66.79 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.15 -0.477 . . . . 19.710000000000001 110.825 179.663 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.574 HG23 HD11 ' A' ' 136' ' ' ILE . 87.0 mt -68.92 -46.09 79.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.237 -0.438 . . . . 19.949999999999999 110.371 179.592 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 27.9 tpt180 -59.57 -31.46 69.46 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.99 -0.55 . . . . 24.949999999999999 111.04 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -66.96 -40.58 87.52 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.17 -0.468 . . . . 18.690000000000001 111.302 -179.817 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.522 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -91.19 -13.59 32.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.376 -0.374 . . . . 16.469999999999999 111.094 -179.865 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 129' ' ' ASP . . . . . 0.447 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 8.7 t70 -95.99 106.72 18.92 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.151 -0.477 . . . . 20.399999999999999 111.054 -179.697 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 87.3 m-85 -98.93 -32.91 11.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.033 -0.53 . . . . 21.43 111.533 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -69.3 -15.5 63.36 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.719 0.295 . . . . 23.370000000000001 110.981 -179.734 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 132' ' ' GLY . . . . . 0.419 ' HA2' ' OD2' ' A' ' 129' ' ' ASP . . . 58.45 84.95 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.835 -0.697 . . . . 24.32 112.874 179.615 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 12.3 p-10 -147.66 -9.64 0.41 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.768 0.318 . . . . 23.879999999999999 111.004 179.745 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 80.14 18.2 72.51 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.835 -0.698 . . . . 22.670000000000002 112.43 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 40.4 mtp -137.52 155.3 49.42 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.576 0.227 . . . . 22.91 110.454 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.72 HG23 ' HB2' ' A' ' 140' ' ' GLU . 48.8 mm -114.79 142.8 26.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 121.404 0.621 . . . . 18.41 112.233 -179.242 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 137' ' ' ASN . . . . . 0.423 ' OD1' ' HB2' ' A' ' 139' ' ' GLU . 1.6 p30 -115.45 157.76 23.51 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.006 -0.997 . . . . 16.82 109.108 178.129 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.624 ' O ' HG23 ' A' ' 142' ' ' VAL . 29.0 t80 -39.12 -25.45 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 112.432 0.53 . . . . 14.65 112.432 -179.239 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 139' ' ' GLU . . . . . 0.423 ' HB2' ' OD1' ' A' ' 137' ' ' ASN . 43.5 mt-10 -80.18 -55.75 4.7 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.692 0.282 . . . . 14.82 111.529 -179.149 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.72 ' HB2' HG23 ' A' ' 136' ' ' ILE . 53.3 mt-10 -61.12 -31.33 71.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.941 0.401 . . . . 17.460000000000001 110.519 -179.825 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.604 ' CE2' HD13 ' A' ' 145' ' ' ILE . 88.9 t80 -67.67 -55.7 12.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.839 -0.619 . . . . 12.93 110.606 179.726 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.624 HG23 ' O ' ' A' ' 138' ' ' TYR . 34.4 t -47.23 -43.39 7.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 115.833 -0.622 . . . . 10.699999999999999 111.964 179.523 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 82.8 t90 -65.29 -55.21 19.61 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.697 0.629 . . . . 13.66 112.697 -178.448 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 144' ' ' MET . . . . . 0.522 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 11.1 ptt? -61.78 -32.39 72.66 Favored 'General case' 0 N--CA 1.464 0.237 0 N-CA-C 112.55 0.574 . . . . 14.5 112.55 -177.996 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 145' ' ' ILE . . . . . 0.604 HD13 ' CE2' ' A' ' 141' ' ' PHE . 25.3 pt -80.71 -20.87 11.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 C-N-CA 120.779 -0.368 . . . . 11.25 111.423 179.835 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 33.2 t -67.66 -32.8 73.73 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.104 0.478 . . . . 8.5399999999999991 110.175 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 5.2 mm100 -84.6 -23.65 29.49 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.595 -0.729 . . . . 11.869999999999999 111.1 180.0 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 63.9 mttm . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.289 -0.863 . . . . 13.68 110.989 179.503 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 21.4 mt . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.78 0.324 . . . . 1.27 110.919 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.554 HG22 ' H ' ' A' ' 6' ' ' GLU . 0.2 OUTLIER -73.44 -171.23 0.94 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.178 -0.465 . . . . 1.1200000000000001 110.869 179.969 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.554 ' H ' HG22 ' A' ' 5' ' ' THR . 9.9 tp10 -69.94 -46.25 65.72 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.134 0.492 . . . . 2.2000000000000002 110.442 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -72.03 -41.9 66.96 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.578 -0.737 . . . . 1.3500000000000001 110.664 179.854 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 -60.55 -45.84 92.41 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.1 -0.5 . . . . 2.2200000000000002 110.603 179.768 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.532 ' HA ' ' CZ ' ' A' ' 12' ' ' PHE . 40.7 mt -57.92 -52.27 60.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.16 -0.473 . . . . 0.54000000000000004 110.879 179.733 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.2 -21.4 65.09 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.068 -0.515 . . . . 0.5 111.716 -179.607 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -72.72 -56.78 4.76 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 111.991 0.367 . . . . 2.27 111.991 -178.987 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.532 ' CZ ' ' HA ' ' A' ' 9' ' ' ILE . 7.5 p90 -77.92 -26.18 48.83 Favored 'General case' 0 C--N 1.332 -0.178 0 C-N-CA 120.674 -0.41 . . . . 0.37 110.789 -179.764 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.436 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 26.7 tptp -65.01 -38.47 91.04 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 109.383 -0.599 . . . . 1.23 109.383 178.971 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.485 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 20.1 t70 -66.65 -48.62 68.83 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 108.945 -0.761 . . . . 0.44 108.945 178.186 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.78 -14.59 59.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.411 -0.813 . . . . 0.28999999999999998 110.723 179.184 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.436 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 88.3 t80 -77.14 -49.89 14.21 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.029 -0.532 . . . . 0.47999999999999998 110.436 -179.579 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 16.5 m -67.32 -22.6 29.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.215 -0.448 . . . . 1.1100000000000001 110.26 179.67 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.485 ' HG2' ' O ' ' A' ' 14' ' ' ASP . 14.5 mm100 -63.85 -20.82 66.1 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.829 -0.623 . . . . 1.6000000000000001 111.379 179.444 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 45.2 m-85 -114.83 24.21 11.96 Favored 'General case' 0 C--N 1.332 -0.156 0 N-CA-C 111.903 0.335 . . . . 0.64000000000000001 111.903 -179.36 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -112.26 81.45 1.47 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.965 0.412 . . . . 0.44 110.504 179.335 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -92.44 -25.52 18.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.832 -0.622 . . . . 2.1000000000000001 111.286 -179.63 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -70.49 -15.33 62.79 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.102 -0.499 . . . . 1.8 111.355 -179.497 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.16 -0.08 68.84 Favored Glycine 0 CA--C 1.518 0.24 0 C-N-CA 120.749 -0.739 . . . . 0.46000000000000002 112.708 179.718 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 40.4 p -82.48 11.9 5.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.632 0.253 . . . . 0.40000000000000002 111.222 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 57.86 24.47 53.92 Favored Glycine 0 C--N 1.33 0.245 0 C-N-CA 120.676 -0.773 . . . . 0.33000000000000002 111.724 -179.489 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.653 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 47.7 mtpt -129.61 155.49 45.75 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.725 0.298 . . . . 1.1000000000000001 110.678 -179.516 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 36.3 pt -118.47 130.85 72.73 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.411 -0.359 . . . . 0.5 111.29 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -50.07 129.38 20.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.372 -0.376 . . . . 0.29999999999999999 111.274 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.418 HG22 HD13 ' A' ' 63' ' ' LEU . 79.7 p -61.55 -21.37 64.22 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.118 -0.492 . . . . 1.03 110.722 179.819 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 51.8 mtp180 -80.91 4.08 20.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.742 -0.663 . . . . 3.0800000000000001 110.201 179.492 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -119.05 -6.63 10.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.547 -0.751 . . . . 2.2599999999999998 110.55 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.49 HD22 HD11 ' A' ' 51' ' ' LEU . 10.2 tt -55.2 -51.18 67.37 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.242 -0.436 . . . . 1.3700000000000001 110.18 179.534 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -52.27 -48.88 52.77 Favored Glycine 0 C--N 1.331 0.288 0 C-N-CA 120.531 -0.842 . . . . 0.32000000000000001 111.496 179.209 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 90.7 m -59.36 -34.44 72.39 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 121.319 0.58 . . . . 0.31 109.848 178.832 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 47.2 tp -70.36 -28.66 65.3 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.296 -0.865 . . . . 1.24 110.26 179.651 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.481 ' HG2' ' O ' ' A' ' 32' ' ' LEU . 23.9 mmm -76.12 -21.42 56.66 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.06 -0.518 . . . . 1.1000000000000001 109.768 179.057 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -75.41 -44.74 42.98 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.651 -0.704 . . . . 2.6899999999999999 110.326 179.071 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.442 HG23 ' HG ' ' A' ' 39' ' ' LEU . 7.9 t -71.51 -13.28 61.76 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.031 -0.531 . . . . 1.0600000000000001 110.416 179.13 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.442 ' HG ' HG23 ' A' ' 38' ' ' THR . 76.7 mt -112.83 157.4 21.43 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.727 -0.67 . . . . 1.26 110.187 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -71.84 34.85 0.61 Allowed Glycine 0 CA--C 1.521 0.449 0 C-N-CA 120.762 -0.733 . . . . 0.68999999999999995 113.34 -179.879 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.735 HE21 ' HA ' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -93.58 -80.68 0.38 Allowed 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.791 0.329 . . . . 1.97 111.087 179.569 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 32.5 m-80 56.81 74.89 0.62 Allowed Pre-proline 0 C--N 1.332 -0.184 0 CA-C-N 115.943 -0.571 . . . . 2.6600000000000001 111.05 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.402 ' HD3' ' HB3' ' A' ' 36' ' ' MET . 92.1 Cg_endo -79.18 173.88 12.78 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.654 2.236 . . . . 0.51000000000000001 112.446 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 19.9 m -69.07 152.71 44.86 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.172 -0.467 . . . . 0.72999999999999998 110.778 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -55.09 -55.21 33.65 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.733 0.302 . . . . 2.7000000000000002 111.128 -179.648 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -54.43 -47.92 72.26 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.092 -0.504 . . . . 0.46000000000000002 111.804 -179.565 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.433 ' HG2' HD23 ' A' ' 51' ' ' LEU . 39.5 tt0 -57.99 -48.24 80.61 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.87 0.367 . . . . 2.23 110.456 -179.629 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.43 ' HA ' HD21 ' A' ' 51' ' ' LEU . 31.8 tp -57.07 -38.61 73.54 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.78 -0.645 . . . . 1.3600000000000001 110.977 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 83.3 mm-40 -72.82 -31.04 64.52 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.303 -0.408 . . . . 1.22 111.551 -179.682 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 28.1 m-20 -73.78 -54.99 6.79 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.547 -0.297 . . . . 0.62 111.8 -179.44 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.49 HD11 HD22 ' A' ' 32' ' ' LEU . 2.2 pp -60.75 -38.57 85.64 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.611 -0.268 . . . . 0.39000000000000001 111.516 -179.226 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 82.4 mt -68.81 -36.75 75.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.934 0.397 . . . . 0.5 110.744 179.595 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.96 -50.76 61.29 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.096 -0.502 . . . . 0.58999999999999997 111.073 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -62.08 -38.53 89.17 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.283 -0.417 . . . . 2.54 110.603 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -73.58 -18.21 61.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.285 -0.416 . . . . 0.53000000000000003 111.04 179.747 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -70.8 -55.02 9.48 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.272 -0.422 . . . . 1.95 110.612 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 3.1 p-10 -89.65 43.68 1.16 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.183 -0.462 . . . . 2.48 110.988 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 67.7 m-20 -155.16 -15.66 0.11 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.705 -0.68 . . . . 2.48 110.61 179.801 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -144.21 21.39 1.73 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.911 -0.586 . . . . 2.0499999999999998 110.613 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 50.3 m-20 64.49 -83.24 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.126 0 CA-C-N 115.861 -0.609 . . . . 1.47 111.314 179.801 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -154.69 19.54 0.59 Allowed Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.793 -0.718 . . . . 0.42999999999999999 112.336 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.653 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 9.6 mm-40 -128.49 155.31 45.03 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.981 0.419 . . . . 0.38 111.156 -179.847 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.552 ' HG ' ' HB2' ' A' ' 67' ' ' GLU . 9.5 tp -124.45 154.09 41.0 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.901 -0.59 . . . . 1.4299999999999999 110.482 -179.604 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ASN . . . . . 0.419 ' CG ' ' HE3' ' A' ' 26' ' ' LYS . 7.6 m-80 -113.41 157.63 21.67 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-O 121.111 0.481 . . . . 1.1899999999999999 111.548 -179.708 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 88.1 t80 -46.88 -43.52 18.85 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.281 -0.872 . . . . 0.40000000000000002 111.02 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -67.62 -34.43 76.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 0.81000000000000005 111.877 -179.82 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.552 ' HB2' ' HG ' ' A' ' 63' ' ' LEU . 22.4 mm-40 -64.39 -53.41 48.95 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.958 0.409 . . . . 1.3600000000000001 110.245 179.682 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.461 ' O ' ' HG3' ' A' ' 72' ' ' MET . 28.0 t80 -59.91 -51.11 71.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.825 -0.625 . . . . 0.51000000000000001 110.336 179.261 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 1.5 m -55.25 -49.67 71.45 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.821 -0.627 . . . . 0.75 111.085 179.727 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -47.51 -49.73 20.14 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.982 -0.627 . . . . 0.40999999999999998 112.212 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.634 HG23 ' HE3' ' A' ' 74' ' ' LYS . 12.7 mt -64.19 -45.56 95.98 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.308 0 CA-C-O 121.015 0.436 . . . . 0.51000000000000001 110.743 179.541 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' MET . . . . . 0.461 ' HG3' ' O ' ' A' ' 68' ' ' PHE . 38.0 mtp -54.84 -25.01 25.68 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.9 -0.591 . . . . 1.01 110.135 179.556 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -76.04 -49.27 18.01 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.36 -0.382 . . . . 0.69999999999999996 110.748 179.69 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.634 ' HE3' HG23 ' A' ' 71' ' ' ILE . 19.2 pttp -65.35 -35.4 80.86 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.516 -0.311 . . . . 1.3799999999999999 111.081 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -81.41 -55.67 4.55 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.728 0.64 . . . . 1.98 112.728 -179.033 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 24.7 mtm . . . . . 0 N--CA 1.453 -0.285 0 N-CA-C 113.066 0.765 . . . . 1.2 113.066 -178.321 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.431 HG23 ' O ' ' A' ' 81' ' ' THR . 3.9 t . . . . . 0 CA--C 1.529 0.138 0 CA-C-O 121.252 0.548 . . . . 7.29 111.605 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.429 ' HB2' ' OH ' ' A' ' 138' ' ' TYR . 11.2 pt-20 -50.25 -20.77 1.13 Allowed 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 112.793 0.664 . . . . 9.7400000000000002 112.793 -178.876 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 25.9 mm-40 -68.78 -57.01 6.21 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.758 0.313 . . . . 12.109999999999999 111.644 -179.312 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -71.86 -27.34 62.81 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.106 0.479 . . . . 10.869999999999999 110.513 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' MET . . . . . 0.563 ' HB3' HD11 ' A' ' 145' ' ' ILE . 27.7 mtp -70.88 -36.09 72.63 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.629 -0.714 . . . . 11.09 110.47 -179.73 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 70.0 ttt180 -68.22 -43.56 77.72 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.973 -0.558 . . . . 15.52 110.2 179.575 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -55.21 -42.91 73.94 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.74 -0.467 . . . . 14.85 109.74 178.847 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' ALA . . . . . 0.428 ' HA ' HD12 ' A' ' 91' ' ' ILE . . . -61.1 -38.44 86.29 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.776 -0.647 . . . . 14.109999999999999 110.688 179.509 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -58.17 -40.89 82.63 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.237 -0.438 . . . . 15.73 110.554 179.624 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 26.3 mtpp -63.96 -37.9 89.11 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.829 -0.623 . . . . 17.66 110.584 179.611 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.428 HD12 ' HA ' ' A' ' 88' ' ' ALA . 66.0 mt -62.32 -44.03 98.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.875 -0.602 . . . . 18.149999999999999 111.598 -179.917 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.507 ' HA ' HG21 ' A' ' 108' ' ' VAL . 18.5 m-85 -80.31 -20.52 44.14 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 111.791 0.293 . . . . 18.34 111.791 -179.614 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -96.88 108.65 21.39 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.892 0.377 . . . . 19.289999999999999 111.047 -179.906 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.82 -58.9 3.33 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.941 -0.572 . . . . 22.25 111.295 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -74.82 158.86 32.72 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.151 -0.477 . . . . 23.34 111.347 -179.466 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -80.88 5.19 66.52 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.796 -0.716 . . . . 22.0 111.429 178.98 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 27.8 p-10 -55.52 -35.06 65.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.904 0.383 . . . . 22.280000000000001 111.384 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 89.86 30.95 11.78 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.867 -0.682 . . . . 19.93 112.167 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -146.78 146.79 30.39 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.639 0.257 . . . . 20.300000000000001 110.902 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.43 HD13 ' HB3' ' A' ' 92' ' ' PHE . 40.4 mt -114.17 125.3 71.44 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-O 120.846 0.355 . . . . 19.370000000000001 111.097 179.773 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 101' ' ' SER . . . . . 0.489 ' OG ' ' HD2' ' A' ' 102' ' ' PRO . 47.3 t -114.61 152.67 46.46 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.055 -0.52 . . . . 22.489999999999998 110.421 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 102' ' ' PRO . . . . . 0.489 ' HD2' ' OG ' ' A' ' 101' ' ' SER . 55.6 Cg_exo -40.05 -34.71 1.01 Allowed 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.564 2.176 . . . . 23.0 112.848 179.669 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.86 -46.57 81.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.292 -0.413 . . . . 24.559999999999999 111.132 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' GLU . . . . . 0.44 ' O ' HG23 ' A' ' 108' ' ' VAL . 43.5 mt-10 -74.37 -39.2 62.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.936 -0.574 . . . . 22.23 110.75 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.875 HD23 ' HB ' ' A' ' 121' ' ' ILE . 8.7 tp -54.86 -49.68 70.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.93 -0.577 . . . . 20.359999999999999 110.407 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 10.4 ttt180 -63.89 -47.85 78.96 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.899 -0.591 . . . . 27.190000000000001 110.582 179.424 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 68.4 t80 -49.91 -43.43 49.63 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.881 -0.6 . . . . 25.359999999999999 111.492 -179.387 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.508 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 53.9 t -72.16 -49.94 40.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.585 -0.28 . . . . 21.059999999999999 111.268 -179.785 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 18.6 mmt -49.13 -49.54 41.69 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.302 -0.408 . . . . 20.93 111.352 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 63.4 mt -59.84 -28.13 40.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.232 -0.44 . . . . 25.129999999999999 110.937 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -77.9 -29.49 50.18 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.122 -0.49 . . . . 23.32 110.937 179.674 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.508 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 14.8 mt -74.47 -41.35 60.92 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.387 -0.37 . . . . 21.07 110.836 -179.892 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 131.28 -0.04 5.12 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.879 -0.677 . . . . 23.050000000000001 112.422 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -101.55 109.27 21.05 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.882 0.372 . . . . 22.59 111.021 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -74.77 113.68 12.33 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.128 -0.487 . . . . 27.960000000000001 111.013 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 116' ' ' VAL . . . . . 0.481 HG12 ' OE1' ' A' ' 120' ' ' GLU . 4.9 m -131.21 146.39 33.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 121.006 0.432 . . . . 24.75 111.437 179.634 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 55.3 p -92.88 152.39 19.43 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.883 -0.599 . . . . 27.239999999999998 110.128 179.306 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -55.79 -19.05 9.97 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.328 -0.396 . . . . 26.629999999999999 111.118 -179.69 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -76.11 -55.48 5.55 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.356 -0.384 . . . . 29.140000000000001 111.709 -179.519 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 120' ' ' GLU . . . . . 0.481 ' OE1' HG12 ' A' ' 116' ' ' VAL . 14.5 pt-20 -62.59 -40.82 98.13 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 111.873 0.323 . . . . 24.190000000000001 111.873 -179.152 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.875 ' HB ' HD23 ' A' ' 105' ' ' LEU . 43.9 pt -70.09 -35.14 62.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 C-N-CA 120.853 -0.339 . . . . 22.329999999999998 111.242 -179.671 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 122' ' ' ASP . . . . . 0.401 ' N ' HG13 ' A' ' 121' ' ' ILE . 13.3 t70 -61.14 -38.83 87.8 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.833 0.349 . . . . 24.289999999999999 110.305 179.437 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -64.52 -46.35 83.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.055 -0.521 . . . . 24.739999999999998 110.446 179.461 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.419 ' CE ' HD21 ' A' ' 105' ' ' LEU . 53.0 ttp -56.58 -39.04 72.82 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 116.09 -0.505 . . . . 19.710000000000001 110.537 179.457 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.607 HD11 HD22 ' A' ' 105' ' ' LEU . 82.1 mt -65.36 -41.3 90.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.914 -0.585 . . . . 19.949999999999999 110.513 179.488 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 69.1 ttt180 -60.52 -32.17 71.2 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.664 -0.698 . . . . 24.949999999999999 110.821 179.666 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -67.79 -36.19 79.99 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.125 -0.489 . . . . 18.690000000000001 111.062 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.75 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -90.93 -15.48 29.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.262 -0.426 . . . . 16.469999999999999 110.964 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 129' ' ' ASP . . . . . 0.44 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 19.1 t70 -98.39 106.67 18.98 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.978 -0.556 . . . . 20.399999999999999 110.902 -179.662 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -94.19 -33.34 13.33 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.805 -0.634 . . . . 21.43 111.448 -179.644 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -67.81 -15.97 63.88 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.87 0.367 . . . . 23.370000000000001 110.649 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 60.41 85.63 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.962 -0.637 . . . . 24.32 112.85 179.713 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -143.05 -35.4 0.4 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.753 0.311 . . . . 23.879999999999999 110.851 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 110.91 6.06 26.66 Favored Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.832 -0.699 . . . . 22.670000000000002 112.729 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 78.3 mtp -131.43 155.26 47.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.631 0.253 . . . . 22.91 110.627 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.662 HG23 ' HB2' ' A' ' 140' ' ' GLU . 48.1 mm -117.33 144.79 24.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 121.203 0.525 . . . . 18.41 111.851 -179.477 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 137' ' ' ASN . . . . . 0.451 ' O ' ' N ' ' A' ' 139' ' ' GLU . 29.8 p-10 -116.92 158.13 24.56 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.354 -0.839 . . . . 16.82 109.194 178.44 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.429 ' OH ' ' HB2' ' A' ' 82' ' ' GLU . 26.8 t80 -39.21 -23.72 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.368 0.507 . . . . 14.65 112.368 -179.534 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 139' ' ' GLU . . . . . 0.451 ' N ' ' O ' ' A' ' 137' ' ' ASN . 45.4 mt-10 -80.45 -56.01 4.48 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 120.744 0.307 . . . . 14.82 111.401 -179.486 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.662 ' HB2' HG23 ' A' ' 136' ' ' ILE . 34.7 mt-10 -62.82 -31.02 71.93 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.908 0.385 . . . . 17.460000000000001 110.38 -179.961 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.56 ' HA ' ' HE2' ' A' ' 144' ' ' MET . 78.0 t80 -66.89 -54.51 21.44 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.976 -0.556 . . . . 12.93 109.689 178.892 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.449 ' HA ' HD11 ' A' ' 145' ' ' ILE . 1.7 t -47.84 -35.44 4.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.306 -0.861 . . . . 10.699999999999999 111.286 179.101 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 143' ' ' TRP . . . . . 0.404 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 79.8 t90 -69.71 -55.32 10.26 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.278 0.473 . . . . 13.66 112.278 -179.42 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 144' ' ' MET . . . . . 0.75 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 21.4 ptt? -65.32 -21.71 66.74 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 113.323 0.861 . . . . 14.5 113.323 -177.627 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 145' ' ' ILE . . . . . 0.635 ' HA ' ' HB2' ' A' ' 148' ' ' LYS . 44.0 pt -80.61 -43.77 21.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 C-N-CA 120.806 -0.357 . . . . 11.25 111.861 -179.821 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 146' ' ' SER . . . . . 0.535 ' N ' HG13 ' A' ' 145' ' ' ILE . 46.9 t -63.67 -13.89 46.98 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 121.472 0.653 . . . . 8.5399999999999991 109.473 179.574 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 147' ' ' GLN . . . . . 0.404 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 6.2 mm-40 -126.19 21.73 7.32 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 114.781 -1.099 . . . . 11.869999999999999 110.025 -179.272 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 148' ' ' LYS . . . . . 0.635 ' HB2' ' HA ' ' A' ' 145' ' ' ILE . 27.2 ttpp . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.203 -0.904 . . . . 13.68 110.931 -179.492 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 11.0 mp . . . . . 0 C--O 1.231 0.092 0 CA-C-O 120.932 0.396 . . . . 1.27 111.014 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.523 HG22 ' H ' ' A' ' 6' ' ' GLU . 0.2 OUTLIER -59.1 177.32 0.17 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.917 -0.583 . . . . 1.1200000000000001 111.181 -179.857 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.523 ' H ' HG22 ' A' ' 5' ' ' THR . 37.7 tt0 -62.88 -42.87 99.93 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.294 0.568 . . . . 2.2000000000000002 109.909 179.691 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -71.27 -39.0 71.83 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.309 -0.859 . . . . 1.3500000000000001 110.521 179.488 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 18.3 mm-40 -62.9 -43.12 99.67 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.894 -0.593 . . . . 2.2200000000000002 110.47 179.623 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.553 ' HA ' ' CZ ' ' A' ' 12' ' ' PHE . 83.6 mt -58.66 -54.35 34.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.139 -0.482 . . . . 0.54000000000000004 110.362 179.572 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.26 -22.38 65.94 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.042 -0.527 . . . . 0.5 111.074 179.741 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -73.38 -56.31 5.22 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.228 -0.442 . . . . 2.27 112.186 -178.91 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.553 ' CZ ' ' HA ' ' A' ' 9' ' ' ILE . 4.7 p90 -78.69 -26.51 44.92 Favored 'General case' 0 C--N 1.332 -0.157 0 C-N-CA 120.542 -0.463 . . . . 0.37 111.255 -179.374 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.431 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 27.8 tptp -67.03 -38.38 85.79 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.649 -0.5 . . . . 1.23 109.649 179.116 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.44 ' O ' HG22 ' A' ' 17' ' ' VAL . 16.8 t70 -66.62 -52.42 45.35 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 109.246 -0.65 . . . . 0.44 109.246 178.34 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.44 -13.66 52.71 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.603 -0.726 . . . . 0.28999999999999998 110.726 179.198 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.431 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 83.0 t80 -76.96 -48.51 17.89 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.083 -0.508 . . . . 0.47999999999999998 110.443 -179.741 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.44 HG22 ' O ' ' A' ' 14' ' ' ASP . 30.8 m -68.73 -22.7 26.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.205 -0.452 . . . . 1.1100000000000001 110.353 179.54 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.435 ' HG2' ' O ' ' A' ' 14' ' ' ASP . 26.3 mm-40 -59.48 -48.28 82.26 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.844 -0.616 . . . . 1.6000000000000001 111.461 179.444 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -88.14 37.34 0.81 Allowed 'General case' 0 N--CA 1.462 0.14 0 CA-C-O 120.771 0.32 . . . . 0.64000000000000001 111.622 -179.541 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -125.11 74.66 1.39 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.065 0.459 . . . . 0.44 110.397 179.328 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -84.72 -21.91 29.92 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.727 -0.67 . . . . 2.1000000000000001 111.309 -179.653 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -75.97 -22.25 56.09 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.978 -0.555 . . . . 1.8 111.398 -179.404 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 82.12 4.53 90.21 Favored Glycine 0 C--N 1.33 0.229 0 C-N-CA 120.678 -0.773 . . . . 0.46000000000000002 112.418 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 60.6 p -82.12 14.74 2.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.652 0.263 . . . . 0.40000000000000002 111.177 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 53.92 22.86 20.91 Favored Glycine 0 C--N 1.332 0.339 0 C-N-CA 120.714 -0.755 . . . . 0.33000000000000002 111.895 -179.498 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.639 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 46.2 mtpt -129.98 155.11 46.63 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.681 -0.259 . . . . 1.1000000000000001 110.692 -179.374 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.682 HG13 ' HB2' ' A' ' 63' ' ' LEU . 15.4 pt -114.89 122.12 68.36 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.203 0 CA-C-O 120.915 0.388 . . . . 0.5 112.021 -179.43 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -52.81 134.71 36.71 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.087 -0.506 . . . . 0.29999999999999999 111.114 179.693 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.0 t -65.53 -13.19 58.38 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.016 -0.538 . . . . 1.03 111.152 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 32.1 mtt180 -80.94 -10.09 59.76 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.012 -0.54 . . . . 3.0800000000000001 110.632 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -116.61 1.12 12.82 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.819 -0.628 . . . . 2.2599999999999998 110.619 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.713 HD11 ' CD1' ' A' ' 68' ' ' PHE . 16.0 tp -64.13 -47.75 78.75 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.382 -0.372 . . . . 1.3700000000000001 110.685 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.421 ' O ' ' HG3' ' A' ' 37' ' ' ARG . . . -51.86 -41.41 51.46 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.246 -0.978 . . . . 0.32000000000000001 110.927 179.115 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.437 ' O ' HG22 ' A' ' 38' ' ' THR . 95.2 m -68.14 -30.63 69.81 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.985 0.421 . . . . 0.31 110.359 179.112 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 60.6 tp -71.73 -41.52 68.39 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.761 -0.654 . . . . 1.24 111.246 -179.816 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.419 ' SD ' ' HG3' ' A' ' 43' ' ' PRO . 48.2 mtp -72.31 -23.9 61.24 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.301 -0.409 . . . . 1.1000000000000001 110.849 179.807 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.421 ' HG3' ' O ' ' A' ' 33' ' ' GLY . 81.9 mtt180 -72.62 -46.14 55.59 Favored 'General case' 0 N--CA 1.461 0.125 0 CA-C-O 120.958 0.408 . . . . 2.6899999999999999 110.297 179.179 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.591 HG23 HD13 ' A' ' 39' ' ' LEU . 1.8 t -68.16 -11.16 58.73 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.958 -0.564 . . . . 1.0600000000000001 110.412 179.023 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.591 HD13 HG23 ' A' ' 38' ' ' THR . 8.4 mp -111.47 156.82 21.09 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.603 -0.726 . . . . 1.26 110.304 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -45.79 -24.42 1.26 Allowed Glycine 0 CA--C 1.519 0.323 0 C-N-CA 121.224 -0.512 . . . . 0.68999999999999995 113.439 -179.652 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.433 ' OE1' ' HB3' ' A' ' 39' ' ' LEU . 19.7 mp0 -57.07 152.94 12.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.893 0.377 . . . . 1.97 111.174 179.811 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 -155.28 71.87 5.61 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.067 -0.515 . . . . 2.6600000000000001 110.952 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.419 ' HG3' ' SD ' ' A' ' 36' ' ' MET . 60.0 Cg_endo -69.24 152.5 72.01 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.789 2.326 . . . . 0.51000000000000001 112.35 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 27.2 m -76.13 151.21 37.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.174 -0.466 . . . . 0.72999999999999998 110.321 179.397 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.445 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 1.3 mp0 -44.55 -55.08 5.43 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.678 0.275 . . . . 2.7000000000000002 111.191 -179.714 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -54.5 -45.01 73.17 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.234 -0.439 . . . . 0.46000000000000002 111.392 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -56.2 -49.83 72.96 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.234 -0.439 . . . . 2.23 111.216 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 17.5 mt -59.74 -41.78 91.73 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.683 0.278 . . . . 1.3600000000000001 110.934 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.445 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 78.0 mm-40 -66.64 -30.28 70.52 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.523 -0.308 . . . . 1.22 111.274 -179.702 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 -75.83 -54.99 6.06 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.424 -0.353 . . . . 0.62 111.431 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 3.1 pp -64.09 -38.14 89.99 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.437 -0.347 . . . . 0.39000000000000001 111.361 -179.469 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 44.9 mt -65.79 -43.92 93.19 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 C-N-CA 121.066 -0.253 . . . . 0.5 110.741 179.68 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.8 -29.55 70.8 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.929 0.395 . . . . 0.58999999999999997 110.739 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -74.59 -52.96 10.34 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.963 -0.562 . . . . 2.54 110.075 179.625 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -69.86 -14.44 62.75 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.014 -0.539 . . . . 0.53000000000000003 111.508 179.786 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -73.6 -37.04 65.56 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.851 0.358 . . . . 1.95 110.965 -179.647 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 38.7 m-80 -89.6 16.67 7.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.235 -0.439 . . . . 2.48 110.656 179.683 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 56.7 t30 -142.39 151.55 41.97 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.905 -0.589 . . . . 2.48 110.627 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 2.5 m120 62.86 9.92 3.98 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.221 -0.445 . . . . 2.0499999999999998 111.17 179.704 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 89.7 m-20 63.03 11.52 5.22 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.329 -0.396 . . . . 1.47 111.827 179.796 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 110.44 44.03 1.02 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.61 -0.805 . . . . 0.42999999999999999 112.822 179.496 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.639 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 10.2 mm-40 -147.62 154.83 41.14 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.066 0.46 . . . . 0.38 111.11 179.856 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.682 ' HB2' HG13 ' A' ' 27' ' ' ILE . 66.4 mt -124.47 155.88 38.18 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.809 -0.632 . . . . 1.4299999999999999 109.982 179.531 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ASN . . . . . 0.475 ' OD1' ' HE3' ' A' ' 26' ' ' LYS . 0.6 OUTLIER -113.15 156.74 22.66 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.924 -0.31 . . . . 1.1899999999999999 110.505 -179.66 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -43.06 -50.23 6.07 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.117 -0.492 . . . . 0.40000000000000002 110.913 179.804 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.7 -29.59 69.62 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.285 -0.416 . . . . 0.81000000000000005 111.35 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.422 ' HG2' ' HB2' ' A' ' 64' ' ' ASN . 14.3 mm-40 -65.1 -55.45 18.7 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.831 0.348 . . . . 1.3600000000000001 110.203 179.317 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.713 ' CD1' HD11 ' A' ' 32' ' ' LEU . 32.8 t80 -63.98 -45.98 86.65 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.077 -0.511 . . . . 0.51000000000000001 109.993 179.255 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 62.7 m -57.34 -35.46 69.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.809 -0.632 . . . . 0.75 110.251 179.477 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -59.51 -54.4 38.07 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.788 -0.72 . . . . 0.40999999999999998 111.431 179.436 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.599 HG23 ' HE2' ' A' ' 74' ' ' LYS . 12.6 mt -60.16 -43.38 92.96 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.347 0 CA-C-O 121.108 0.48 . . . . 0.51000000000000001 110.173 179.099 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' MET . . . . . 0.409 ' HG3' ' O ' ' A' ' 68' ' ' PHE . 40.1 mtp -53.76 -32.52 52.64 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.859 -0.61 . . . . 1.01 110.051 179.317 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -67.17 -47.71 70.15 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.186 -0.461 . . . . 0.69999999999999996 110.853 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.599 ' HE2' HG23 ' A' ' 71' ' ' ILE . 65.7 pttt -70.44 -28.9 65.39 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.412 -0.358 . . . . 1.3799999999999999 111.747 -179.591 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' GLN . . . . . 0.454 ' HG3' HG22 ' A' ' 71' ' ' ILE . 7.7 mm-40 -82.1 -35.06 28.98 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.186 0.517 . . . . 1.98 111.155 -179.383 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 50.7 mtp . . . . . 0 C--N 1.326 -0.451 0 CA-C-N 115.525 -0.762 . . . . 1.2 111.969 -179.024 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.558 ' O ' ' HG2' ' A' ' 85' ' ' MET . 6.6 t . . . . . 0 N--CA 1.47 0.571 0 CA-C-O 120.98 0.419 . . . . 7.29 111.836 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -42.71 -30.91 0.41 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 115.57 -0.741 . . . . 9.7400000000000002 112.977 -179.152 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -60.56 -55.94 27.37 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 120.879 0.371 . . . . 12.109999999999999 111.52 -179.332 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -63.99 -21.93 66.71 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.169 -0.468 . . . . 10.869999999999999 111.167 -179.582 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' MET . . . . . 0.558 ' HG2' ' O ' ' A' ' 81' ' ' THR . 11.3 mmm -74.41 -41.13 61.42 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.895 0.379 . . . . 11.09 110.578 -179.558 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 50.8 ttp180 -62.46 -46.57 87.92 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.969 -0.559 . . . . 15.52 110.404 179.729 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.439 ' O ' HG12 ' A' ' 91' ' ' ILE . 40.7 tt0 -55.73 -47.05 77.56 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.029 0.442 . . . . 14.85 109.867 179.015 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.84 -32.89 74.79 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.796 -0.638 . . . . 14.109999999999999 111.034 179.616 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 81.7 t80 -61.5 -37.12 82.52 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-O 120.978 0.418 . . . . 15.73 110.494 179.777 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 89.0 mttt -69.21 -40.1 78.21 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.871 -0.604 . . . . 17.66 110.501 179.621 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.439 HG12 ' O ' ' A' ' 87' ' ' GLU . 37.4 mm -60.51 -50.5 80.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.897 -0.592 . . . . 18.149999999999999 111.567 -179.799 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.448 ' HB3' HD13 ' A' ' 100' ' ' ILE . 8.2 m-85 -66.79 -48.08 70.11 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.306 -0.406 . . . . 18.34 111.635 -179.347 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 53.6 t0 -60.83 93.82 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.984 0.421 . . . . 19.289999999999999 110.557 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.717 ' HE ' ' HG2' ' A' ' 104' ' ' GLU . 34.8 mtm180 -63.01 -11.55 19.83 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.9 -0.591 . . . . 22.25 111.49 -179.497 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.436 ' HB2' ' OD1' ' A' ' 97' ' ' ASP . 8.9 m-20 -119.82 170.23 9.42 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.965 0.412 . . . . 23.34 111.09 -179.78 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.49 5.21 57.02 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.925 -0.655 . . . . 22.0 112.256 179.602 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.436 ' OD1' ' HB2' ' A' ' 95' ' ' ASP . 5.0 p-10 -60.0 -38.6 83.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.66 0.267 . . . . 22.280000000000001 111.119 -179.657 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 113.05 15.04 9.42 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.804 -0.712 . . . . 19.93 112.955 179.648 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -142.34 154.13 44.41 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.613 0.244 . . . . 20.300000000000001 110.758 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.448 HD13 ' HB3' ' A' ' 92' ' ' PHE . 76.8 mt -114.11 140.7 33.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 121.023 0.44 . . . . 19.370000000000001 111.337 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 101' ' ' SER . . . . . 0.438 ' OG ' ' HD2' ' A' ' 102' ' ' PRO . 31.1 t -114.51 154.22 46.6 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 115.589 -0.732 . . . . 22.489999999999998 109.956 179.785 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 102' ' ' PRO . . . . . 0.438 ' HD2' ' OG ' ' A' ' 101' ' ' SER . 57.7 Cg_exo -50.53 -36.19 48.55 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 121.941 1.76 . . . . 23.0 111.442 -179.892 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.73 -48.84 79.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.765 -0.652 . . . . 24.559999999999999 109.911 178.929 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' GLU . . . . . 0.717 ' HG2' ' HE ' ' A' ' 94' ' ' ARG . 45.4 mt-10 -59.47 -45.62 91.12 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.303 -0.862 . . . . 22.23 110.332 179.245 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.573 HD22 ' HB ' ' A' ' 121' ' ' ILE . 2.6 tt -63.29 -29.7 70.97 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.585 -0.734 . . . . 20.359999999999999 110.615 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.462 ' CZ ' HD11 ' A' ' 110' ' ' ILE . 12.1 tpt180 -72.81 -40.41 65.88 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.709 -0.678 . . . . 27.190000000000001 111.5 -179.645 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 53.3 t80 -76.87 -35.18 57.63 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 111.98 0.363 . . . . 25.359999999999999 111.98 -178.904 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.447 HG21 ' HA ' ' A' ' 92' ' ' PHE . 90.4 t -72.34 -47.45 52.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 111.692 0.256 . . . . 21.059999999999999 111.692 -179.455 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 12.9 mmt -50.98 -36.32 38.44 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.712 0.291 . . . . 20.93 111.283 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.462 HD11 ' CZ ' ' A' ' 106' ' ' ARG . 72.4 mt -67.94 -35.58 72.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.894 0.378 . . . . 25.129999999999999 110.636 179.801 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 -66.06 -37.94 87.08 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.025 -0.534 . . . . 23.32 110.744 179.594 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 14.6 mt -67.59 -28.89 68.14 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.999 -0.546 . . . . 21.07 110.954 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 116.28 0.14 20.65 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.9 -0.667 . . . . 23.050000000000001 112.305 -179.836 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -103.42 110.06 21.93 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.768 0.318 . . . . 22.59 110.978 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 17.6 tppt? -80.58 116.2 20.49 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.2 -0.455 . . . . 27.960000000000001 110.743 179.708 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 3.7 m -125.33 154.59 33.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.035 0.445 . . . . 24.75 111.569 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 80.6 p -95.68 146.27 24.63 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.735 -0.666 . . . . 27.239999999999998 110.085 179.173 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -53.55 -18.94 3.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.279 -0.418 . . . . 26.629999999999999 111.367 -179.597 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -79.22 -52.13 8.56 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.38 -0.373 . . . . 29.140000000000001 111.697 -179.49 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -63.09 -37.12 85.92 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.627 -0.261 . . . . 24.190000000000001 111.567 -179.269 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.573 ' HB ' HD22 ' A' ' 105' ' ' LEU . 48.3 pt -74.67 -35.46 37.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 C-N-CA 120.995 -0.282 . . . . 22.329999999999998 111.031 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -61.2 -38.59 87.1 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.961 0.41 . . . . 24.289999999999999 110.309 179.185 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -67.81 -43.48 79.54 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.897 -0.592 . . . . 24.739999999999998 110.52 179.488 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 50.2 ttp -58.11 -39.5 78.83 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.044 -0.525 . . . . 19.710000000000001 110.573 179.62 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.431 HG23 HD11 ' A' ' 136' ' ' ILE . 76.2 mt -66.94 -36.4 77.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.16 -0.473 . . . . 19.949999999999999 110.608 179.585 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 37.6 ttm180 -66.04 -29.92 70.35 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.173 -0.467 . . . . 24.949999999999999 110.806 179.764 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -75.88 -26.89 57.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.14 -0.482 . . . . 18.690000000000001 111.239 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.683 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -97.81 -16.23 19.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.245 -0.434 . . . . 16.469999999999999 111.173 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 129' ' ' ASP . . . . . 0.4 ' HA ' ' OE1' ' A' ' 140' ' ' GLU . 31.4 t70 -94.57 105.19 17.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.135 -0.484 . . . . 20.399999999999999 111.009 -179.564 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -100.33 -33.34 10.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.865 -0.607 . . . . 21.43 111.294 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -64.06 -27.95 69.45 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.375 -0.375 . . . . 23.370000000000001 110.715 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 75.98 81.88 0.52 Allowed Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.921 -0.657 . . . . 24.32 112.952 179.51 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 16.5 p-10 -155.66 6.66 0.22 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.745 0.307 . . . . 23.879999999999999 110.919 179.605 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 59.94 25.64 62.04 Favored Glycine 0 C--N 1.331 0.251 0 C-N-CA 120.891 -0.671 . . . . 22.670000000000002 112.551 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 96.8 mmm -135.96 152.5 51.02 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.596 0.236 . . . . 22.91 110.43 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.731 HG23 ' HB2' ' A' ' 140' ' ' GLU . 41.4 mm -115.86 138.71 45.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 121.341 0.591 . . . . 18.41 112.126 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 137' ' ' ASN . . . . . 0.454 ' O ' ' N ' ' A' ' 139' ' ' GLU . 26.4 p30 -115.38 158.85 21.87 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.267 -0.879 . . . . 16.82 109.036 178.035 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.65 ' O ' HG23 ' A' ' 142' ' ' VAL . 28.6 t80 -38.49 -24.21 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 112.589 0.589 . . . . 14.65 112.589 -179.029 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 139' ' ' GLU . . . . . 0.454 ' N ' ' O ' ' A' ' 137' ' ' ASN . 44.4 mt-10 -80.25 -55.78 4.67 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.822 0.344 . . . . 14.82 111.213 -179.437 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.731 ' HB2' HG23 ' A' ' 136' ' ' ILE . 24.8 mt-10 -60.22 -27.17 66.98 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.174 -0.466 . . . . 17.460000000000001 110.266 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.725 ' HA ' ' HE2' ' A' ' 144' ' ' MET . 69.0 t80 -71.14 -56.34 6.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.877 -0.601 . . . . 12.93 110.415 179.54 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.65 HG23 ' O ' ' A' ' 138' ' ' TYR . 43.1 t -44.73 -48.05 2.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.774 -0.648 . . . . 10.699999999999999 111.794 179.432 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 78.8 t90 -64.65 -55.43 20.25 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.513 0.56 . . . . 13.66 112.513 -178.797 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 144' ' ' MET . . . . . 0.725 ' HE2' ' HA ' ' A' ' 141' ' ' PHE . 16.7 ptt? -60.37 -35.41 75.64 Favored 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 112.451 0.538 . . . . 14.5 112.451 -178.004 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 145' ' ' ILE . . . . . 0.635 HG21 ' CZ ' ' A' ' 141' ' ' PHE . 3.2 pt -80.93 -17.27 12.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 C-N-CA 120.591 -0.444 . . . . 11.25 111.275 -179.883 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 42.2 t -69.25 -36.46 77.17 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.399 -0.593 . . . . 8.5399999999999991 109.399 179.231 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 31.8 mm-40 -93.56 -16.48 24.36 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.138 -0.937 . . . . 11.869999999999999 110.229 179.382 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 148' ' ' LYS . . . . . 0.438 ' CB ' ' HA ' ' A' ' 145' ' ' ILE . 37.6 ttpt . . . . . 0 C--O 1.25 1.112 0 CA-C-O 118.231 -0.89 . . . . 13.68 110.961 179.474 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 9.8 mp . . . . . 0 C--O 1.233 0.21 0 CA-C-O 120.651 0.262 . . . . 1.27 111.491 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -62.88 167.0 5.02 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.422 -0.354 . . . . 1.1200000000000001 110.68 179.616 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -49.37 -39.8 33.51 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.707 0.289 . . . . 2.2000000000000002 111.436 179.597 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.95 -33.72 59.83 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.432 -0.349 . . . . 1.3500000000000001 110.699 -179.593 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 -67.02 -44.73 79.5 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.001 -0.545 . . . . 2.2200000000000002 110.583 179.782 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.531 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 80.4 mt -61.29 -51.77 69.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.992 -0.549 . . . . 0.54000000000000004 110.755 179.804 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.48 -21.0 66.53 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.044 -0.526 . . . . 0.5 111.193 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -72.09 -56.42 5.64 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 116.405 -0.361 . . . . 2.27 111.696 -179.405 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.531 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 8.6 p90 -77.85 -24.67 48.52 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.703 -0.399 . . . . 0.37 110.823 -179.636 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.426 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 20.1 tptm -66.81 -36.93 83.51 Favored 'General case' 0 C--O 1.233 0.201 0 N-CA-C 109.355 -0.609 . . . . 1.23 109.355 178.738 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.447 ' O ' HG22 ' A' ' 17' ' ' VAL . 23.5 t70 -68.05 -48.18 66.32 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 109.224 -0.658 . . . . 0.44 109.224 178.347 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.72 -14.31 61.04 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.666 -0.697 . . . . 0.28999999999999998 110.528 178.909 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.426 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 81.2 t80 -77.48 -49.94 13.7 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-N 115.929 -0.578 . . . . 0.47999999999999998 110.18 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.447 HG22 ' O ' ' A' ' 14' ' ' ASP . 34.0 m -66.91 -21.4 28.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.075 -0.511 . . . . 1.1100000000000001 110.141 179.395 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.435 ' HG3' ' O ' ' A' ' 14' ' ' ASP . 70.5 mt-30 -59.99 -46.17 90.34 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.625 -0.716 . . . . 1.6000000000000001 111.212 179.2 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 25.8 m-85 -84.36 22.33 1.27 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.304 -0.407 . . . . 0.64000000000000001 111.565 -179.471 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -120.45 66.15 0.84 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.146 0.498 . . . . 0.44 110.441 179.385 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 11.2 mmmm -73.32 -26.19 60.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.77 -0.65 . . . . 2.1000000000000001 111.269 -179.661 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -68.89 -42.64 76.66 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.111 -0.495 . . . . 1.8 111.306 -179.629 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 107.73 11.77 24.09 Favored Glycine 0 C--N 1.331 0.272 0 C-N-CA 120.723 -0.751 . . . . 0.46000000000000002 112.791 179.683 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 38.5 p -86.18 10.35 14.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.71 0.29 . . . . 0.40000000000000002 111.199 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 55.68 20.12 23.35 Favored Glycine 0 C--N 1.332 0.333 0 C-N-CA 120.803 -0.713 . . . . 0.33000000000000002 112.126 -179.703 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.461 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 32.5 mtpt -130.35 155.93 45.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.727 0.299 . . . . 1.1000000000000001 111.081 -179.669 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.451 HG13 ' HB2' ' A' ' 63' ' ' LEU . 39.5 pt -115.5 133.7 61.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.408 -0.36 . . . . 0.5 111.494 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -48.8 143.21 5.51 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.116 -0.493 . . . . 0.29999999999999999 111.696 -179.672 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.485 ' HA ' HD11 ' A' ' 63' ' ' LEU . 58.5 p -68.86 -29.87 68.27 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.662 -0.699 . . . . 1.03 111.724 -179.704 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.545 ' HD3' ' H ' ' A' ' 30' ' ' ARG . 0.2 OUTLIER -86.11 0.47 53.43 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.392 -0.367 . . . . 3.0800000000000001 111.109 -179.536 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -109.29 -3.57 17.08 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.105 -0.498 . . . . 2.2599999999999998 110.845 179.824 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.494 HD23 HD13 ' A' ' 63' ' ' LEU . 1.4 tm? -61.03 -52.33 65.43 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.232 -0.44 . . . . 1.3700000000000001 110.616 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.447 ' HA2' HD21 ' A' ' 48' ' ' LEU . . . -52.41 -41.25 55.12 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.638 -0.791 . . . . 0.32000000000000001 111.633 179.441 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 89.4 m -64.5 -34.67 78.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.018 0.437 . . . . 0.31 110.218 179.103 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 28.9 tp -66.82 -23.72 66.08 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.711 -0.677 . . . . 1.24 110.525 179.731 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.42 ' HG3' ' HG3' ' A' ' 43' ' ' PRO . 23.3 mmt -78.92 -39.23 35.34 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.221 -0.445 . . . . 1.1000000000000001 110.039 178.846 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 70.3 mtt180 -59.19 -43.12 92.2 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.691 -0.686 . . . . 2.6899999999999999 111.068 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.488 HG23 HD13 ' A' ' 39' ' ' LEU . 2.0 t -70.4 -13.29 62.07 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.38 -0.373 . . . . 1.0600000000000001 111.42 179.886 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.488 HD13 HG23 ' A' ' 38' ' ' THR . 10.6 mp -113.14 157.14 22.03 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.193 -0.458 . . . . 1.26 110.59 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -48.29 -19.23 1.07 Allowed Glycine 0 CA--C 1.519 0.314 0 CA-C-N 116.013 -0.54 . . . . 0.68999999999999995 113.441 -179.651 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 61.9 mm-40 -59.03 168.57 1.28 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.885 0.374 . . . . 1.97 110.894 179.764 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 6.0 t30 -170.27 64.35 0.47 Allowed Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.068 -0.515 . . . . 2.6600000000000001 110.777 179.605 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.534 ' HB3' ' NE2' ' A' ' 75' ' ' GLN . 32.1 Cg_endo -64.8 154.96 70.07 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.633 2.222 . . . . 0.51000000000000001 112.449 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.403 HG22 ' N ' ' A' ' 45' ' ' GLU . 20.8 m -80.43 157.01 26.37 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.027 -0.533 . . . . 0.72999999999999998 110.69 179.765 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.403 ' N ' HG22 ' A' ' 44' ' ' THR . 39.2 tt0 -46.77 -49.05 20.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.549 -0.296 . . . . 2.7000000000000002 111.343 -179.701 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.09 -55.27 25.2 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.199 -0.455 . . . . 0.46000000000000002 111.516 -179.664 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -50.7 -50.84 54.09 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.289 -0.414 . . . . 2.23 111.045 -179.91 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.502 HD13 HD11 ' A' ' 51' ' ' LEU . 0.2 OUTLIER -58.25 -40.66 82.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.295 -0.411 . . . . 1.3600000000000001 110.866 -179.844 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 85.0 mm-40 -67.42 -29.64 69.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.421 -0.354 . . . . 1.22 110.976 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -70.68 -49.37 47.94 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.22 -0.446 . . . . 0.62 111.529 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.502 HD11 HD13 ' A' ' 48' ' ' LEU . 0.9 OUTLIER -72.78 -28.32 62.52 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.49 -0.323 . . . . 0.39000000000000001 111.614 -179.375 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.493 HD11 HD12 ' A' ' 48' ' ' LEU . 28.2 mt -70.21 -46.03 73.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 120.771 0.319 . . . . 0.5 110.389 179.467 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.94 -25.53 62.78 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.079 -0.51 . . . . 0.58999999999999997 111.083 -179.884 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -77.98 -46.57 20.73 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.194 -0.457 . . . . 2.54 110.731 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -74.39 -27.13 60.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.188 -0.46 . . . . 0.53000000000000003 111.378 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -64.76 -34.38 78.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.796 0.331 . . . . 1.95 110.985 -179.772 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 79.1 m-20 -111.53 59.64 0.62 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.229 -0.441 . . . . 2.48 111.079 -179.878 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -170.81 -55.17 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.051 -0.522 . . . . 2.48 110.684 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 1.5 p30 -110.96 27.16 9.95 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.867 -0.606 . . . . 2.0499999999999998 110.818 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 62.66 -81.75 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.945 -0.57 . . . . 1.47 111.331 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -158.49 34.83 0.51 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.752 -0.737 . . . . 0.42999999999999999 112.546 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.461 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 10.0 mm-40 -140.47 150.22 43.52 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.031 0.443 . . . . 0.38 111.379 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.494 HD13 HD23 ' A' ' 32' ' ' LEU . 13.5 mt -121.99 155.48 35.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.804 -0.634 . . . . 1.4299999999999999 110.566 -179.905 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -113.4 157.03 22.42 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.482 -0.326 . . . . 1.1899999999999999 110.847 -179.657 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 59.7 t80 -43.16 -35.16 1.27 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.427 -0.351 . . . . 0.40000000000000002 111.228 179.571 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.35 -38.8 59.89 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.143 0.423 . . . . 0.81000000000000005 112.143 -179.579 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -63.99 -53.19 54.01 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.216 0.531 . . . . 1.3600000000000001 110.28 179.636 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.48 ' HD1' HD21 ' A' ' 32' ' ' LEU . 18.4 t80 -59.22 -52.41 65.82 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.495 -0.775 . . . . 0.51000000000000001 110.789 179.459 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 35.8 t -56.54 -49.0 76.09 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 116.28 -0.418 . . . . 0.75 110.51 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -43.67 -50.94 6.96 Favored Glycine 0 N--CA 1.45 -0.391 0 CA-C-N 115.503 -0.771 . . . . 0.40999999999999998 112.313 179.616 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.537 HG23 ' HE3' ' A' ' 74' ' ' LYS . 11.0 mt -67.1 -42.69 88.62 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.373 0 CA-C-O 120.823 0.344 . . . . 0.51000000000000001 111.064 179.752 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' MET . . . . . 0.403 ' HG2' ' O ' ' A' ' 68' ' ' PHE . 87.8 mmm -53.26 -41.05 65.1 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.28 0.562 . . . . 1.01 110.003 179.344 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.8 -53.24 60.28 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.297 -0.865 . . . . 0.69999999999999996 111.087 179.481 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.537 ' HE3' HG23 ' A' ' 71' ' ' ILE . 18.8 pttp -67.94 -27.09 66.32 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 120.858 0.361 . . . . 1.3799999999999999 111.327 -179.81 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' GLN . . . . . 0.534 ' NE2' ' HB3' ' A' ' 43' ' ' PRO . 35.2 tt0 -80.35 -28.05 38.13 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.104 -0.498 . . . . 1.98 111.826 -179.352 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 38.6 mtt . . . . . 0 N--CA 1.45 -0.454 0 CA-C-N 116.448 -0.342 . . . . 1.2 111.541 -179.483 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.471 ' O ' ' HG3' ' A' ' 85' ' ' MET . 2.7 t . . . . . 0 N--CA 1.466 0.358 0 CA-C-O 120.592 0.235 . . . . 7.29 111.289 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -79.86 -28.73 39.98 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 112.776 0.658 . . . . 9.7400000000000002 112.776 -178.3 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -59.91 -49.14 78.84 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.907 -0.317 . . . . 12.109999999999999 111.461 -179.393 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -69.72 -21.94 63.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.982 0.42 . . . . 10.869999999999999 110.628 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' MET . . . . . 0.604 ' SD ' HG13 ' A' ' 142' ' ' VAL . 23.9 mtt -72.75 -47.75 44.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.827 -0.624 . . . . 11.09 111.103 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.404 ' O ' ' HB3' ' A' ' 89' ' ' PHE . 64.7 ttt180 -62.17 -38.21 88.17 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.396 -0.365 . . . . 15.52 110.195 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -59.01 -45.11 91.49 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.165 -0.68 . . . . 14.85 109.165 178.731 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -69.15 -27.92 65.97 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.476 -0.784 . . . . 14.109999999999999 110.557 179.259 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.404 ' HB3' ' O ' ' A' ' 86' ' ' ARG . 62.0 t80 -63.4 -41.93 98.76 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.158 -0.474 . . . . 15.73 110.27 179.437 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 53.8 mttp -66.74 -41.82 87.2 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.765 -0.652 . . . . 17.66 110.435 179.481 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 78.3 mt -64.49 -39.61 86.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.102 -0.499 . . . . 18.149999999999999 111.076 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.535 ' HD1' HG11 ' A' ' 108' ' ' VAL . 1.7 m-85 -73.79 -33.75 64.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.345 -0.389 . . . . 18.34 111.103 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 51.1 t0 -81.27 114.87 20.36 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.364 -0.38 . . . . 19.289999999999999 110.507 179.768 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.525 ' HG2' ' HB3' ' A' ' 104' ' ' GLU . 22.0 mmm180 -65.47 -57.48 8.17 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.004 -0.544 . . . . 22.25 110.992 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.99 160.3 22.04 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.093 -0.503 . . . . 23.34 110.975 -179.693 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -84.18 5.49 79.88 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.857 -0.687 . . . . 22.0 112.175 179.641 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 16.8 p-10 -57.81 -33.36 68.5 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.747 0.308 . . . . 22.280000000000001 111.185 -179.893 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 96.04 26.97 10.63 Favored Glycine 0 C--N 1.331 0.274 0 C-N-CA 120.833 -0.699 . . . . 19.93 112.619 179.813 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 68.0 m-85 -142.57 142.69 32.21 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.599 0.238 . . . . 20.300000000000001 110.853 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.407 ' HB ' ' HB ' ' A' ' 136' ' ' ILE . 65.5 mt -114.38 127.27 71.92 Favored 'Isoleucine or valine' 0 C--O 1.231 0.126 0 CA-C-O 121.0 0.429 . . . . 19.370000000000001 111.17 179.882 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 75.6 m -114.44 156.5 44.44 Favored Pre-proline 0 C--N 1.332 -0.182 0 CA-C-N 115.879 -0.6 . . . . 22.489999999999998 110.783 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_exo -44.13 -35.86 8.16 Favored 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 122.41 2.073 . . . . 23.0 112.284 -179.813 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.436 ' O ' ' HG3' ' A' ' 106' ' ' ARG . . . -63.83 -48.11 78.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.169 -0.468 . . . . 24.559999999999999 110.734 179.709 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 104' ' ' GLU . . . . . 0.525 ' HB3' ' HG2' ' A' ' 94' ' ' ARG . 45.4 mt-10 -72.9 -19.89 61.19 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.837 -0.619 . . . . 22.23 110.842 179.703 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.841 HD23 ' HB ' ' A' ' 121' ' ' ILE . 14.7 tp -80.16 -39.98 28.26 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.062 -0.517 . . . . 20.359999999999999 111.691 -179.22 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.489 ' HB3' HD13 ' A' ' 121' ' ' ILE . 7.4 ppt_? -73.76 -35.79 65.04 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.852 0.358 . . . . 27.190000000000001 110.517 -179.834 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 60.4 t80 -69.41 -44.7 70.85 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.963 -0.562 . . . . 25.359999999999999 111.306 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.535 HG11 ' HD1' ' A' ' 92' ' ' PHE . 7.3 p -63.75 -43.74 98.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.529 -0.305 . . . . 21.059999999999999 111.571 -179.536 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.464 ' N ' HG13 ' A' ' 108' ' ' VAL . 20.6 mmt -55.43 -45.63 76.75 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.519 -0.309 . . . . 20.93 111.29 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 81.2 mt -59.35 -25.05 29.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.963 0.411 . . . . 25.129999999999999 110.619 179.788 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 80.1 m-20 -77.67 -39.41 44.96 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.963 -0.562 . . . . 23.32 110.533 179.623 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.431 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 10.5 mt -69.68 -28.68 66.07 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.93 -0.577 . . . . 21.07 110.668 179.859 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 113.18 17.08 7.94 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.921 -0.657 . . . . 23.050000000000001 112.523 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -113.88 108.8 17.55 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.804 0.335 . . . . 22.59 111.087 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -77.04 113.83 15.18 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.163 -0.471 . . . . 27.960000000000001 110.989 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 116' ' ' VAL . . . . . 0.488 ' HB ' HG23 ' A' ' 121' ' ' ILE . 1.2 m -127.39 155.01 38.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.026 0.441 . . . . 24.75 111.6 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 117' ' ' THR . . . . . 0.44 ' O ' HG12 ' A' ' 121' ' ' ILE . 72.2 p -99.34 144.26 28.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.793 -0.639 . . . . 27.239999999999998 110.227 179.275 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -51.77 -20.94 2.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.274 -0.421 . . . . 26.629999999999999 111.551 -179.506 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 12.9 mm-40 -77.43 -55.33 5.48 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.502 -0.317 . . . . 29.140000000000001 111.694 -179.618 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -61.63 -40.92 96.59 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 111.825 0.306 . . . . 24.190000000000001 111.825 -179.204 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.841 ' HB ' HD23 ' A' ' 105' ' ' LEU . 4.9 pt -68.59 -42.67 83.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 C-N-CA 121.062 -0.255 . . . . 22.329999999999998 111.584 -179.442 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 122' ' ' ASP . . . . . 0.523 ' N ' HG13 ' A' ' 121' ' ' ILE . 24.0 t70 -59.76 -33.16 71.32 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.825 0.345 . . . . 24.289999999999999 110.649 179.842 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 -66.06 -49.19 68.5 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.034 -0.53 . . . . 24.739999999999998 110.434 179.562 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.409 ' CE ' HD21 ' A' ' 105' ' ' LEU . 3.1 tmm? -56.96 -37.94 72.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.032 -0.531 . . . . 19.710000000000001 111.054 179.547 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.602 HD11 HD22 ' A' ' 105' ' ' LEU . 66.4 mt -65.55 -43.52 94.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.291 -0.413 . . . . 19.949999999999999 110.516 179.793 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 23.9 ttm180 -57.43 -35.43 70.08 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.892 -0.595 . . . . 24.949999999999999 110.984 179.824 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -69.47 -43.5 73.11 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.166 -0.47 . . . . 18.690000000000001 110.969 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.611 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -80.4 -12.22 59.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.217 -0.447 . . . . 16.469999999999999 111.283 -179.911 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -101.31 106.14 17.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.161 -0.472 . . . . 20.399999999999999 110.942 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 82.1 m-85 -98.16 -33.64 11.05 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.911 -0.586 . . . . 21.43 111.032 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -65.1 -16.41 63.44 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.213 -0.449 . . . . 23.370000000000001 110.772 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 61.16 82.75 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.871 -0.68 . . . . 24.32 112.55 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -151.68 -6.68 0.24 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.65 0.262 . . . . 23.879999999999999 111.393 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 74.66 20.47 79.51 Favored Glycine 0 C--N 1.331 0.253 0 C-N-CA 120.785 -0.721 . . . . 22.670000000000002 112.815 179.647 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 47.9 mtp -136.01 155.64 49.93 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.623 0.249 . . . . 22.91 110.385 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.706 HG23 ' HB2' ' A' ' 140' ' ' GLU . 48.6 mm -114.84 140.17 37.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 121.309 0.576 . . . . 18.41 112.092 -179.416 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 137' ' ' ASN . . . . . 0.449 ' O ' ' N ' ' A' ' 139' ' ' GLU . 1.9 m-20 -115.07 157.84 22.96 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.919 -1.037 . . . . 16.82 108.996 178.594 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 31.2 t80 -40.0 -23.84 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 120.762 0.315 . . . . 14.65 111.605 179.795 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 139' ' ' GLU . . . . . 0.449 ' N ' ' O ' ' A' ' 137' ' ' ASN . 19.4 mm-40 -80.53 -55.77 4.63 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-O 120.958 0.408 . . . . 14.82 110.871 -179.586 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.706 ' HB2' HG23 ' A' ' 136' ' ' ILE . 25.8 mt-10 -61.27 -33.42 73.52 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.958 -0.565 . . . . 17.460000000000001 110.693 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.594 ' CZ ' HG21 ' A' ' 145' ' ' ILE . 76.9 t80 -66.91 -56.06 11.93 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.914 -0.585 . . . . 12.93 110.194 179.796 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.604 HG13 ' SD ' ' A' ' 85' ' ' MET . 2.5 t -45.75 -44.86 4.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.554 -0.748 . . . . 10.699999999999999 112.138 179.83 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 79.8 t90 -65.13 -55.58 17.89 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.439 0.533 . . . . 13.66 112.439 -178.69 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 144' ' ' MET . . . . . 0.611 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 17.3 ptt? -60.28 -36.71 78.48 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 112.099 0.407 . . . . 14.5 112.099 -178.185 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 145' ' ' ILE . . . . . 0.594 HG21 ' CZ ' ' A' ' 141' ' ' PHE . 2.8 pt -80.73 -15.39 12.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 C-N-CA 120.803 -0.359 . . . . 11.25 111.327 179.817 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 45.0 t -69.42 -38.9 78.09 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.385 -0.598 . . . . 8.5399999999999991 109.385 179.589 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 5.2 mm100 -87.03 -21.07 26.33 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.313 -0.858 . . . . 11.869999999999999 109.945 178.91 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 24.5 ttpp . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.258 -0.877 . . . . 13.68 111.11 179.7 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.497 HD13 ' SG ' ' A' ' 69' ' ' CYS . 78.7 mt . . . . . 0 C--O 1.232 0.178 0 CA-C-O 120.805 0.336 . . . . 1.27 111.165 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 50.5 p -73.19 -176.37 2.15 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.434 -0.348 . . . . 1.1200000000000001 111.525 -179.799 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -64.7 -38.08 89.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.475 -0.329 . . . . 2.2000000000000002 111.518 -179.586 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -75.06 -44.26 48.67 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.963 0.411 . . . . 1.3500000000000001 111.009 -179.549 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -61.92 -46.2 90.4 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.892 -0.595 . . . . 2.2200000000000002 110.885 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.542 ' HA ' ' CZ ' ' A' ' 12' ' ' PHE . 62.9 mt -58.56 -52.64 57.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.135 -0.484 . . . . 0.54000000000000004 111.006 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.85 -20.8 65.44 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.417 -0.356 . . . . 0.5 111.584 -179.722 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -70.82 -56.82 5.47 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 111.78 0.289 . . . . 2.27 111.78 -179.273 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.542 ' CZ ' ' HA ' ' A' ' 9' ' ' ILE . 19.3 p90 -79.57 -26.9 41.22 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 120.591 -0.444 . . . . 0.37 110.922 -179.692 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.428 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 45.8 tptt -65.51 -34.2 77.72 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 109.387 -0.598 . . . . 1.23 109.387 178.889 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.548 ' O ' HG22 ' A' ' 17' ' ' VAL . 14.4 t70 -69.98 -50.09 45.13 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 108.998 -0.742 . . . . 0.44 108.998 178.187 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.89 -14.8 50.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.663 -0.699 . . . . 0.28999999999999998 110.277 178.771 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.428 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 44.9 t80 -80.32 -45.47 17.78 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.636 -0.711 . . . . 0.47999999999999998 110.733 -179.616 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.548 HG22 ' O ' ' A' ' 14' ' ' ASP . 24.6 m -69.62 -20.46 23.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 121.003 0.43 . . . . 1.1100000000000001 110.288 179.749 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.469 ' HG3' ' O ' ' A' ' 14' ' ' ASP . 78.3 mt-30 -60.38 -29.43 68.94 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.784 -0.643 . . . . 1.6000000000000001 111.175 179.471 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 56.8 m-85 -104.34 13.64 31.69 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.558 -0.292 . . . . 0.64000000000000001 111.7 -179.409 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -114.12 81.96 1.62 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.981 0.419 . . . . 0.44 110.921 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 43.8 mmtm -85.42 -34.59 21.67 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.969 -0.56 . . . . 2.1000000000000001 111.291 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -62.26 -28.53 69.77 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.127 -0.488 . . . . 1.8 111.296 -179.6 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 89.69 7.25 69.1 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.697 -0.763 . . . . 0.46000000000000002 112.72 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 21.9 p -76.76 7.87 4.25 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.583 0.23 . . . . 0.40000000000000002 111.231 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 55.88 27.23 49.9 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.609 -0.805 . . . . 0.33000000000000002 111.745 -179.436 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.676 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 37.8 mtpt -136.68 155.56 49.71 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.858 0.361 . . . . 1.1000000000000001 111.095 -179.402 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 46.5 pt -125.51 143.51 38.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.11 -0.496 . . . . 0.5 111.252 -179.735 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -56.92 124.98 20.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.365 -0.38 . . . . 0.29999999999999999 111.04 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.1 t -62.03 -13.36 25.31 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.116 -0.493 . . . . 1.03 111.268 -179.8 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 68.1 mtp180 -79.75 -29.07 40.41 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.125 -0.488 . . . . 3.0800000000000001 110.565 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -93.54 3.89 54.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.959 -0.564 . . . . 2.2599999999999998 110.341 179.678 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.442 HD23 HD22 ' A' ' 63' ' ' LEU . 0.8 OUTLIER -56.91 -55.29 36.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.794 -0.639 . . . . 1.3700000000000001 110.636 -179.932 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.478 ' HA3' HD21 ' A' ' 48' ' ' LEU . . . -53.91 -42.63 70.39 Favored Glycine 0 C--N 1.331 0.282 0 C-N-CA 120.556 -0.831 . . . . 0.32000000000000001 111.892 179.551 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 57.8 m -62.69 -36.35 82.64 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.094 0.473 . . . . 0.31 110.573 179.278 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 62.9 tp -65.28 -31.65 72.91 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.799 -0.637 . . . . 1.24 110.822 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.437 ' HG3' ' O ' ' A' ' 32' ' ' LEU . 19.3 mtp -80.48 -28.59 37.51 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.129 -0.487 . . . . 1.1000000000000001 110.851 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 24.9 mtp180 -65.23 -44.12 89.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.49 -0.323 . . . . 2.6899999999999999 110.731 179.738 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.452 HG23 ' CD1' ' A' ' 39' ' ' LEU . 1.3 t -65.59 -13.67 59.53 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.956 0.408 . . . . 1.0600000000000001 110.991 179.579 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.452 ' CD1' HG23 ' A' ' 38' ' ' THR . 8.8 mp -113.86 156.87 23.16 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.996 -0.547 . . . . 1.26 110.65 179.584 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -46.51 -27.95 3.22 Favored Glycine 0 CA--C 1.52 0.372 0 C-N-CA 120.886 -0.673 . . . . 0.68999999999999995 113.161 -179.834 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -60.66 154.64 20.87 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.712 0.292 . . . . 1.97 111.157 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 48.5 t-20 -172.13 82.61 0.46 Allowed Pre-proline 0 C--N 1.33 -0.242 0 CA-C-N 116.222 -0.444 . . . . 2.6600000000000001 110.747 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.401 ' HB3' ' NE2' ' A' ' 75' ' ' GLN . 56.1 Cg_endo -70.27 159.26 53.63 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.512 2.141 . . . . 0.51000000000000001 112.367 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 37.7 m -65.17 146.83 54.46 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.107 -0.497 . . . . 0.72999999999999998 110.584 179.685 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.499 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 16.8 mm-40 -48.38 -55.68 10.14 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.843 -0.162 . . . . 2.7000000000000002 111.377 -179.47 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -49.15 -42.66 40.32 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.784 0.326 . . . . 0.46000000000000002 111.248 -179.697 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.522 ' HG3' HD23 ' A' ' 51' ' ' LEU . 7.9 tp10 -64.52 -50.76 66.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.16 -0.473 . . . . 2.23 110.288 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.478 HD21 ' HA3' ' A' ' 33' ' ' GLY . 33.0 tp -57.32 -33.83 68.11 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.957 -0.565 . . . . 1.3600000000000001 110.9 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.499 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 77.4 mm-40 -73.55 -34.67 65.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.314 -0.403 . . . . 1.22 110.511 179.71 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 56.4 m-20 -72.26 -55.27 7.46 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.099 -0.501 . . . . 0.62 111.649 -179.71 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.522 HD23 ' HG3' ' A' ' 47' ' ' GLU . 1.9 pp -61.2 -34.64 75.41 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 111.823 0.305 . . . . 0.39000000000000001 111.823 -179.207 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 49.4 mt -72.01 -53.62 19.45 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 120.692 0.282 . . . . 0.5 110.857 179.61 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.85 -26.23 65.66 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.341 -0.39 . . . . 0.58999999999999997 111.036 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -77.33 -51.86 10.14 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.191 -0.459 . . . . 2.54 110.697 179.885 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -69.53 -16.6 63.46 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.197 -0.456 . . . . 0.53000000000000003 111.294 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -80.08 -36.66 35.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.361 -0.382 . . . . 1.95 110.964 -179.805 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -98.5 36.57 1.61 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.201 -0.454 . . . . 2.48 110.991 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -159.54 -27.39 0.07 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.172 -0.467 . . . . 2.48 110.937 179.894 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 10.4 m120 -120.19 20.44 12.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.273 -0.421 . . . . 2.0499999999999998 110.825 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 24.5 m-80 64.13 -81.34 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 115.901 -0.591 . . . . 1.47 111.453 179.694 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -154.84 5.21 0.26 Allowed Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.547 -0.835 . . . . 0.42999999999999999 113.001 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.676 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 11.0 mm-40 -117.23 153.91 32.08 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.984 0.421 . . . . 0.38 111.619 -179.945 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.525 ' HG ' ' HB2' ' A' ' 67' ' ' GLU . 1.7 tp -128.62 153.62 47.07 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.699 -0.682 . . . . 1.4299999999999999 110.201 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 10.9 m-80 -110.61 157.0 20.16 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-O 121.343 0.592 . . . . 1.1899999999999999 111.472 -179.363 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.443 ' O ' ' HB2' ' A' ' 69' ' ' CYS . 88.1 t80 -46.39 -38.91 9.58 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.91 -1.041 . . . . 0.40000000000000002 111.736 -179.439 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -67.49 -37.54 83.01 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.606 0.595 . . . . 0.81000000000000005 112.606 -179.087 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.525 ' HB2' ' HG ' ' A' ' 63' ' ' LEU . 7.7 mt-10 -63.92 -52.91 57.65 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.126 0.489 . . . . 1.3600000000000001 109.842 179.611 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.447 ' O ' ' HG3' ' A' ' 72' ' ' MET . 28.2 t80 -59.53 -54.39 47.14 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.551 -0.75 . . . . 0.51000000000000001 110.608 179.175 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.497 ' SG ' HD13 ' A' ' 4' ' ' LEU . 0.5 OUTLIER -53.78 -46.63 71.08 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.2 -0.455 . . . . 0.75 110.729 -179.986 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -48.28 -54.27 13.19 Favored Glycine 0 C--N 1.331 0.291 0 CA-C-N 115.857 -0.61 . . . . 0.40999999999999998 112.564 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.466 HG23 ' CE ' ' A' ' 74' ' ' LYS . 11.5 mt -61.79 -43.09 96.77 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.297 0 CA-C-O 120.861 0.363 . . . . 0.51000000000000001 110.751 179.755 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' MET . . . . . 0.447 ' HG3' ' O ' ' A' ' 68' ' ' PHE . 61.8 mtp -54.9 -28.93 54.39 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.965 -0.561 . . . . 1.01 110.05 179.582 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.89 -50.3 36.49 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.964 -0.562 . . . . 0.69999999999999996 110.754 179.63 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.466 ' CE ' HG23 ' A' ' 71' ' ' ILE . 63.8 pttt -68.84 -28.49 66.77 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.357 -0.383 . . . . 1.3799999999999999 111.655 -179.616 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' GLN . . . . . 0.401 ' NE2' ' HB3' ' A' ' 43' ' ' PRO . 7.5 tt0 -81.0 -55.05 5.04 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.123 0.416 . . . . 1.98 112.123 -179.319 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 71.3 mtp . . . . . 0 N--CA 1.454 -0.256 0 N-CA-C 112.282 0.475 . . . . 1.2 112.282 -178.883 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.602 ' O ' ' HG3' ' A' ' 85' ' ' MET . 65.7 m . . . . . 0 CA--C 1.528 0.104 0 N-CA-C 111.707 0.262 . . . . 7.29 111.707 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.43 ' HB3' ' OH ' ' A' ' 138' ' ' TYR . 44.9 mt-10 -55.55 -16.34 3.83 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 112.873 0.694 . . . . 9.7400000000000002 112.873 -178.772 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -61.38 -55.99 25.38 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.863 0.364 . . . . 12.109999999999999 111.693 -179.329 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -71.59 -21.76 61.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.338 -0.392 . . . . 10.869999999999999 111.148 -179.522 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' MET . . . . . 0.646 ' HB3' HD11 ' A' ' 145' ' ' ILE . 10.8 mtp -74.38 -39.58 62.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.353 -0.385 . . . . 11.09 110.908 -179.473 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 61.4 ttt180 -69.76 -41.41 75.24 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.064 -0.517 . . . . 15.52 110.327 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -59.35 -40.93 87.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.219 0.533 . . . . 14.85 109.596 178.857 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -69.62 -29.51 67.02 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.652 -0.704 . . . . 14.109999999999999 110.425 179.277 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 64.0 t80 -66.91 -41.18 87.51 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.053 -0.521 . . . . 15.73 110.483 179.466 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 49.0 mttm -64.07 -42.93 96.82 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.882 -0.599 . . . . 17.66 110.789 179.616 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 84.0 mt -64.8 -46.95 90.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.892 -0.595 . . . . 18.149999999999999 111.066 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.493 ' CD1' HG11 ' A' ' 108' ' ' VAL . 2.2 m-85 -60.02 -48.03 83.41 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.256 -0.429 . . . . 18.34 110.867 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 42.9 t0 -64.68 109.49 2.04 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.074 -0.512 . . . . 19.289999999999999 110.608 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.477 ' HG2' ' HB3' ' A' ' 104' ' ' GLU . 19.1 mmm180 -64.84 -42.2 95.1 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.114 -0.494 . . . . 22.25 111.141 -179.441 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -94.39 178.46 5.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.277 -0.42 . . . . 23.34 110.969 -179.644 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.14 5.24 57.57 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.962 -0.637 . . . . 22.0 112.033 179.562 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 18.5 p-10 -63.54 -31.66 72.89 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.783 0.325 . . . . 22.280000000000001 111.079 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 93.41 27.28 13.5 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.784 -0.722 . . . . 19.93 112.606 179.704 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 67.9 m-85 -138.88 143.52 38.78 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.594 0.235 . . . . 20.300000000000001 110.879 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.498 ' HB ' ' HB ' ' A' ' 136' ' ' ILE . 56.1 mt -114.33 128.74 71.22 Favored 'Isoleucine or valine' 0 C--O 1.232 0.144 0 CA-C-O 120.94 0.4 . . . . 19.370000000000001 111.061 179.638 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 49.5 m -114.84 156.65 44.74 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 115.818 -0.628 . . . . 22.489999999999998 110.506 -179.868 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_exo -44.29 -35.11 7.84 Favored 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 122.174 1.916 . . . . 23.0 112.012 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.479 ' O ' ' HG3' ' A' ' 106' ' ' ARG . . . -65.35 -49.59 68.78 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.099 -0.501 . . . . 24.559999999999999 110.509 179.377 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 104' ' ' GLU . . . . . 0.477 ' HB3' ' HG2' ' A' ' 94' ' ' ARG . 45.5 mt-10 -69.71 -20.37 63.54 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.862 -0.608 . . . . 22.23 110.641 179.506 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.635 HD23 ' HB ' ' A' ' 121' ' ' ILE . 42.1 tp -80.29 -39.55 28.59 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.061 -0.518 . . . . 20.359999999999999 111.51 -179.346 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.479 ' HG3' ' O ' ' A' ' 103' ' ' ALA . 3.3 ppt_? -72.03 -32.16 66.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.186 0.517 . . . . 27.190000000000001 110.39 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 81.0 t80 -73.49 -43.33 60.38 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.581 -0.736 . . . . 25.359999999999999 111.482 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.52 HG13 ' N ' ' A' ' 109' ' ' MET . 7.5 p -66.86 -48.17 80.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 N-CA-C 111.879 0.325 . . . . 21.059999999999999 111.879 -179.184 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.52 ' N ' HG13 ' A' ' 108' ' ' VAL . 22.7 mmt -50.84 -41.89 58.1 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 111.625 0.232 . . . . 20.93 111.625 -179.174 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 79.7 mt -61.78 -30.44 48.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 120.951 0.405 . . . . 25.129999999999999 110.528 179.401 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -70.77 -35.85 72.79 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.007 -0.542 . . . . 23.32 110.427 179.619 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 9.0 mp -72.84 -42.14 64.08 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.946 -0.57 . . . . 21.07 110.634 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 115.53 41.11 0.82 Allowed Glycine 0 N--CA 1.452 -0.272 0 CA-C-N 115.875 -0.602 . . . . 23.050000000000001 112.392 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -110.03 -31.75 7.26 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 111.577 0.214 . . . . 22.59 111.577 -179.558 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 36.6 mtmm 52.7 90.0 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.966 0.413 . . . . 27.960000000000001 110.606 -179.596 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 2.4 m -123.38 155.78 29.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.906 -0.588 . . . . 24.75 112.12 -178.93 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 117' ' ' THR . . . . . 0.408 ' O ' HG12 ' A' ' 121' ' ' ILE . 70.5 p -92.23 145.06 24.79 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.57 -0.741 . . . . 27.239999999999998 110.216 179.187 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 118' ' ' ASP . . . . . 0.479 ' HA ' HD11 ' A' ' 121' ' ' ILE . 8.8 m-20 -51.62 -18.38 1.14 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.041 -0.527 . . . . 26.629999999999999 111.98 -179.361 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -77.51 -55.62 5.22 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.078 0.399 . . . . 29.140000000000001 112.078 -179.008 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -61.87 -40.57 95.83 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 111.967 0.358 . . . . 24.190000000000001 111.967 -179.044 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.635 ' HB ' HD23 ' A' ' 105' ' ' LEU . 5.1 pt -69.63 -40.15 79.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 C-N-CA 120.897 -0.321 . . . . 22.329999999999998 111.522 -179.568 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 122' ' ' ASP . . . . . 0.429 ' N ' HG13 ' A' ' 121' ' ' ILE . 15.4 t70 -56.49 -41.52 76.78 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.858 0.361 . . . . 24.289999999999999 110.42 179.552 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -62.83 -45.37 92.91 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.059 -0.519 . . . . 24.739999999999998 110.475 179.52 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 59.9 ttp -56.98 -38.2 72.69 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.034 -0.53 . . . . 19.710000000000001 110.868 179.49 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.615 HG23 HD11 ' A' ' 136' ' ' ILE . 58.6 mt -64.43 -38.39 82.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.147 -0.479 . . . . 19.949999999999999 110.525 179.691 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 126' ' ' ARG . . . . . 0.407 ' HD2' HH11 ' A' ' 126' ' ' ARG . 6.7 ttp85 -62.21 -42.7 99.53 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.957 -0.565 . . . . 24.949999999999999 110.632 179.74 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -65.6 -26.46 67.85 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.876 -0.602 . . . . 18.690000000000001 110.962 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.623 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -95.65 -13.07 24.6 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.104 -0.498 . . . . 16.469999999999999 111.21 179.912 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -100.16 105.79 17.43 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.094 -0.503 . . . . 20.399999999999999 110.837 -179.77 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 91.2 m-85 -97.4 -30.91 12.65 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.878 -0.601 . . . . 21.43 111.387 -179.498 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -69.72 -15.04 63.08 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.301 -0.409 . . . . 23.370000000000001 110.715 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 60.5 87.4 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.977 -0.63 . . . . 24.32 113.059 179.581 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -155.7 -23.84 0.11 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.755 0.312 . . . . 23.879999999999999 111.099 179.511 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 93.87 23.51 22.85 Favored Glycine 0 C--N 1.331 0.293 0 C-N-CA 120.817 -0.706 . . . . 22.670000000000002 112.617 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 82.1 mmm -135.8 155.22 50.68 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 110.423 -0.214 . . . . 22.91 110.423 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.652 HG23 ' HB2' ' A' ' 140' ' ' GLU . 46.9 mm -114.57 139.53 40.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 121.306 0.574 . . . . 18.41 111.599 179.759 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 137' ' ' ASN . . . . . 0.451 ' O ' ' N ' ' A' ' 139' ' ' GLU . 16.2 m-20 -115.09 157.4 23.61 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.095 -0.957 . . . . 16.82 108.887 178.662 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.43 ' OH ' ' HB3' ' A' ' 82' ' ' GLU . 19.5 t80 -41.13 -22.86 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 120.893 0.378 . . . . 14.65 111.024 179.483 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 139' ' ' GLU . . . . . 0.451 ' N ' ' O ' ' A' ' 137' ' ' ASN . 9.6 mm-40 -81.16 -55.25 4.87 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.24 -0.436 . . . . 14.82 111.019 -179.662 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.652 ' HB2' HG23 ' A' ' 136' ' ' ILE . 31.9 mt-10 -60.11 -34.1 73.04 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.195 -0.457 . . . . 17.460000000000001 110.74 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.482 ' CZ ' HG21 ' A' ' 145' ' ' ILE . 82.2 t80 -68.29 -55.28 12.68 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.034 -0.53 . . . . 12.93 110.326 179.503 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 2.3 t -47.04 -39.67 4.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.485 -0.78 . . . . 10.699999999999999 111.684 179.427 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 143' ' ' TRP . . . . . 0.466 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 84.8 t90 -71.06 -55.43 8.26 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.182 0.438 . . . . 13.66 112.182 -178.856 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 144' ' ' MET . . . . . 0.623 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 17.3 ptt? -61.3 -23.79 65.95 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 113.156 0.799 . . . . 14.5 113.156 -177.801 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 145' ' ' ILE . . . . . 0.646 HD11 ' HB3' ' A' ' 85' ' ' MET . 48.5 pt -80.7 -46.15 21.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 N-CA-C 112.488 0.551 . . . . 11.25 112.488 -179.287 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 146' ' ' SER . . . . . 0.573 ' N ' HG13 ' A' ' 145' ' ' ILE . 12.6 p -63.29 -13.94 44.09 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-O 121.201 0.524 . . . . 8.5399999999999991 110.469 -179.839 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 147' ' ' GLN . . . . . 0.466 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 17.0 mm-40 -117.57 13.77 14.39 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.35 -0.841 . . . . 11.869999999999999 111.326 -178.563 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 148' ' ' LYS . . . . . 0.544 ' HG3' ' O ' ' A' ' 144' ' ' MET . 35.5 mttm . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.19 -0.91 . . . . 13.68 110.84 179.548 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.461 HD13 ' SG ' ' A' ' 69' ' ' CYS . 49.3 mt . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.955 0.407 . . . . 1.27 110.71 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.428 HG22 ' H ' ' A' ' 6' ' ' GLU . 0.2 OUTLIER -73.41 169.32 17.41 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.875 -0.602 . . . . 1.1200000000000001 111.073 -179.833 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.428 ' H ' HG22 ' A' ' 5' ' ' THR . 32.9 tt0 -52.05 -46.64 65.18 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.407 -0.36 . . . . 2.2000000000000002 111.501 179.668 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -70.82 -46.13 63.33 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.216 -0.447 . . . . 1.3500000000000001 111.08 -179.27 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -58.16 -42.99 87.14 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.975 -0.557 . . . . 2.2200000000000002 110.872 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.506 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 72.5 mt -59.47 -51.04 77.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.302 -0.408 . . . . 0.54000000000000004 110.376 179.596 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.08 -22.54 66.97 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.024 -0.535 . . . . 0.5 111.315 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -70.05 -56.87 5.81 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 116.34 -0.391 . . . . 2.27 111.835 -179.111 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.518 ' HB2' ' HE2' ' A' ' 68' ' ' PHE . 13.3 p90 -78.91 -24.85 43.85 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.733 -0.387 . . . . 0.37 110.692 -179.684 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.41 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 24.0 tptp -64.01 -35.58 81.17 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 108.923 -0.769 . . . . 1.23 108.923 178.382 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.443 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 20.4 t70 -70.14 -49.78 47.18 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 115.621 -0.718 . . . . 0.44 109.302 178.37 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.43 -14.62 42.81 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.769 -0.65 . . . . 0.28999999999999998 110.506 178.942 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.41 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 36.3 t80 -79.93 -50.58 10.24 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.742 -0.663 . . . . 0.47999999999999998 110.686 -179.708 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 31.2 m -65.93 -19.31 25.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 121.01 0.433 . . . . 1.1100000000000001 110.336 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.443 ' HG2' ' O ' ' A' ' 14' ' ' ASP . 75.3 mm-40 -58.64 -37.18 75.39 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.656 -0.702 . . . . 1.6000000000000001 111.331 179.294 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 62.0 m-85 -91.26 9.87 29.57 Favored 'General case' 0 N--CA 1.464 0.248 0 N-CA-C 111.767 0.284 . . . . 0.64000000000000001 111.767 -179.684 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -106.85 83.94 1.92 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.886 0.374 . . . . 0.44 110.808 179.602 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 29.9 mmmt -92.77 -10.61 36.34 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.061 -0.518 . . . . 2.1000000000000001 111.242 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -84.95 -14.32 47.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.147 -0.479 . . . . 1.8 111.281 -179.488 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.14 6.73 88.79 Favored Glycine 0 N--CA 1.453 -0.21 0 C-N-CA 120.688 -0.768 . . . . 0.46000000000000002 112.605 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 40.2 p -82.4 8.09 12.39 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.688 0.28 . . . . 0.40000000000000002 111.071 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 56.94 18.01 24.49 Favored Glycine 0 C--N 1.332 0.34 0 C-N-CA 120.824 -0.703 . . . . 0.33000000000000002 112.165 -179.683 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.434 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 32.6 mtpt -129.31 155.69 45.21 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.773 0.32 . . . . 1.1000000000000001 111.161 -179.406 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.403 HG13 ' HB2' ' A' ' 63' ' ' LEU . 39.8 pt -118.19 133.02 66.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 120.895 0.379 . . . . 0.5 111.455 -179.791 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -52.52 138.77 27.03 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.079 -0.509 . . . . 0.29999999999999999 111.247 -179.816 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.555 ' HA ' HD11 ' A' ' 63' ' ' LEU . 8.9 t -71.27 -2.51 16.41 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.194 -0.457 . . . . 1.03 111.323 -179.771 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.436 ' HD2' ' N ' ' A' ' 30' ' ' ARG . 0.9 OUTLIER -98.48 2.49 47.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.029 0.443 . . . . 3.0800000000000001 110.25 179.592 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -124.43 -5.41 7.7 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.782 -0.645 . . . . 2.2599999999999998 110.886 -179.745 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.468 ' O ' ' HG2' ' A' ' 36' ' ' MET . 2.1 tm? -55.57 -51.28 67.64 Favored 'General case' 0 C--O 1.233 0.198 0 N-CA-C 109.954 -0.387 . . . . 1.3700000000000001 109.954 179.694 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.42 ' HA2' HD11 ' A' ' 48' ' ' LEU . . . -53.71 -37.31 56.72 Favored Glycine 0 C--N 1.333 0.366 0 C-N-CA 120.629 -0.796 . . . . 0.32000000000000001 111.4 179.122 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 59.7 m -67.49 -31.48 71.65 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.279 0.561 . . . . 0.31 110.112 178.974 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 56.3 tp -72.83 -19.72 61.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.544 -0.753 . . . . 1.24 110.369 179.554 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.468 ' HG2' ' O ' ' A' ' 32' ' ' LEU . 75.8 mmm -80.02 -47.11 15.43 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.062 -0.517 . . . . 1.1000000000000001 110.786 179.593 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 13.4 ptm180 -61.85 -39.87 93.38 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.365 -0.38 . . . . 2.6899999999999999 111.399 -179.763 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.491 HG23 HD12 ' A' ' 39' ' ' LEU . 5.3 t -62.84 -14.42 45.64 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 121.179 0.514 . . . . 1.0600000000000001 110.413 179.491 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.491 HD12 HG23 ' A' ' 38' ' ' THR . 6.8 mp -114.46 157.21 23.23 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.464 -0.789 . . . . 1.26 109.31 178.385 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -74.02 34.54 0.91 Allowed Glycine 0 CA--C 1.521 0.43 0 C-N-CA 120.612 -0.804 . . . . 0.68999999999999995 113.298 -179.74 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.471 ' OE1' ' HB3' ' A' ' 39' ' ' LEU . 3.5 mm100 -91.65 -68.12 0.81 Allowed 'General case' 0 C--O 1.232 0.14 0 CA-C-O 120.829 0.347 . . . . 1.97 110.547 179.517 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 31.0 m-80 54.42 78.32 0.39 Allowed Pre-proline 0 CA--C 1.53 0.183 0 CA-C-N 115.961 -0.563 . . . . 2.6600000000000001 111.16 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.429 ' HD3' ' HB3' ' A' ' 36' ' ' MET . 74.4 Cg_endo -75.04 175.51 11.15 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.456 2.104 . . . . 0.51000000000000001 112.319 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 34.4 m -74.16 149.01 41.19 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.173 -0.467 . . . . 0.72999999999999998 110.734 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.479 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 38.1 mt-10 -53.6 -55.84 22.31 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.546 -0.297 . . . . 2.7000000000000002 111.484 -179.664 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.85 -47.08 71.32 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.339 -0.391 . . . . 0.46000000000000002 111.698 -179.405 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -57.9 -49.95 74.99 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.926 0.393 . . . . 2.23 110.582 -179.689 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.42 HD11 ' HA2' ' A' ' 33' ' ' GLY . 21.4 tp -57.48 -37.13 72.42 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.832 -0.622 . . . . 1.3600000000000001 111.068 -179.772 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.479 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 78.4 mm-40 -75.2 -28.01 59.82 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.42 -0.355 . . . . 1.22 111.264 -179.818 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 45.7 m-20 -75.35 -46.05 35.6 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.402 -0.363 . . . . 0.62 111.681 -179.588 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.414 HD21 ' HA ' ' A' ' 48' ' ' LEU . 1.9 pp -71.92 -40.12 69.01 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.552 -0.295 . . . . 0.39000000000000001 111.66 -179.314 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 71.8 mt -64.97 -45.02 95.94 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-O 120.746 0.308 . . . . 0.5 110.736 179.795 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -69.08 -35.12 76.15 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.308 -0.405 . . . . 0.58999999999999997 110.667 179.767 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -64.93 -46.63 80.83 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.18 -0.464 . . . . 2.54 109.87 179.384 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -70.92 -21.5 62.35 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.844 -0.616 . . . . 0.53000000000000003 110.909 179.295 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -65.65 -54.39 28.17 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.344 -0.389 . . . . 1.95 110.865 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 87.1 m-20 -93.81 52.76 1.71 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.279 -0.419 . . . . 2.48 110.932 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -162.33 -63.24 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.188 -0.46 . . . . 2.48 110.628 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 29.4 m-80 -93.0 27.1 2.54 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.204 -0.453 . . . . 2.0499999999999998 110.869 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 57.5 m-20 65.21 -78.98 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 115.998 -0.546 . . . . 1.47 111.172 179.876 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -163.79 22.06 0.16 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.901 -0.666 . . . . 0.42999999999999999 112.297 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.434 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 10.0 mm-40 -131.92 153.1 50.61 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.976 0.417 . . . . 0.38 111.38 -179.782 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.555 HD11 ' HA ' ' A' ' 29' ' ' THR . 33.6 mt -120.63 151.9 38.86 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.768 -0.651 . . . . 1.4299999999999999 110.276 179.818 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 19.9 m-80 -113.18 157.69 21.37 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.765 0.317 . . . . 1.1899999999999999 110.879 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -42.61 -39.75 2.46 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.751 -0.659 . . . . 0.40000000000000002 111.415 -179.499 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -68.98 -35.63 76.94 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.105 0.409 . . . . 0.81000000000000005 112.105 -179.575 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -61.1 -52.87 63.08 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.01 0.433 . . . . 1.3600000000000001 110.457 179.739 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.518 ' HE2' ' HB2' ' A' ' 12' ' ' PHE . 36.6 t80 -65.63 -46.24 80.01 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.698 -0.683 . . . . 0.51000000000000001 111.02 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.461 ' SG ' HD13 ' A' ' 4' ' ' LEU . 2.7 t -58.38 -46.99 85.28 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.233 -0.44 . . . . 0.75 110.723 -179.932 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -53.32 -50.27 53.12 Favored Glycine 0 N--CA 1.451 -0.347 0 CA-C-N 115.837 -0.619 . . . . 0.40999999999999998 112.136 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.604 HG23 ' HE2' ' A' ' 74' ' ' LYS . 12.6 mt -62.57 -38.04 80.46 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.386 0 CA-C-O 120.924 0.392 . . . . 0.51000000000000001 110.787 179.695 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -58.6 -28.57 65.71 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.899 -0.591 . . . . 1.01 110.26 179.421 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -73.09 -49.45 28.4 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.06 -0.518 . . . . 0.69999999999999996 110.778 179.632 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.604 ' HE2' HG23 ' A' ' 71' ' ' ILE . 61.9 pttt -69.56 -26.7 64.62 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.245 -0.434 . . . . 1.3799999999999999 110.838 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 58.2 tt0 -78.69 -50.06 12.07 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.074 -0.512 . . . . 1.98 110.99 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 34.8 mtt . . . . . 0 N--CA 1.447 -0.612 0 CA-C-N 116.175 -0.466 . . . . 1.2 110.908 179.779 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.505 ' O ' ' HG2' ' A' ' 85' ' ' MET . 6.1 t . . . . . 0 N--CA 1.47 0.532 0 CA-C-O 121.079 0.466 . . . . 7.29 111.388 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.44 ' HA ' ' HG2' ' A' ' 85' ' ' MET . 13.1 pt-20 -46.08 -32.38 2.84 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 113.064 0.764 . . . . 9.7400000000000002 113.064 -178.479 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -53.74 -56.06 20.77 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.002 0.43 . . . . 12.109999999999999 111.733 -179.152 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -65.99 -17.51 64.72 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.227 -0.442 . . . . 10.869999999999999 110.85 -179.935 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' MET . . . . . 0.603 ' CB ' HG22 ' A' ' 142' ' ' VAL . 0.8 OUTLIER -83.0 -25.02 32.63 Favored 'General case' 0 CA--C 1.509 -0.63 0 CA-C-O 121.912 0.863 . . . . 11.09 109.081 -179.089 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 31.1 tpt180 -71.04 -45.23 64.22 Favored 'General case' 0 N--CA 1.442 -0.835 0 CA-C-N 113.902 -1.499 . . . . 15.52 110.151 179.693 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -69.26 -37.26 77.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.844 -0.616 . . . . 14.85 110.06 178.839 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -69.69 -39.58 76.86 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.008 -0.542 . . . . 14.109999999999999 111.046 179.635 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -64.25 -34.84 79.04 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.995 0.426 . . . . 15.73 110.276 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 59.8 mttt -62.45 -55.23 29.65 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.726 -0.67 . . . . 17.66 110.882 179.493 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 55.1 mt -64.15 -29.68 48.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.655 -0.702 . . . . 18.149999999999999 111.652 -179.409 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -79.6 -29.97 41.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.584 -0.28 . . . . 18.34 111.657 -179.403 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 24.1 t0 -83.84 101.83 11.91 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.009 0.433 . . . . 19.289999999999999 110.617 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.86 -14.17 58.65 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.874 -0.603 . . . . 22.25 111.719 -179.567 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.467 ' HB2' ' OD1' ' A' ' 97' ' ' ASP . 4.7 m-20 -125.66 160.07 30.62 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.932 0.396 . . . . 23.34 111.148 -179.876 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -87.68 5.34 85.11 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.899 -0.667 . . . . 22.0 112.051 179.64 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.467 ' OD1' ' HB2' ' A' ' 95' ' ' ASP . 10.4 p-10 -61.54 -33.12 73.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.784 0.326 . . . . 22.280000000000001 110.962 -179.844 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 99.84 17.85 24.43 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.758 -0.734 . . . . 19.93 112.845 179.691 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' PHE . . . . . 0.421 ' HB2' ' OD2' ' A' ' 97' ' ' ASP . 98.0 m-85 -141.09 147.1 38.01 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.815 0.34 . . . . 20.300000000000001 111.313 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 71.3 mt -114.96 136.2 52.41 Favored 'Isoleucine or valine' 0 C--O 1.232 0.157 0 CA-C-N 116.141 -0.482 . . . . 19.370000000000001 110.828 179.368 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 70.8 m -114.64 156.13 45.18 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 116.076 -0.511 . . . . 22.489999999999998 110.647 -179.819 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -40.1 -36.14 1.39 Allowed 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 122.458 2.105 . . . . 23.0 112.524 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.83 -51.66 60.89 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.105 -0.498 . . . . 24.559999999999999 110.839 179.58 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' GLU . . . . . 0.402 ' O ' HG23 ' A' ' 108' ' ' VAL . 45.8 mt-10 -63.42 -45.03 92.87 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.808 -0.633 . . . . 22.23 110.739 179.768 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.769 HD23 ' HB ' ' A' ' 121' ' ' ILE . 21.7 tp -52.27 -42.71 63.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.862 -0.608 . . . . 20.359999999999999 110.999 -179.665 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.547 HH21 ' HA ' ' A' ' 117' ' ' THR . 4.4 ttm180 -72.13 -45.24 61.33 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.896 -0.593 . . . . 27.190000000000001 111.14 -179.907 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -53.14 -34.2 55.76 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.272 -0.422 . . . . 25.359999999999999 111.42 -179.468 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.466 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 43.3 t -80.17 -51.15 16.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.636 -0.256 . . . . 21.059999999999999 111.292 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 18.1 mmt -49.61 -46.18 49.01 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.372 -0.376 . . . . 20.93 111.406 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 68.4 mt -62.31 -30.16 48.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.92 0.39 . . . . 25.129999999999999 110.589 179.74 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 -74.94 -28.02 60.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.029 -0.532 . . . . 23.32 110.913 179.494 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 27.8 mt -77.16 -41.79 40.31 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.108 -0.496 . . . . 21.07 110.732 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 131.18 -5.2 5.65 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.996 -0.621 . . . . 23.050000000000001 111.965 -179.611 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -91.13 97.69 11.3 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.696 0.284 . . . . 22.59 110.875 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -68.71 102.1 1.45 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.291 -0.413 . . . . 27.960000000000001 110.82 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 116' ' ' VAL . . . . . 0.442 ' HB ' HG23 ' A' ' 121' ' ' ILE . 2.3 m -115.86 154.74 17.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.212 -0.449 . . . . 24.75 111.428 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 117' ' ' THR . . . . . 0.547 ' HA ' HH21 ' A' ' 106' ' ' ARG . 81.5 p -98.88 145.77 26.65 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.854 -0.612 . . . . 27.239999999999998 110.53 179.487 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -51.88 -20.84 2.49 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.227 -0.442 . . . . 26.629999999999999 111.612 -179.549 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -78.26 -53.2 7.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.427 -0.351 . . . . 29.140000000000001 111.676 -179.527 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -63.83 -37.91 89.13 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.04 0.385 . . . . 24.190000000000001 112.04 -179.115 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.769 ' HB ' HD23 ' A' ' 105' ' ' LEU . 38.7 pt -72.83 -42.19 61.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 C-N-CA 120.83 -0.348 . . . . 22.329999999999998 111.702 -179.518 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 122' ' ' ASP . . . . . 0.478 ' N ' HG13 ' A' ' 121' ' ' ILE . 18.1 t70 -58.74 -44.77 90.59 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.842 0.353 . . . . 24.289999999999999 110.671 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -60.08 -44.99 94.38 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.082 -0.508 . . . . 24.739999999999998 110.457 179.475 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 43.2 ttp -57.46 -33.66 68.19 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.905 -0.588 . . . . 19.710000000000001 110.63 179.386 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 66.5 mt -65.82 -43.96 93.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.048 -0.524 . . . . 19.949999999999999 110.554 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 33.8 ttm180 -58.23 -40.66 82.28 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.924 -0.58 . . . . 24.949999999999999 111.048 179.802 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -56.45 -43.65 79.7 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.254 -0.43 . . . . 18.690000000000001 111.08 -179.892 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.628 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -87.39 -14.25 41.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.148 -0.478 . . . . 16.469999999999999 111.28 -179.776 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 129' ' ' ASP . . . . . 0.432 ' HA ' ' OE1' ' A' ' 140' ' ' GLU . 27.5 t70 -93.61 99.23 11.71 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.015 0.436 . . . . 20.399999999999999 110.728 -179.739 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -89.74 -37.1 14.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.8 -0.636 . . . . 21.43 111.278 -179.679 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -63.7 -18.04 63.59 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.324 -0.398 . . . . 23.370000000000001 110.583 -179.828 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 60.74 83.45 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.977 -0.63 . . . . 24.32 112.831 179.665 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 133' ' ' ASP . . . . . 0.424 ' OD2' ' HB2' ' A' ' 135' ' ' MET . 12.6 p-10 -146.44 -5.62 0.56 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.791 0.329 . . . . 23.879999999999999 111.086 179.586 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 77.09 11.71 85.31 Favored Glycine 0 C--N 1.331 0.254 0 C-N-CA 120.866 -0.683 . . . . 22.670000000000002 112.699 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 135' ' ' MET . . . . . 0.424 ' HB2' ' OD2' ' A' ' 133' ' ' ASP . 88.9 mtp -133.38 154.27 50.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.646 0.26 . . . . 22.91 110.389 179.653 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.662 HG23 ' HB2' ' A' ' 140' ' ' GLU . 40.4 mm -115.3 144.89 21.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 121.254 0.55 . . . . 18.41 112.155 -179.246 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 137' ' ' ASN . . . . . 0.429 ' O ' ' N ' ' A' ' 139' ' ' GLU . 30.0 p-10 -114.81 157.86 22.68 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.304 -0.862 . . . . 16.82 108.779 178.058 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.645 ' O ' HG23 ' A' ' 142' ' ' VAL . 27.8 t80 -39.27 -25.19 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 112.377 0.51 . . . . 14.65 112.377 -179.152 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 139' ' ' GLU . . . . . 0.429 ' N ' ' O ' ' A' ' 137' ' ' ASN . 44.9 mt-10 -80.05 -55.92 4.61 Favored 'General case' 0 C--O 1.234 0.275 0 O-C-N 122.226 -0.296 . . . . 14.82 111.401 -179.563 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.662 ' HB2' HG23 ' A' ' 136' ' ' ILE . 30.7 mt-10 -60.82 -27.33 67.97 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.986 0.422 . . . . 17.460000000000001 110.36 179.895 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.619 ' HA ' ' HE2' ' A' ' 144' ' ' MET . 91.6 t80 -69.33 -56.01 8.77 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.905 -0.588 . . . . 12.93 109.787 179.333 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.645 HG23 ' O ' ' A' ' 138' ' ' TYR . 38.9 t -45.41 -40.84 2.84 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 CA-C-N 115.55 -0.75 . . . . 10.699999999999999 111.643 178.917 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 143' ' ' TRP . . . . . 0.41 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 75.5 t90 -67.68 -55.61 12.58 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.744 0.646 . . . . 13.66 112.744 -178.845 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 144' ' ' MET . . . . . 0.628 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 19.9 ptt? -67.07 -20.25 65.79 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 113.257 0.836 . . . . 14.5 113.257 -177.433 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 145' ' ' ILE . . . . . 0.574 HG23 ' O ' ' A' ' 141' ' ' PHE . 43.4 pt -80.52 -46.09 21.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 N-CA-C 112.236 0.458 . . . . 11.25 112.236 -179.121 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 146' ' ' SER . . . . . 0.551 ' N ' HG13 ' A' ' 145' ' ' ILE . 28.8 t -63.58 -13.93 46.55 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.193 0.521 . . . . 8.5399999999999991 110.356 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 147' ' ' GLN . . . . . 0.41 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 16.6 mm-40 -118.35 45.33 2.04 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.385 -0.825 . . . . 11.869999999999999 111.651 -178.245 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 148' ' ' LYS . . . . . 0.442 ' HE3' ' O ' ' A' ' 145' ' ' ILE . 10.4 mtmp? . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.242 -0.885 . . . . 13.68 110.919 179.51 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.9 mt . . . . . 0 CA--C 1.529 0.143 0 CA-C-O 120.618 0.247 . . . . 1.27 111.007 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 72.3 p -76.68 -177.45 4.27 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.456 -0.338 . . . . 1.1200000000000001 111.294 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -60.25 -51.26 70.32 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.376 -0.375 . . . . 2.2000000000000002 111.562 -179.512 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -67.74 -45.63 74.44 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.983 0.42 . . . . 1.3500000000000001 111.018 -179.572 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 81.4 mm-40 -59.23 -42.41 90.95 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.812 -0.631 . . . . 2.2200000000000002 111.245 -179.717 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.532 ' HA ' ' CZ ' ' A' ' 12' ' ' PHE . 55.0 mt -60.62 -49.79 83.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.884 0.373 . . . . 0.54000000000000004 110.652 179.744 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.2 -19.07 64.73 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.995 -0.548 . . . . 0.5 111.099 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -73.94 -55.83 5.69 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.259 -0.428 . . . . 2.27 111.767 -179.238 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.532 ' CZ ' ' HA ' ' A' ' 9' ' ' ILE . 4.2 p90 -77.53 -24.51 49.95 Favored 'General case' 0 C--N 1.332 -0.196 0 C-N-CA 120.673 -0.411 . . . . 0.37 111.012 -179.582 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 23.9 tptp -66.92 -41.44 87.05 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 109.397 -0.594 . . . . 1.23 109.397 178.9 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -65.26 -47.67 75.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.898 -0.592 . . . . 0.44 109.477 178.498 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.87 -30.65 70.27 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 115.643 -0.708 . . . . 0.28999999999999998 110.415 179.127 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 24.9 t80 -66.95 -38.89 86.96 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.572 -0.74 . . . . 0.47999999999999998 110.623 179.664 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -70.88 -28.39 33.5 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.774 0 CA-C-N 115.966 -0.561 . . . . 1.1100000000000001 111.153 -179.724 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -60.54 -27.86 67.98 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.791 -0.641 . . . . 1.6000000000000001 111.486 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 54.9 m-85 -94.01 -12.63 28.22 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.63 -0.259 . . . . 0.64000000000000001 111.672 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -84.93 91.25 8.0 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.894 0.378 . . . . 0.44 110.732 179.621 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 71.8 mmtt -100.03 -26.03 14.11 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.965 -0.561 . . . . 2.1000000000000001 111.243 -179.659 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -70.96 -20.14 62.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.168 -0.469 . . . . 1.8 111.281 -179.549 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 86.45 0.2 86.64 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.786 -0.721 . . . . 0.46000000000000002 112.707 179.627 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 22.7 p -79.39 10.74 3.48 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.738 0.304 . . . . 0.40000000000000002 111.212 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 55.54 30.01 54.97 Favored Glycine 0 C--N 1.331 0.293 0 C-N-CA 120.82 -0.705 . . . . 0.33000000000000002 112.066 -179.877 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.428 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 33.0 mtmm -138.33 155.85 48.18 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.744 0.307 . . . . 1.1000000000000001 111.238 -179.466 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.558 HG13 ' HB2' ' A' ' 63' ' ' LEU . 33.8 pt -116.12 126.41 73.61 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 116.358 -0.383 . . . . 0.5 111.199 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -50.74 142.02 11.99 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.181 -0.463 . . . . 0.29999999999999999 111.501 -179.898 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.503 ' HA ' HD11 ' A' ' 63' ' ' LEU . 9.8 t -67.44 -16.09 64.03 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.886 -0.597 . . . . 1.03 111.745 -179.542 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -89.46 5.08 46.95 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.473 -0.33 . . . . 3.0800000000000001 110.679 179.728 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -123.18 -4.26 8.45 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.091 -0.504 . . . . 2.2599999999999998 110.942 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.508 HD21 ' CD1' ' A' ' 68' ' ' PHE . 1.6 tm? -58.81 -48.6 80.75 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.35 -0.386 . . . . 1.3700000000000001 110.373 179.617 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -55.64 -35.77 63.18 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.533 -0.841 . . . . 0.32000000000000001 111.306 179.341 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 88.5 m -69.74 -39.92 76.5 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.062 0.458 . . . . 0.31 110.21 179.272 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 56.1 tp -65.15 -24.07 67.3 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.731 -0.668 . . . . 1.24 110.322 179.439 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.496 ' HG3' ' HG3' ' A' ' 43' ' ' PRO . 21.5 mmt -75.46 -43.32 50.15 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.94 -0.573 . . . . 1.1000000000000001 110.13 179.139 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -55.87 -50.14 71.43 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.645 -0.707 . . . . 2.6899999999999999 111.102 179.834 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.442 HG23 ' HG ' ' A' ' 39' ' ' LEU . 10.1 t -61.68 -13.49 23.17 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.294 -0.412 . . . . 1.0600000000000001 111.135 179.84 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.442 ' HG ' HG23 ' A' ' 38' ' ' THR . 75.0 mt -113.57 157.16 22.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.096 -0.502 . . . . 1.26 110.613 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -75.85 40.36 1.4 Allowed Glycine 0 CA--C 1.521 0.426 0 C-N-CA 120.883 -0.675 . . . . 0.68999999999999995 114.027 -178.884 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 9.9 mp0 -97.15 -66.72 0.88 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 117.103 0.451 . . . . 1.97 111.109 179.029 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 59.0 m-20 60.82 67.21 1.55 Allowed Pre-proline 0 CA--C 1.53 0.199 0 CA-C-N 116.149 -0.478 . . . . 2.6600000000000001 111.098 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.496 ' HG3' ' HG3' ' A' ' 36' ' ' MET . 60.1 Cg_endo -71.47 160.39 48.65 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.72 2.28 . . . . 0.51000000000000001 112.124 179.655 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 33.4 m -74.5 146.76 42.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.153 -0.476 . . . . 0.72999999999999998 110.604 179.635 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.435 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 41.9 tt0 -46.4 -50.34 16.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.61 -0.268 . . . . 2.7000000000000002 111.137 -179.522 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -51.32 -53.07 39.66 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.274 -0.421 . . . . 0.46000000000000002 111.315 -179.748 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.467 ' HG2' HD23 ' A' ' 51' ' ' LEU . 36.8 tt0 -52.08 -49.5 63.43 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.357 -0.383 . . . . 2.23 110.618 179.888 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 51.6 mt -57.87 -40.24 79.73 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.38 -0.373 . . . . 1.3600000000000001 110.584 179.572 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.435 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 31.7 mm-40 -65.66 -32.74 74.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.411 -0.359 . . . . 1.22 111.026 179.862 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -75.13 -54.64 6.79 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.222 -0.444 . . . . 0.62 112.103 -179.349 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.467 HD23 ' HG2' ' A' ' 47' ' ' GLU . 2.2 pp -66.33 -39.71 89.42 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 111.995 0.368 . . . . 0.39000000000000001 111.995 -178.871 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 86.1 mt -68.48 -43.31 83.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 C-N-CA 121.147 -0.221 . . . . 0.5 111.054 -179.647 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.86 -38.86 89.95 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.809 0.338 . . . . 0.58999999999999997 110.811 179.72 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -64.02 -43.54 95.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.13 -0.486 . . . . 2.54 110.309 179.607 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -77.19 -16.36 59.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.983 -0.553 . . . . 0.53000000000000003 110.996 179.543 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -65.74 -23.9 66.84 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.148 -0.478 . . . . 1.95 110.799 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -103.92 29.61 5.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.035 -0.53 . . . . 2.48 110.621 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 58.8 t30 -158.51 150.26 21.23 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.007 -0.542 . . . . 2.48 110.754 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 74.4 m-20 59.76 15.1 4.54 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.042 -0.526 . . . . 2.0499999999999998 111.021 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 18.3 m-80 60.71 12.9 3.96 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.905 -0.589 . . . . 1.47 111.917 179.29 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 113.62 30.47 2.6 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.636 -0.792 . . . . 0.42999999999999999 112.389 179.722 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.428 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 9.6 mm-40 -127.32 154.52 44.84 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.095 0.474 . . . . 0.38 111.3 -179.832 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.558 ' HB2' HG13 ' A' ' 27' ' ' ILE . 17.4 mt -121.08 152.42 38.68 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.608 -0.724 . . . . 1.4299999999999999 109.753 179.366 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ASN . . . . . 0.438 ' H ' ' CG ' ' A' ' 67' ' ' GLU . 0.8 OUTLIER -113.07 156.76 22.55 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 110.19 -0.3 . . . . 1.1899999999999999 110.19 -179.483 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.537 ' O ' ' HB2' ' A' ' 69' ' ' CYS . 82.8 t80 -42.41 -41.56 2.93 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.483 -0.326 . . . . 0.40000000000000002 110.959 179.889 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 3.8 m -71.45 -33.85 69.73 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.352 -0.386 . . . . 0.81000000000000005 111.397 -179.766 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.438 ' CG ' ' H ' ' A' ' 64' ' ' ASN . 17.5 mm-40 -62.51 -51.28 68.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.871 0.367 . . . . 1.3600000000000001 110.287 179.393 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.508 ' CD1' HD21 ' A' ' 32' ' ' LEU . 32.8 t80 -67.65 -47.43 69.56 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.021 -0.536 . . . . 0.51000000000000001 110.649 179.534 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.537 ' HB2' ' O ' ' A' ' 65' ' ' PHE . 0.1 OUTLIER -57.27 -38.9 74.62 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-O 120.959 0.409 . . . . 0.75 110.059 179.599 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -57.51 -50.95 60.87 Favored Glycine 0 CA--C 1.507 -0.466 0 N-CA-C 111.119 -0.792 . . . . 0.40999999999999998 111.119 179.462 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.706 HG23 ' HE2' ' A' ' 74' ' ' LYS . 70.6 mt -59.5 -50.12 81.09 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.656 0 CA-C-O 121.032 0.444 . . . . 0.51000000000000001 110.365 178.466 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 15.2 mtp -49.68 -28.94 6.58 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.613 -0.721 . . . . 1.01 110.51 179.524 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -71.87 -45.28 61.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.328 -0.396 . . . . 0.69999999999999996 110.231 179.291 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.706 ' HE2' HG23 ' A' ' 71' ' ' ILE . 49.0 pttt -70.56 -28.87 65.23 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.125 -0.489 . . . . 1.3799999999999999 111.041 179.823 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 20.3 tp60 -80.58 -55.42 4.87 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.001 -0.545 . . . . 1.98 111.623 -179.784 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 68.3 mtp . . . . . 0 N--CA 1.449 -0.496 0 CA-C-N 116.169 -0.469 . . . . 1.2 111.793 -179.275 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.64 ' O ' ' HG2' ' A' ' 85' ' ' MET . 58.8 m . . . . . 0 CA--C 1.529 0.137 0 N-CA-C 109.925 -0.398 . . . . 7.29 109.925 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -58.12 -16.03 11.72 Favored 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 113.39 0.885 . . . . 9.7400000000000002 113.39 -178.169 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -64.26 -56.5 14.17 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.001 0.429 . . . . 12.109999999999999 111.683 -179.286 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -68.19 -14.08 62.71 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.045 -0.525 . . . . 10.869999999999999 110.919 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' MET . . . . . 0.64 ' HG2' ' O ' ' A' ' 81' ' ' THR . 4.5 mmm -80.35 -38.77 29.83 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.119 -0.491 . . . . 11.09 110.42 -179.441 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 10.4 ttm180 -67.73 -42.55 81.72 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.975 -0.557 . . . . 15.52 109.595 179.303 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.503 ' O ' HG12 ' A' ' 91' ' ' ILE . 36.9 tt0 -59.55 -48.77 80.34 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.879 -0.6 . . . . 14.85 109.811 179.011 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.56 -29.87 70.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.938 -0.574 . . . . 14.109999999999999 110.778 179.583 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 46.7 t80 -59.28 -52.04 67.37 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 109.846 -0.427 . . . . 15.73 109.846 179.492 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -59.06 -37.77 77.82 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.797 -0.638 . . . . 17.66 110.021 178.77 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.503 HG12 ' O ' ' A' ' 87' ' ' GLU . 40.0 mm -59.92 -40.98 84.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.431 -0.804 . . . . 18.149999999999999 110.83 179.469 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.528 ' O ' ' HD3' ' A' ' 94' ' ' ARG . 7.0 m-85 -74.06 -56.64 4.68 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.311 -0.404 . . . . 18.34 111.332 -179.636 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 93' ' ' ASP . . . . . 0.486 ' HA ' ' CZ ' ' A' ' 94' ' ' ARG . 43.2 t0 -49.96 124.97 10.97 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 120.947 0.403 . . . . 19.289999999999999 110.566 -179.739 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.67 ' CZ ' ' HB3' ' A' ' 104' ' ' GLU . 0.0 OUTLIER -76.78 -31.97 57.38 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.904 -0.589 . . . . 22.25 111.662 -178.694 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -113.76 177.97 4.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.978 0.418 . . . . 23.34 111.368 -179.036 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -88.38 3.9 85.32 Favored Glycine 0 N--CA 1.449 -0.472 0 N-CA-C 110.919 -0.872 . . . . 22.0 110.919 178.632 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 22.3 p-10 -56.02 -39.18 71.55 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.227 -0.487 . . . . 22.280000000000001 111.167 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 89.48 21.57 40.3 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.846 -0.693 . . . . 19.93 111.922 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' PHE . . . . . 0.501 ' HA ' ' O ' ' A' ' 136' ' ' ILE . 97.5 m-85 -136.93 143.83 43.12 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.858 0.361 . . . . 20.300000000000001 111.328 -179.709 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.538 ' HB ' ' HB ' ' A' ' 136' ' ' ILE . 59.6 mt -114.35 132.3 63.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-N 115.904 -0.589 . . . . 19.370000000000001 110.832 179.629 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 26.7 p -114.42 156.18 44.86 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.037 -0.529 . . . . 22.489999999999998 110.693 -179.705 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_exo -42.78 -48.71 7.18 Favored 'Trans proline' 0 C--N 1.348 0.538 0 C-N-CA 122.686 2.257 . . . . 23.0 112.965 -179.78 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.81 -51.29 68.86 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.093 0.473 . . . . 24.559999999999999 111.068 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' GLU . . . . . 0.67 ' HB3' ' CZ ' ' A' ' 94' ' ' ARG . 38.6 mt-10 -59.15 -41.34 88.1 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.716 -0.674 . . . . 22.23 111.04 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.708 HD23 ' HB ' ' A' ' 121' ' ' ILE . 47.7 tp -54.38 -46.72 73.13 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.67 -0.695 . . . . 20.359999999999999 111.037 -179.476 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 5.4 ttt180 -60.47 -48.16 82.98 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.104 -0.498 . . . . 27.190000000000001 110.854 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 72.5 t80 -52.19 -35.02 47.92 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.223 -0.444 . . . . 25.359999999999999 111.513 -179.457 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.631 HG21 HH11 ' A' ' 94' ' ' ARG . 30.2 t -77.18 -54.12 13.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 N-CA-C 111.748 0.277 . . . . 21.059999999999999 111.748 -179.611 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -49.54 -39.63 35.27 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.834 0.349 . . . . 20.93 110.955 -179.715 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 84.7 mt -66.84 -28.68 43.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.17 -0.468 . . . . 25.129999999999999 110.936 179.757 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 89.1 m-20 -72.84 -46.18 54.37 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.235 -0.439 . . . . 23.32 110.336 179.639 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 9.6 mp -60.32 -45.11 94.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.626 -0.715 . . . . 21.07 110.976 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 128.95 11.81 2.79 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.8 -0.714 . . . . 23.050000000000001 112.474 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -106.51 94.64 5.24 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.789 0.328 . . . . 22.59 111.07 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -60.99 126.2 26.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.159 -0.473 . . . . 27.960000000000001 110.704 179.588 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 116' ' ' VAL . . . . . 0.425 HG12 ' OE1' ' A' ' 120' ' ' GLU . 3.0 m -144.41 150.71 16.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.231 -0.44 . . . . 24.75 111.444 -179.792 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 68.3 p -94.5 149.36 21.32 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.826 -0.625 . . . . 27.239999999999998 110.218 179.231 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -54.78 -17.24 3.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.155 -0.475 . . . . 26.629999999999999 111.601 -179.597 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -77.8 -55.18 5.54 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.479 -0.328 . . . . 29.140000000000001 111.511 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 120' ' ' GLU . . . . . 0.425 ' OE1' HG12 ' A' ' 116' ' ' VAL . 14.6 pt-20 -63.36 -38.84 92.71 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 111.996 0.369 . . . . 24.190000000000001 111.996 -179.151 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.708 ' HB ' HD23 ' A' ' 105' ' ' LEU . 42.0 pt -71.68 -41.61 71.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 N-CA-C 111.787 0.292 . . . . 22.329999999999998 111.787 -179.408 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 122' ' ' ASP . . . . . 0.513 ' N ' HG13 ' A' ' 121' ' ' ILE . 19.7 t70 -59.89 -39.76 86.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.741 0.305 . . . . 24.289999999999999 110.702 179.873 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -65.06 -43.9 90.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.11 -0.496 . . . . 24.739999999999998 110.605 179.682 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 52.6 ttp -56.76 -37.78 71.54 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.114 -0.494 . . . . 19.710000000000001 110.585 179.459 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.61 HG23 HD11 ' A' ' 136' ' ' ILE . 72.3 mt -65.85 -43.23 93.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.99 -0.55 . . . . 19.949999999999999 110.448 179.595 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 75.0 ttt180 -60.82 -30.66 70.22 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.701 -0.682 . . . . 24.949999999999999 111.115 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -75.88 -27.62 57.81 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.132 -0.485 . . . . 18.690000000000001 111.362 -179.701 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.581 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -101.06 -8.73 22.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.355 -0.384 . . . . 16.469999999999999 111.181 -179.805 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 30.2 t0 -100.7 87.48 3.35 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.179 -0.464 . . . . 20.399999999999999 110.825 -179.785 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 71.7 m-85 -67.4 -49.81 62.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.895 -0.593 . . . . 21.43 111.147 -179.633 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -57.39 -29.12 63.81 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.239 -0.437 . . . . 23.370000000000001 110.776 179.89 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 67.17 63.62 3.7 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.973 -0.632 . . . . 24.32 112.909 179.419 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -122.95 7.26 9.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.851 0.358 . . . . 23.879999999999999 110.586 179.533 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 69.07 18.83 73.27 Favored Glycine 0 C--N 1.33 0.246 0 C-N-CA 120.99 -0.624 . . . . 22.670000000000002 112.629 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 85.6 mmm -134.57 153.66 51.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.701 0.286 . . . . 22.91 110.545 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.663 HG23 ' HB2' ' A' ' 140' ' ' GLU . 43.4 mm -114.79 141.81 29.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 121.091 0.472 . . . . 18.41 111.563 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 137' ' ' ASN . . . . . 0.435 ' O ' ' N ' ' A' ' 139' ' ' GLU . 37.1 t30 -114.89 156.42 25.02 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.258 -0.883 . . . . 16.82 108.801 178.345 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.694 ' O ' HG23 ' A' ' 142' ' ' VAL . 6.8 t80 -40.08 -24.8 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 120.706 0.288 . . . . 14.65 111.487 179.698 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 139' ' ' GLU . . . . . 0.435 ' N ' ' O ' ' A' ' 137' ' ' ASN . 14.3 mm-40 -80.28 -55.78 4.67 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.876 0.37 . . . . 14.82 111.01 -179.353 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.663 ' HB2' HG23 ' A' ' 136' ' ' ILE . 35.5 mt-10 -57.74 -31.17 66.19 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.005 -0.543 . . . . 17.460000000000001 110.401 179.742 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.554 ' CE2' HD13 ' A' ' 145' ' ' ILE . 90.0 t80 -69.58 -56.04 8.44 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.599 -0.728 . . . . 12.93 110.708 -179.922 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.694 HG23 ' O ' ' A' ' 138' ' ' TYR . 52.0 t -46.58 -38.22 3.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.002 -0.545 . . . . 10.699999999999999 111.958 179.626 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 143' ' ' TRP . . . . . 0.451 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 91.0 t90 -71.08 -55.87 7.32 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.469 0.544 . . . . 13.66 112.469 -178.809 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 144' ' ' MET . . . . . 0.581 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 18.4 ptt? -62.47 -25.0 67.76 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 112.971 0.73 . . . . 14.5 112.971 -177.75 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 145' ' ' ILE . . . . . 0.587 HD11 ' HB3' ' A' ' 85' ' ' MET . 45.1 pt -80.93 -40.47 18.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 N-CA-C 112.168 0.433 . . . . 11.25 112.168 -179.83 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 146' ' ' SER . . . . . 0.538 ' N ' HG13 ' A' ' 145' ' ' ILE . 88.1 p -61.31 -14.82 29.72 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-O 121.494 0.664 . . . . 8.5399999999999991 109.557 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 147' ' ' GLN . . . . . 0.451 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 2.7 mm-40 -113.6 -11.51 12.99 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 114.899 -1.046 . . . . 11.869999999999999 109.897 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 148' ' ' LYS . . . . . 0.579 ' HB2' ' HA ' ' A' ' 145' ' ' ILE . 28.0 ttpp . . . . . 0 C--O 1.25 1.085 0 CA-C-O 118.247 -0.882 . . . . 13.68 110.92 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.598 HD13 ' SG ' ' A' ' 69' ' ' CYS . 33.2 mt . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.827 0.346 . . . . 1.27 110.614 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 56.5 p -70.99 -165.4 0.12 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.132 -0.486 . . . . 1.1200000000000001 111.194 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -75.48 -42.79 52.16 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.995 0.426 . . . . 2.2000000000000002 110.472 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -73.06 -35.13 66.63 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.834 -0.621 . . . . 1.3500000000000001 110.536 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 86.2 mm-40 -70.85 -47.21 60.59 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.922 -0.581 . . . . 2.2200000000000002 110.817 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.517 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 35.4 mt -58.46 -41.26 81.18 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 116.271 -0.422 . . . . 0.54000000000000004 110.912 179.828 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -76.06 -22.05 56.08 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.438 -0.347 . . . . 0.5 111.043 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -68.47 -57.1 6.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.199 -0.455 . . . . 2.27 111.736 -179.425 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.517 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 11.5 p90 -76.76 -25.29 53.27 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.678 -0.409 . . . . 0.37 110.489 -179.721 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.404 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 18.9 tptm -63.33 -34.01 76.77 Favored 'General case' 0 CA--C 1.519 -0.242 0 N-CA-C 108.87 -0.789 . . . . 1.23 108.87 178.227 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.608 ' O ' HG22 ' A' ' 17' ' ' VAL . 14.0 t70 -69.74 -53.02 20.39 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 109.013 -0.736 . . . . 0.44 109.013 178.418 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.05 -15.23 21.26 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.821 -0.627 . . . . 0.28999999999999998 110.508 178.887 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.404 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 66.1 t80 -80.69 -44.76 18.24 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.746 -0.661 . . . . 0.47999999999999998 111.001 -179.729 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.608 HG22 ' O ' ' A' ' 14' ' ' ASP . 25.7 m -69.33 -21.14 24.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.983 0.42 . . . . 1.1100000000000001 110.675 -179.664 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.55 ' HG3' ' O ' ' A' ' 14' ' ' ASP . 83.8 mt-30 -63.69 -25.29 68.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.83 -0.623 . . . . 1.6000000000000001 111.3 179.814 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -104.9 25.06 10.93 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.57 -0.286 . . . . 0.64000000000000001 111.617 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -116.74 80.64 1.5 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.059 0.457 . . . . 0.44 110.723 179.336 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt -93.83 5.14 52.63 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.85 -0.614 . . . . 2.1000000000000001 111.176 -179.658 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -103.89 -1.26 27.99 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.316 -0.402 . . . . 1.8 111.35 -179.371 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 63.48 10.39 36.03 Favored Glycine 0 CA--C 1.517 0.201 0 C-N-CA 120.921 -0.657 . . . . 0.46000000000000002 113.144 179.578 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 30.4 p -90.15 10.85 22.84 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.699 0.285 . . . . 0.40000000000000002 111.122 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 56.26 18.13 20.12 Favored Glycine 0 C--N 1.332 0.306 0 C-N-CA 120.766 -0.73 . . . . 0.33000000000000002 111.912 -179.653 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.42 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 32.1 mtpt -129.58 155.95 44.97 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.594 -0.303 . . . . 1.1000000000000001 110.819 -179.339 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.401 ' O ' HG13 ' A' ' 27' ' ' ILE . 35.7 pt -120.87 129.96 75.13 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 120.934 0.397 . . . . 0.5 111.359 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -47.78 137.46 9.6 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.144 -0.48 . . . . 0.29999999999999999 111.336 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.494 HG23 ' HD2' ' A' ' 30' ' ' ARG . 5.5 t -67.31 -0.27 3.41 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.926 -0.579 . . . . 1.03 110.873 179.804 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.494 ' HD2' HG23 ' A' ' 29' ' ' THR . 3.6 mmm180 -94.28 -17.8 22.27 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.98 -0.554 . . . . 3.0800000000000001 110.28 179.839 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -102.07 -3.0 28.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.56 -0.745 . . . . 2.2599999999999998 110.503 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.445 HD12 HD11 ' A' ' 51' ' ' LEU . 3.2 tm? -58.08 -50.66 72.68 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.009 -0.542 . . . . 1.3700000000000001 110.311 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -54.34 -38.56 62.5 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.49 -0.862 . . . . 0.32000000000000001 111.524 179.301 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 92.8 m -65.95 -34.53 78.33 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.006 0.432 . . . . 0.31 110.429 179.145 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 48.3 tp -68.3 -36.68 79.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.789 -0.641 . . . . 1.24 110.909 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.452 ' HG3' ' HG3' ' A' ' 43' ' ' PRO . 40.0 mmm -65.46 -40.19 92.91 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.88 -0.415 . . . . 1.1000000000000001 109.88 179.549 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 74.9 mtp180 -67.9 -30.39 69.71 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.266 -0.642 . . . . 2.6899999999999999 109.266 178.705 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 96.2 m -65.97 -21.29 66.41 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 115.286 -0.87 . . . . 1.0600000000000001 110.415 179.245 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 10.3 mp -114.49 156.96 23.62 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.493 -0.776 . . . . 1.26 110.413 179.757 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -53.16 -8.12 0.64 Allowed Glycine 0 CA--C 1.52 0.402 0 C-N-CA 121.109 -0.567 . . . . 0.68999999999999995 113.339 -179.789 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 82.9 mm-40 -60.43 176.14 0.38 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.089 0.471 . . . . 1.97 111.343 179.752 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 16.8 p-10 -169.81 72.27 0.66 Allowed Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 115.782 -0.645 . . . . 2.6600000000000001 110.85 179.8 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.452 ' HG3' ' HG3' ' A' ' 36' ' ' MET . 56.9 Cg_endo -68.84 142.29 51.68 Favored 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.595 2.196 . . . . 0.51000000000000001 112.316 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 26.9 m -64.22 148.46 50.05 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.243 -0.435 . . . . 0.72999999999999998 110.168 179.346 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.479 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 6.7 tp10 -48.15 -55.69 9.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.595 0.236 . . . . 2.7000000000000002 110.999 -179.356 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -51.13 -52.13 46.9 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.144 -0.48 . . . . 0.46000000000000002 111.42 -179.837 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -50.01 -50.45 47.29 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.375 -0.375 . . . . 2.23 110.702 179.858 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 12.8 mt -57.07 -45.48 83.26 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.229 -0.441 . . . . 1.3600000000000001 110.676 179.751 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.479 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 30.4 mm-40 -60.73 -32.31 71.59 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.811 0.339 . . . . 1.22 110.911 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -73.71 -55.52 6.16 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.204 -0.453 . . . . 0.62 112.185 -179.086 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.445 HD11 HD12 ' A' ' 32' ' ' LEU . 1.8 pp -66.59 -36.72 83.3 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 111.613 0.227 . . . . 0.39000000000000001 111.613 -179.13 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 78.9 mt -64.81 -43.25 96.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.702 0.287 . . . . 0.5 110.483 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.54 -28.84 68.14 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.2 -0.454 . . . . 0.58999999999999997 110.372 179.328 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -66.05 -51.36 58.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.93 -0.577 . . . . 2.54 110.228 179.452 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -78.51 -14.72 59.22 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.055 -0.52 . . . . 0.53000000000000003 111.429 179.708 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.477 ' HA ' HG21 ' A' ' 29' ' ' THR . 40.7 tt0 -59.97 -44.09 94.68 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.504 -0.316 . . . . 1.95 111.051 -179.807 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 79.2 m-20 -122.45 57.64 1.08 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.306 -0.406 . . . . 2.48 110.984 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -149.26 -30.53 0.24 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.157 -0.474 . . . . 2.48 110.782 179.821 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -128.7 25.69 5.65 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.139 -0.482 . . . . 2.0499999999999998 110.784 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 62.69 11.37 4.8 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.96 -0.564 . . . . 1.47 111.667 179.846 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 104.18 37.95 2.78 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.687 -0.768 . . . . 0.42999999999999999 112.647 179.608 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.42 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 9.9 mm-40 -140.56 154.31 46.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.139 0.495 . . . . 0.38 111.438 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 81.3 mt -122.02 147.76 45.67 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.742 -0.663 . . . . 1.4299999999999999 110.146 179.607 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -112.9 156.76 22.4 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.61 -0.268 . . . . 1.1899999999999999 110.507 -179.645 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.444 ' O ' ' HB2' ' A' ' 69' ' ' CYS . 78.3 t80 -43.69 -42.6 5.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.206 -0.452 . . . . 0.40000000000000002 111.287 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.27 -34.11 74.27 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 111.874 0.324 . . . . 0.81000000000000005 111.874 -179.713 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -63.09 -54.02 44.56 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.097 0.475 . . . . 1.3600000000000001 110.239 179.501 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.48 ' HE2' ' HB2' ' A' ' 12' ' ' PHE . 28.7 t80 -64.14 -45.01 90.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.752 -0.658 . . . . 0.51000000000000001 110.752 179.676 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.598 ' SG ' HD13 ' A' ' 4' ' ' LEU . 3.9 t -58.15 -44.19 87.74 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.079 -0.509 . . . . 0.75 110.156 179.62 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -53.26 -48.16 60.02 Favored Glycine 0 N--CA 1.45 -0.432 0 CA-C-N 115.622 -0.717 . . . . 0.40999999999999998 111.674 179.536 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.494 HG23 ' CE ' ' A' ' 74' ' ' LYS . 14.4 mt -62.75 -44.7 99.7 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.363 0 CA-C-O 121.091 0.472 . . . . 0.51000000000000001 110.426 179.257 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -53.33 -27.12 21.66 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.555 -0.748 . . . . 1.01 110.035 179.472 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -74.48 -47.29 34.13 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.907 -0.588 . . . . 0.69999999999999996 111.034 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.494 ' CE ' HG23 ' A' ' 71' ' ' ILE . 63.1 pttt -68.74 -27.5 65.98 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 116.551 -0.295 . . . . 1.3799999999999999 111.247 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' GLN . . . . . 0.443 ' NE2' ' HB3' ' A' ' 43' ' ' PRO . 81.3 mt-30 -81.24 -50.41 9.59 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.796 0.332 . . . . 1.98 111.497 179.061 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 33.1 mtt . . . . . 0 N--CA 1.454 -0.265 0 N-CA-C 112.373 0.509 . . . . 1.2 112.373 -178.963 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.519 ' O ' ' HG2' ' A' ' 85' ' ' MET . 13.0 t . . . . . 0 N--CA 1.458 -0.046 0 CA-C-O 120.751 0.31 . . . . 7.29 111.163 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.438 ' HA ' ' HG2' ' A' ' 85' ' ' MET . 41.9 mt-10 -75.61 -14.4 60.37 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.21 -0.45 . . . . 9.7400000000000002 111.495 -179.273 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -60.78 -55.29 34.92 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.384 -0.371 . . . . 12.109999999999999 111.614 -179.716 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -65.74 -20.52 66.3 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.303 -0.408 . . . . 10.869999999999999 111.23 -179.503 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' MET . . . . . 0.539 ' HB3' HD11 ' A' ' 145' ' ' ILE . 1.5 mmm -80.46 -36.01 34.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.991 0.424 . . . . 11.09 110.78 -179.353 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 29.4 ttt180 -67.96 -42.44 80.88 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.821 -0.627 . . . . 15.52 110.487 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -68.06 -37.93 81.86 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.078 -0.51 . . . . 14.85 110.002 179.161 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.16 -31.15 67.33 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.972 -0.558 . . . . 14.109999999999999 110.854 179.499 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -67.71 -40.45 84.27 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.118 -0.492 . . . . 15.73 110.456 179.766 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -66.5 -39.91 88.97 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.914 -0.585 . . . . 17.66 110.559 179.493 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 96.9 mt -64.47 -47.93 87.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.845 -0.616 . . . . 18.149999999999999 110.795 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.482 ' HD2' HG11 ' A' ' 108' ' ' VAL . 4.4 m-85 -63.85 -57.14 10.77 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.114 -0.494 . . . . 18.34 110.695 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 93' ' ' ASP . . . . . 0.601 ' HA ' HH21 ' A' ' 94' ' ' ARG . 27.4 t0 -53.51 127.3 24.67 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 120.787 0.327 . . . . 19.289999999999999 110.228 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.731 ' H ' ' HE ' ' A' ' 94' ' ' ARG . 0.0 OUTLIER -98.19 -24.18 15.38 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.28 -0.418 . . . . 22.25 111.788 -178.665 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -101.84 -179.93 4.15 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.969 0.414 . . . . 23.34 111.026 -179.794 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.26 3.3 56.67 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.886 -0.673 . . . . 22.0 112.024 179.628 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -71.63 -36.14 70.66 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.869 0.366 . . . . 22.280000000000001 111.24 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 90.38 27.15 21.31 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.737 -0.744 . . . . 19.93 112.494 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' PHE . . . . . 0.422 ' HA ' ' O ' ' A' ' 136' ' ' ILE . 86.3 m-85 -132.32 142.81 49.49 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.569 0.223 . . . . 20.300000000000001 110.764 179.839 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.579 ' HB ' ' HB ' ' A' ' 136' ' ' ILE . 41.5 mt -114.47 126.28 71.97 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-O 120.923 0.392 . . . . 19.370000000000001 111.268 179.893 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 26.8 p -116.05 156.12 47.19 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 115.94 -0.573 . . . . 22.489999999999998 110.555 179.794 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_exo -41.63 -36.33 3.1 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 122.448 2.099 . . . . 23.0 112.464 -179.63 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.416 ' O ' ' HG3' ' A' ' 106' ' ' ARG . . . -64.89 -49.98 68.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.08 0.467 . . . . 24.559999999999999 110.591 179.554 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 104' ' ' GLU . . . . . 0.582 ' HB3' ' CZ ' ' A' ' 94' ' ' ARG . 38.1 mt-10 -63.24 -50.25 70.94 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.935 -0.575 . . . . 22.23 110.677 179.337 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.626 HD23 ' HB ' ' A' ' 121' ' ' ILE . 48.0 tp -51.55 -35.43 40.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.642 -0.708 . . . . 20.359999999999999 111.799 -179.081 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.448 ' HG3' ' N ' ' A' ' 107' ' ' PHE . 0.1 OUTLIER -76.28 -32.15 58.65 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.91 0.386 . . . . 27.190000000000001 110.551 -179.677 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 107' ' ' PHE . . . . . 0.448 ' N ' ' HG3' ' A' ' 106' ' ' ARG . 85.5 t80 -72.62 -34.75 67.57 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.901 -0.591 . . . . 25.359999999999999 111.732 -179.883 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.487 HG13 ' N ' ' A' ' 109' ' ' MET . 7.3 p -77.86 -47.0 26.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 N-CA-C 112.011 0.374 . . . . 21.059999999999999 112.011 -179.203 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.487 ' N ' HG13 ' A' ' 108' ' ' VAL . 0.2 OUTLIER -51.6 -36.99 47.89 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.724 0.297 . . . . 20.93 111.533 -179.321 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.428 HG13 ' O ' ' A' ' 106' ' ' ARG . 75.7 mt -69.47 -26.8 32.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.349 -0.387 . . . . 25.129999999999999 111.082 -179.827 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -73.29 -41.14 63.94 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.195 -0.457 . . . . 23.32 110.619 179.635 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 9.2 mp -63.5 -44.37 94.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.914 -0.585 . . . . 21.07 110.945 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 133.6 1.88 3.72 Favored Glycine 0 C--N 1.331 0.286 0 C-N-CA 120.688 -0.768 . . . . 23.050000000000001 112.753 179.562 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -103.16 115.38 30.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.784 0.326 . . . . 22.59 111.291 -179.637 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -76.09 128.52 35.15 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.196 -0.456 . . . . 27.960000000000001 110.256 179.434 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 116' ' ' VAL . . . . . 0.466 ' HB ' HG23 ' A' ' 121' ' ' ILE . 3.1 m -142.36 155.6 18.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 121.18 0.514 . . . . 24.75 111.802 -179.474 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 117' ' ' THR . . . . . 0.456 ' O ' HG12 ' A' ' 121' ' ' ILE . 43.0 p -103.44 147.49 27.07 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.472 -0.785 . . . . 27.239999999999998 110.208 179.646 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -51.95 -19.69 1.94 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.241 -0.436 . . . . 26.629999999999999 111.519 -179.635 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -77.9 -54.92 5.76 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.523 -0.308 . . . . 29.140000000000001 111.704 -179.535 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 120' ' ' GLU . . . . . 0.431 ' OE1' HG12 ' A' ' 116' ' ' VAL . 14.6 pt-20 -63.17 -39.57 95.03 Favored 'General case' 0 C--N 1.332 -0.196 0 N-CA-C 112.034 0.383 . . . . 24.190000000000001 112.034 -179.182 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.626 ' HB ' HD23 ' A' ' 105' ' ' LEU . 15.2 pt -71.63 -40.28 70.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 C-N-CA 121.022 -0.271 . . . . 22.329999999999998 111.63 -179.485 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 122' ' ' ASP . . . . . 0.532 ' N ' HG13 ' A' ' 121' ' ' ILE . 15.4 t70 -57.79 -43.13 85.43 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.741 0.305 . . . . 24.289999999999999 110.538 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -63.0 -43.7 98.07 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.07 -0.514 . . . . 24.739999999999998 110.171 179.415 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.455 ' HE3' HD21 ' A' ' 105' ' ' LEU . 56.0 ttp -57.15 -33.89 67.87 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.002 -0.545 . . . . 19.710000000000001 110.362 179.148 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.653 HG23 HD11 ' A' ' 136' ' ' ILE . 97.3 mt -67.36 -43.72 87.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.815 -0.629 . . . . 19.949999999999999 110.533 179.638 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 32.3 ttm180 -60.3 -32.6 71.37 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.937 -0.574 . . . . 24.949999999999999 110.801 179.593 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -63.67 -29.73 70.93 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.13 -0.487 . . . . 18.690000000000001 111.278 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.686 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -104.28 -15.37 15.49 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.3 -0.409 . . . . 16.469999999999999 111.329 -179.86 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -93.98 103.53 15.61 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.108 -0.496 . . . . 20.399999999999999 110.771 -179.666 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -96.52 -31.09 12.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.883 -0.599 . . . . 21.43 111.32 -179.427 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -70.69 -15.85 62.75 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.389 -0.369 . . . . 23.370000000000001 110.74 179.932 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 58.88 85.29 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 121.024 -0.607 . . . . 24.32 112.946 179.557 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -152.21 1.98 0.34 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.684 0.278 . . . . 23.879999999999999 111.073 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 69.28 20.85 75.5 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.81 -0.709 . . . . 22.670000000000002 112.753 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 82.1 mmm -135.12 155.04 51.4 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.591 0.234 . . . . 22.91 110.523 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.674 HG23 ' HB2' ' A' ' 140' ' ' GLU . 46.4 mm -116.79 143.81 26.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 121.093 0.473 . . . . 18.41 111.491 179.892 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 137' ' ' ASN . . . . . 0.404 ' C ' ' N ' ' A' ' 139' ' ' GLU . 30.2 m-20 -114.41 156.67 24.07 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.267 -0.878 . . . . 16.82 108.711 178.465 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.686 ' O ' HG23 ' A' ' 142' ' ' VAL . 16.9 t80 -42.65 -23.47 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.673 0.273 . . . . 14.65 111.151 179.823 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 139' ' ' GLU . . . . . 0.404 ' N ' ' C ' ' A' ' 137' ' ' ASN . 12.0 mm-40 -80.52 -56.03 4.46 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 120.904 0.383 . . . . 14.82 110.831 -179.799 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.674 ' HB2' HG23 ' A' ' 136' ' ' ILE . 29.6 mt-10 -57.96 -27.26 63.26 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.139 -0.482 . . . . 17.460000000000001 110.121 179.616 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.585 ' HA ' ' HE2' ' A' ' 144' ' ' MET . 90.3 t80 -70.4 -55.71 8.41 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.746 -0.661 . . . . 12.93 110.035 179.435 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.686 HG23 ' O ' ' A' ' 138' ' ' TYR . 55.1 t -46.03 -36.91 2.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 115.781 -0.645 . . . . 10.699999999999999 111.507 178.964 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 79.5 t90 -71.81 -55.5 7.47 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 112.563 0.579 . . . . 13.66 112.563 -178.809 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 144' ' ' MET . . . . . 0.686 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 20.8 ptt? -64.28 -22.63 67.02 Favored 'General case' 0 N--CA 1.463 0.203 0 N-CA-C 112.921 0.711 . . . . 14.5 112.921 -177.637 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 145' ' ' ILE . . . . . 0.694 ' HA ' ' HB2' ' A' ' 148' ' ' LYS . 28.3 pt -80.55 -42.58 21.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 C-N-CA 120.702 -0.399 . . . . 11.25 111.416 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 146' ' ' SER . . . . . 0.469 ' N ' HG13 ' A' ' 145' ' ' ILE . 82.3 p -65.04 -14.15 59.7 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.519 0.676 . . . . 8.5399999999999991 109.421 179.235 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 -125.94 19.5 7.76 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 114.839 -1.073 . . . . 11.869999999999999 110.066 -179.589 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 148' ' ' LYS . . . . . 0.694 ' HB2' ' HA ' ' A' ' 145' ' ' ILE . 24.1 ttpp . . . . . 0 C--O 1.25 1.107 0 CA-C-O 118.296 -0.859 . . . . 13.68 110.898 -179.618 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 51.3 mt . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.77 0.319 . . . . 1.27 111.105 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -98.07 165.16 12.03 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.205 -0.452 . . . . 1.1200000000000001 110.838 179.822 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -51.59 -39.05 57.21 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.797 0.332 . . . . 2.2000000000000002 111.51 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.444 ' HG3' ' N ' ' A' ' 8' ' ' GLN . 11.6 pt-20 -72.08 -46.7 55.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.278 -0.419 . . . . 1.3500000000000001 111.075 -179.406 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' GLN . . . . . 0.444 ' N ' ' HG3' ' A' ' 7' ' ' GLU . 96.7 mt-30 -61.04 -42.55 98.69 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.885 -0.598 . . . . 2.2200000000000002 110.945 -179.812 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.483 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 77.1 mt -59.29 -51.94 66.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.951 -0.568 . . . . 0.54000000000000004 110.893 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.0 -26.8 67.86 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.12 -0.491 . . . . 0.5 111.654 -179.718 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -69.45 -56.72 6.61 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 112.155 0.428 . . . . 2.27 112.155 -178.834 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.483 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 8.5 p90 -77.89 -25.03 48.29 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 120.466 -0.494 . . . . 0.37 110.908 -179.544 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.457 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 41.6 tptt -64.45 -34.12 77.47 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 108.969 -0.752 . . . . 1.23 108.969 178.707 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -70.12 -48.95 55.35 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 108.697 -0.853 . . . . 0.44 108.697 177.689 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.84 -14.06 41.26 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.268 -0.878 . . . . 0.28999999999999998 110.355 178.697 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.457 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 31.2 t80 -80.04 -54.04 6.16 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.809 -0.632 . . . . 0.47999999999999998 111.0 -179.501 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 15.6 m -62.25 -22.73 30.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 121.105 0.479 . . . . 1.1100000000000001 110.334 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 75.6 mm-40 -61.09 -32.41 72.07 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.624 -0.716 . . . . 1.6000000000000001 111.543 179.597 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 99.7 m-85 -101.97 33.89 2.88 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.741 0.305 . . . . 0.64000000000000001 111.631 -179.817 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -125.64 75.5 1.49 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.042 0.449 . . . . 0.44 110.425 179.32 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 41.1 tptt -87.01 -33.85 19.43 Favored 'General case' 0 N--CA 1.436 -1.129 0 CA-C-N 115.824 -0.625 . . . . 2.1000000000000001 110.925 -179.783 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -63.24 -15.68 57.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.102 -0.499 . . . . 1.8 111.384 -179.52 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.48 10.7 84.6 Favored Glycine 0 C--N 1.331 0.264 0 C-N-CA 120.832 -0.699 . . . . 0.46000000000000002 112.833 179.553 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 20.3 p -86.9 15.35 5.98 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.637 0.256 . . . . 0.40000000000000002 111.213 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 53.35 26.39 29.57 Favored Glycine 0 C--N 1.333 0.388 0 C-N-CA 120.851 -0.69 . . . . 0.33000000000000002 112.234 -179.792 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.469 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 31.5 mtmm -135.0 156.57 48.82 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.822 0.344 . . . . 1.1000000000000001 111.054 -179.646 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.616 HG13 ' HB2' ' A' ' 63' ' ' LEU . 23.8 pt -114.11 126.02 71.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 121.115 0.483 . . . . 0.5 111.468 -179.649 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -54.49 138.17 41.07 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.861 -0.609 . . . . 0.29999999999999999 111.213 179.707 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 9.4 t -68.31 -9.44 47.75 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.061 -0.518 . . . . 1.03 111.382 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.421 ' HD3' ' N ' ' A' ' 30' ' ' ARG . 0.0 OUTLIER -87.13 -14.14 42.15 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.256 -0.429 . . . . 3.0800000000000001 110.681 179.902 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -108.19 -0.28 21.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.093 -0.503 . . . . 2.2599999999999998 110.632 179.768 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.447 HD22 ' HA ' ' A' ' 32' ' ' LEU . 1.0 OUTLIER -60.08 -46.08 90.77 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.072 -0.513 . . . . 1.3700000000000001 109.972 179.665 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.589 ' HA2' HD11 ' A' ' 48' ' ' LEU . . . -56.89 -36.8 74.8 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.507 -0.854 . . . . 0.32000000000000001 111.277 179.051 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 87.6 m -70.54 -32.5 69.98 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.007 0.432 . . . . 0.31 110.027 179.047 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.46 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 1.2 tt -65.48 -35.47 80.98 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.679 -0.691 . . . . 1.24 110.165 179.68 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.571 ' HG3' ' HG3' ' A' ' 43' ' ' PRO . 21.7 mmt -69.52 -42.17 75.03 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.215 -0.448 . . . . 1.1000000000000001 110.482 179.301 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 62.7 mtp180 -53.19 -51.65 61.39 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.617 -0.719 . . . . 2.6899999999999999 111.403 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 10.2 t -62.99 -12.78 28.1 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.433 -0.349 . . . . 1.0600000000000001 111.538 -179.785 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.46 ' HG ' ' O ' ' A' ' 35' ' ' LEU . 47.1 mt -113.06 156.65 22.75 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.364 -0.38 . . . . 1.26 110.708 -179.827 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -76.88 39.89 1.6 Allowed Glycine 0 CA--C 1.52 0.357 0 C-N-CA 120.88 -0.676 . . . . 0.68999999999999995 113.912 -178.952 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 67.2 mm-40 -94.3 -59.98 1.83 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 117.148 0.474 . . . . 1.97 110.745 179.034 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 57.15 66.28 3.17 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.132 -0.486 . . . . 2.6600000000000001 111.088 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.571 ' HG3' ' HG3' ' A' ' 36' ' ' MET . 43.5 Cg_endo -67.42 167.95 19.26 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.593 2.195 . . . . 0.51000000000000001 112.117 179.723 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 20.6 m -74.43 150.09 40.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.184 -0.462 . . . . 0.72999999999999998 110.511 179.654 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -54.76 -48.01 73.17 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.654 0.264 . . . . 2.7000000000000002 111.434 -179.716 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.81 -47.19 81.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.375 -0.375 . . . . 0.46000000000000002 111.498 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.451 ' O ' HD23 ' A' ' 51' ' ' LEU . 10.0 tp10 -56.46 -48.79 76.33 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.03 0.443 . . . . 2.23 110.48 -179.554 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.589 HD11 ' HA2' ' A' ' 33' ' ' GLY . 33.4 tp -57.45 -41.24 80.16 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.555 -0.748 . . . . 1.3600000000000001 110.938 -179.759 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 67.8 mt-30 -72.17 -25.95 61.88 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.058 -0.519 . . . . 1.22 111.212 -179.595 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -71.12 -55.05 9.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.483 -0.326 . . . . 0.62 111.565 -179.916 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.451 HD23 ' O ' ' A' ' 47' ' ' GLU . 0.9 OUTLIER -64.9 -38.8 92.16 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.459 -0.337 . . . . 0.39000000000000001 111.844 -179.226 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 94.5 mt -65.5 -48.37 83.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.841 0.353 . . . . 0.5 110.837 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.92 -26.33 66.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.192 -0.458 . . . . 0.58999999999999997 110.745 179.635 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -69.79 -53.98 15.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.991 -0.549 . . . . 2.54 110.416 179.753 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -72.7 -14.3 61.54 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.996 -0.547 . . . . 0.53000000000000003 111.176 179.735 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -55.53 -30.61 61.02 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.097 -0.501 . . . . 1.95 111.406 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -118.57 -33.23 4.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.506 -0.316 . . . . 2.48 111.337 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -69.58 -34.64 74.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.412 -0.358 . . . . 2.48 111.133 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ASN . . . . . 0.453 ' O ' ' HB2' ' A' ' 60' ' ' ASN . 13.5 m120 -114.7 6.25 15.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.315 -0.402 . . . . 2.0499999999999998 111.246 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ASN . . . . . 0.453 ' HB2' ' O ' ' A' ' 59' ' ' ASN . 39.6 m-80 74.0 -49.66 0.68 Allowed 'General case' 0 N--CA 1.466 0.375 0 O-C-N 123.607 0.567 . . . . 1.47 111.527 -179.867 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 169.43 7.52 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.598 -0.81 . . . . 0.42999999999999999 112.992 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.469 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 9.6 mm-40 -124.66 155.03 39.85 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.995 0.426 . . . . 0.38 111.284 179.837 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.616 ' HB2' HG13 ' A' ' 27' ' ' ILE . 27.3 mt -129.28 156.56 43.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.867 -0.606 . . . . 1.4299999999999999 110.854 -179.79 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ASN . . . . . 0.421 ' H ' ' CG ' ' A' ' 67' ' ' GLU . 44.3 m-80 -112.34 157.26 21.21 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.526 -0.307 . . . . 1.1899999999999999 110.493 179.902 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.473 ' O ' ' HB2' ' A' ' 69' ' ' CYS . 87.8 t80 -43.06 -38.46 2.34 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.986 -0.552 . . . . 0.40000000000000002 110.654 179.589 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -72.81 -37.71 67.44 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.063 -0.517 . . . . 0.81000000000000005 111.922 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.421 ' CG ' ' H ' ' A' ' 64' ' ' ASN . 20.6 mm-40 -59.65 -49.97 75.69 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.179 0.514 . . . . 1.3600000000000001 109.918 179.562 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.466 ' HE2' ' HB2' ' A' ' 12' ' ' PHE . 34.2 t80 -68.5 -53.7 21.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.525 -0.761 . . . . 0.51000000000000001 110.839 179.763 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.473 ' HB2' ' O ' ' A' ' 65' ' ' PHE . 1.8 t -51.52 -41.02 60.74 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-O 120.971 0.415 . . . . 0.75 110.267 179.667 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -56.94 -50.38 64.45 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.864 -0.684 . . . . 0.40999999999999998 111.526 179.577 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.453 ' HA ' ' HE2' ' A' ' 74' ' ' LYS . 11.4 mt -62.38 -36.69 76.02 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.407 0 CA-C-O 120.88 0.372 . . . . 0.51000000000000001 110.852 179.344 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' MET . . . . . 0.406 ' HG2' ' O ' ' A' ' 68' ' ' PHE . 95.0 mmm -59.2 -41.34 88.32 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.153 0.501 . . . . 1.01 109.679 179.104 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -55.93 -52.7 63.19 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.463 -0.79 . . . . 0.69999999999999996 110.659 178.871 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.453 ' HE2' ' HA ' ' A' ' 71' ' ' ILE . 55.3 pttt -68.7 -30.52 69.2 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.287 -0.415 . . . . 1.3799999999999999 111.15 -179.923 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 16.1 tp60 -68.64 -45.61 71.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.92 0.39 . . . . 1.98 110.884 179.624 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 45.1 mtt . . . . . 0 N--CA 1.445 -0.719 0 CA-C-N 115.861 -0.609 . . . . 1.2 111.022 -179.744 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.532 ' O ' ' HG2' ' A' ' 85' ' ' MET . 3.0 t . . . . . 0 N--CA 1.469 0.492 0 CA-C-O 121.17 0.509 . . . . 7.29 111.07 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -49.92 -18.95 0.59 Allowed 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 115.281 -0.872 . . . . 9.7400000000000002 113.112 -178.53 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -60.35 -56.28 23.35 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 111.854 0.316 . . . . 12.109999999999999 111.854 -179.213 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -72.73 -13.65 61.38 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.357 -0.383 . . . . 10.869999999999999 111.285 -179.455 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' MET . . . . . 0.628 ' HB3' HG22 ' A' ' 142' ' ' VAL . 5.6 mmm -79.34 -49.28 12.66 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.468 -0.333 . . . . 11.09 110.627 -179.197 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 16.3 ttp180 -63.45 -42.23 98.65 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 116.219 -0.446 . . . . 15.52 109.912 179.586 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -60.11 -42.14 94.1 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.013 -0.539 . . . . 14.85 109.795 179.105 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -72.17 -23.23 61.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.75 -0.659 . . . . 14.109999999999999 110.597 179.426 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -68.95 -43.44 75.04 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.194 -0.457 . . . . 15.73 110.482 179.649 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 47.7 mtmt -68.32 -40.99 81.46 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.135 -0.484 . . . . 17.66 110.353 179.482 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 93.0 mt -64.47 -46.36 93.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.89 -0.595 . . . . 18.149999999999999 111.106 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.457 ' HA ' HG21 ' A' ' 108' ' ' VAL . 0.6 OUTLIER -65.93 -49.13 69.03 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.281 -0.418 . . . . 18.34 110.907 -179.963 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -61.06 98.63 0.08 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.28 -0.418 . . . . 19.289999999999999 110.069 179.75 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.43 ' HG2' ' HB3' ' A' ' 104' ' ' GLU . 18.9 mmm180 -51.7 -27.77 12.76 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.918 -0.583 . . . . 22.25 111.231 -179.414 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.423 ' HB2' ' OD1' ' A' ' 97' ' ' ASP . 4.0 m-20 -112.22 169.9 8.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.3 -0.409 . . . . 23.34 110.731 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.41 5.6 57.31 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.891 -0.671 . . . . 22.0 112.051 179.675 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.423 ' OD1' ' HB2' ' A' ' 95' ' ' ASP . 7.8 p-10 -57.43 -32.7 67.16 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.687 0.28 . . . . 22.280000000000001 111.23 -179.659 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 107.43 12.97 22.06 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.698 -0.763 . . . . 19.93 112.926 179.626 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' PHE . . . . . 0.455 ' HA ' ' O ' ' A' ' 136' ' ' ILE . 97.3 m-85 -138.69 145.26 40.14 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.834 0.349 . . . . 20.300000000000001 111.071 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 48.5 mt -115.85 137.81 48.33 Favored 'Isoleucine or valine' 0 C--O 1.232 0.148 0 CA-C-N 116.151 -0.477 . . . . 19.370000000000001 111.445 -179.726 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 28.3 p -115.84 156.31 46.65 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 115.827 -0.624 . . . . 22.489999999999998 110.606 179.841 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_exo -44.34 -38.01 11.0 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.396 2.064 . . . . 23.0 112.552 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -63.89 -40.05 95.6 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.055 -0.521 . . . . 24.559999999999999 111.037 179.905 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' GLU . . . . . 0.526 ' O ' HG23 ' A' ' 108' ' ' VAL . 42.2 mt-10 -72.82 -41.44 64.9 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.473 -0.785 . . . . 22.23 110.369 -179.896 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.583 HD23 ' HE1' ' A' ' 109' ' ' MET . 4.9 tp -58.05 -55.04 40.14 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.695 -0.684 . . . . 20.359999999999999 110.381 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 9.0 ttp180 -54.61 -49.78 69.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.588 -0.733 . . . . 27.190000000000001 111.573 -179.813 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 55.3 t80 -54.59 -33.8 60.93 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.203 -0.453 . . . . 25.359999999999999 111.786 -178.952 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.526 HG23 ' O ' ' A' ' 104' ' ' GLU . 58.3 t -79.23 -55.43 9.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 112.113 0.412 . . . . 21.059999999999999 112.113 -179.187 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.583 ' HE1' HD23 ' A' ' 105' ' ' LEU . 49.5 mtm -50.64 -41.23 55.02 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.524 0.202 . . . . 20.93 111.429 -179.278 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 88.9 mt -62.85 -32.59 56.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.928 0.394 . . . . 25.129999999999999 110.546 179.36 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 95.8 m-20 -71.46 -38.27 71.29 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.007 -0.542 . . . . 23.32 110.828 179.501 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.489 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 2.3 mt -74.66 -25.94 59.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.191 -0.459 . . . . 21.07 110.936 -179.708 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 98.23 46.87 2.12 Favored Glycine 0 N--CA 1.453 -0.23 0 C-N-CA 120.887 -0.673 . . . . 23.050000000000001 112.433 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -100.26 -27.02 13.71 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.523 0.201 . . . . 22.59 111.359 -179.684 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 13.4 mmmm 52.3 85.97 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.327 -0.397 . . . . 27.960000000000001 110.809 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 116' ' ' VAL . . . . . 0.457 HG21 ' SD ' ' A' ' 109' ' ' MET . 2.8 m -129.44 155.38 41.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.122 -0.49 . . . . 24.75 111.824 -179.514 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 59.2 p -95.87 146.71 24.35 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.798 -0.637 . . . . 27.239999999999998 109.864 178.608 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -55.54 -15.85 3.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.476 -0.329 . . . . 26.629999999999999 111.618 -179.453 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -79.21 -55.22 5.26 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.498 -0.319 . . . . 29.140000000000001 111.612 -179.573 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 120' ' ' GLU . . . . . 0.413 ' OE1' HG12 ' A' ' 116' ' ' VAL . 13.3 pt-20 -62.03 -37.34 84.54 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 111.824 0.305 . . . . 24.190000000000001 111.824 -179.347 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.549 ' HB ' HD23 ' A' ' 105' ' ' LEU . 33.3 pt -74.89 -38.19 43.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 N-CA-C 111.887 0.329 . . . . 22.329999999999998 111.887 -179.06 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 122' ' ' ASP . . . . . 0.504 ' N ' HG13 ' A' ' 121' ' ' ILE . 18.0 t70 -62.33 -43.94 97.66 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.872 0.367 . . . . 24.289999999999999 110.561 179.753 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -62.55 -43.03 99.83 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.03 -0.532 . . . . 24.739999999999998 110.565 179.631 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 45.4 ttp -56.41 -36.95 69.51 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.063 -0.517 . . . . 19.710000000000001 110.651 179.389 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.644 HG23 HD11 ' A' ' 136' ' ' ILE . 71.9 mt -65.24 -43.05 95.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.045 -0.525 . . . . 19.949999999999999 110.514 179.751 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 69.9 ttt180 -59.4 -37.92 79.25 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.815 -0.63 . . . . 24.949999999999999 111.046 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -70.92 -24.48 62.47 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.202 -0.454 . . . . 18.690000000000001 111.315 -179.635 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.577 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -98.94 -12.77 20.37 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.309 -0.405 . . . . 16.469999999999999 111.272 -179.831 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 62.1 t0 -103.32 96.45 6.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.204 -0.453 . . . . 20.399999999999999 110.935 -179.553 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -66.38 -54.05 28.88 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.896 -0.593 . . . . 21.43 111.128 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -61.14 -19.3 61.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.153 -0.476 . . . . 23.370000000000001 111.042 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 52.16 77.38 0.14 Allowed Glycine 0 N--CA 1.453 -0.186 0 C-N-CA 120.904 -0.665 . . . . 24.32 112.753 179.718 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -128.75 -0.3 5.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.825 0.345 . . . . 23.879999999999999 110.667 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 80.74 19.66 67.56 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.9 -0.667 . . . . 22.670000000000002 112.617 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 38.2 mtp -139.33 149.33 44.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.65 0.262 . . . . 22.91 110.419 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.723 HG23 ' HB2' ' A' ' 140' ' ' GLU . 47.4 mm -116.62 142.3 30.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 121.254 0.549 . . . . 18.41 111.95 -179.408 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 137' ' ' ASN . . . . . 0.423 ' O ' ' N ' ' A' ' 139' ' ' GLU . 1.3 p30 -114.94 158.75 21.58 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.159 -0.928 . . . . 16.82 109.239 178.647 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.699 ' O ' HG23 ' A' ' 142' ' ' VAL . 11.8 t80 -37.72 -27.56 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 112.481 0.549 . . . . 14.65 112.481 -179.067 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 139' ' ' GLU . . . . . 0.423 ' N ' ' O ' ' A' ' 137' ' ' ASN . 43.3 mt-10 -80.54 -55.73 4.66 Favored 'General case' 0 C--N 1.328 -0.327 0 O-C-N 122.155 -0.34 . . . . 14.82 111.236 -179.328 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.723 ' HB2' HG23 ' A' ' 136' ' ' ILE . 71.4 mt-10 -59.15 -29.76 67.66 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.228 -0.442 . . . . 17.460000000000001 110.504 179.819 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.536 ' CE2' HD13 ' A' ' 145' ' ' ILE . 78.7 t80 -70.23 -55.61 8.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.821 -0.627 . . . . 12.93 110.575 179.715 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.699 HG23 ' O ' ' A' ' 138' ' ' TYR . 53.7 t -48.25 -35.86 5.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 115.917 -0.583 . . . . 10.699999999999999 111.972 179.728 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 143' ' ' TRP . . . . . 0.487 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 91.4 t90 -72.23 -56.06 6.16 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.469 0.544 . . . . 13.66 112.469 -179.018 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 144' ' ' MET . . . . . 0.694 ' HE2' HG21 ' A' ' 136' ' ' ILE . 18.2 ptt? -61.35 -25.76 67.37 Favored 'General case' 0 N--CA 1.464 0.244 0 N-CA-C 112.93 0.715 . . . . 14.5 112.93 -177.993 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 145' ' ' ILE . . . . . 0.561 HD11 ' HB3' ' A' ' 85' ' ' MET . 45.6 pt -80.48 -40.78 19.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 112.022 0.378 . . . . 11.25 112.022 -179.559 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 146' ' ' SER . . . . . 0.546 ' N ' HG13 ' A' ' 145' ' ' ILE . 22.6 t -59.7 -14.49 14.34 Favored 'General case' 0 CA--C 1.519 -0.25 0 CA-C-O 121.45 0.643 . . . . 8.5399999999999991 109.841 -179.804 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 147' ' ' GLN . . . . . 0.487 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 0.7 OUTLIER -114.63 -15.54 11.95 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.887 -1.051 . . . . 11.869999999999999 110.242 -179.579 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.312 -0.851 . . . . 13.68 110.904 179.822 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.552 HD13 ' SG ' ' A' ' 69' ' ' CYS . 31.3 mt . . . . . 0 CA--C 1.528 0.101 0 CA-C-O 120.792 0.33 . . . . 1.27 110.925 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 76.3 p -70.34 -167.84 0.2 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.259 -0.428 . . . . 1.1200000000000001 111.057 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.426 ' HG3' ' N ' ' A' ' 7' ' ' GLU . 10.0 pt-20 -72.64 -40.46 66.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.908 0.385 . . . . 2.2000000000000002 110.505 -179.91 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.426 ' N ' ' HG3' ' A' ' 6' ' ' GLU . 9.4 pt-20 -74.18 -39.05 63.46 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.936 -0.574 . . . . 1.3500000000000001 110.515 179.733 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -65.13 -48.99 71.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.905 -0.588 . . . . 2.2200000000000002 110.64 179.721 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.53 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 61.9 mt -55.8 -50.59 67.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.389 -0.369 . . . . 0.54000000000000004 110.705 179.829 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.61 -23.11 66.13 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.163 -0.472 . . . . 0.5 111.255 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -69.71 -56.35 7.45 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.295 -0.412 . . . . 2.27 111.828 -179.108 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.53 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 12.3 p90 -78.22 -25.47 46.99 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 120.586 -0.446 . . . . 0.37 110.879 -179.775 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.471 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 20.0 tptm -63.32 -36.23 83.02 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 108.989 -0.745 . . . . 1.23 108.989 178.484 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.463 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 15.7 t70 -68.44 -51.98 37.75 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 108.825 -0.806 . . . . 0.44 108.825 177.927 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.34 -13.81 22.31 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.399 -0.819 . . . . 0.28999999999999998 110.568 179.069 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.471 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 55.0 t80 -79.43 -51.45 9.35 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.886 -0.597 . . . . 0.47999999999999998 110.597 -179.697 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.442 HG22 ' O ' ' A' ' 14' ' ' ASP . 26.9 m -65.36 -18.92 24.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 121.003 0.43 . . . . 1.1100000000000001 110.294 179.913 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.463 ' HG2' ' O ' ' A' ' 14' ' ' ASP . 29.2 mm-40 -63.2 -29.62 70.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.648 -0.705 . . . . 1.6000000000000001 111.719 179.483 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -105.87 27.1 8.85 Favored 'General case' 0 N--CA 1.463 0.217 0 N-CA-C 112.04 0.385 . . . . 0.64000000000000001 112.04 -179.185 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -113.94 86.74 2.47 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.988 0.423 . . . . 0.44 110.589 179.217 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.546 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -94.85 -38.01 10.94 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.917 -0.583 . . . . 2.1000000000000001 111.438 -179.599 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -56.8 -24.59 51.73 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.307 -0.406 . . . . 1.8 111.477 -179.583 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 87.28 1.92 83.56 Favored Glycine 0 C--N 1.33 0.209 0 C-N-CA 120.793 -0.717 . . . . 0.46000000000000002 112.88 179.62 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 26.8 p -82.35 16.07 2.2 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.688 0.28 . . . . 0.40000000000000002 111.195 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 54.93 25.55 38.17 Favored Glycine 0 C--N 1.331 0.299 0 C-N-CA 120.721 -0.752 . . . . 0.33000000000000002 111.766 -179.539 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.428 ' HD3' ' OD1' ' A' ' 64' ' ' ASN . 35.4 mtmm -132.38 156.61 46.34 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.842 0.353 . . . . 1.1000000000000001 111.067 -179.382 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.711 HG13 ' HB2' ' A' ' 63' ' ' LEU . 31.1 pt -114.33 124.94 71.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 121.001 0.429 . . . . 0.5 111.341 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -51.2 141.19 15.05 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.063 -0.517 . . . . 0.29999999999999999 111.416 179.736 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 8.3 t -65.91 -11.84 50.13 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.94 -0.573 . . . . 1.03 111.313 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.459 ' HD2' ' N ' ' A' ' 30' ' ' ARG . 2.5 mpt_? -90.76 5.25 49.05 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.971 0.415 . . . . 3.0800000000000001 110.492 179.777 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -120.86 -9.43 9.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.923 -0.58 . . . . 2.2599999999999998 110.788 -179.789 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.521 HD22 HD11 ' A' ' 51' ' ' LEU . 7.9 tt -53.25 -52.46 58.92 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.317 -0.401 . . . . 1.3700000000000001 110.747 179.671 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.482 ' HA2' HD11 ' A' ' 48' ' ' LEU . . . -54.3 -48.01 65.97 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.427 -0.892 . . . . 0.32000000000000001 111.602 179.551 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 30.2 m -58.3 -29.25 65.71 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 121.423 0.63 . . . . 0.31 109.643 178.688 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.475 ' O ' HG22 ' A' ' 38' ' ' THR . 1.2 tt -72.67 -35.07 67.62 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.163 -0.926 . . . . 1.24 109.905 179.391 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.557 ' SD ' ' HG3' ' A' ' 43' ' ' PRO . 7.4 mtp -76.92 -16.9 59.23 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.976 -0.556 . . . . 1.1000000000000001 110.297 179.89 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -80.63 -41.78 23.3 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.977 -0.556 . . . . 2.6899999999999999 110.302 179.049 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.475 HG22 ' O ' ' A' ' 35' ' ' LEU . 10.4 t -67.32 -12.44 60.16 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.991 -0.55 . . . . 1.0600000000000001 110.769 179.568 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 26.4 mt -112.28 155.53 23.9 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.918 -0.583 . . . . 1.26 110.136 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -72.42 16.83 1.62 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.834 -0.698 . . . . 0.68999999999999995 113.462 -179.272 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -68.09 -63.2 1.11 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.907 0.384 . . . . 1.97 110.932 179.602 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 69.7 m-20 55.57 70.77 1.43 Allowed Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 115.936 -0.574 . . . . 2.6600000000000001 111.061 -179.707 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.557 ' HG3' ' SD ' ' A' ' 36' ' ' MET . 57.5 Cg_endo -67.97 -167.78 0.18 Allowed 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.87 2.38 . . . . 0.51000000000000001 112.307 179.645 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 41.1 m -100.17 144.23 29.44 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.036 -0.529 . . . . 0.72999999999999998 110.489 179.45 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -48.99 -55.14 12.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.742 0.306 . . . . 2.7000000000000002 111.364 -179.442 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -54.49 -48.24 72.09 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.204 -0.453 . . . . 0.46000000000000002 111.622 -179.646 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.452 ' HG2' HD23 ' A' ' 51' ' ' LEU . 37.8 tt0 -56.4 -47.29 79.27 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.813 0.339 . . . . 2.23 110.651 -179.778 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.482 HD11 ' HA2' ' A' ' 33' ' ' GLY . 13.9 tp -58.83 -41.88 87.92 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.936 -0.575 . . . . 1.3600000000000001 111.112 -179.764 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 82.8 mm-40 -71.12 -31.76 68.15 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.249 -0.432 . . . . 1.22 111.759 -179.384 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.465 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 28.8 m-20 -74.07 -55.88 5.58 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 111.919 0.34 . . . . 0.62 111.919 -179.199 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.521 HD11 HD22 ' A' ' 32' ' ' LEU . 3.1 pp -59.51 -37.29 77.93 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.696 -0.229 . . . . 0.39000000000000001 111.285 -179.314 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 76.8 mt -69.35 -35.39 67.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.754 0.312 . . . . 0.5 110.556 179.539 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.68 -36.55 81.19 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.301 -0.409 . . . . 0.58999999999999997 110.756 179.45 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.465 ' HG2' ' O ' ' A' ' 50' ' ' ASP . 3.3 mm-40 -73.23 -50.38 22.72 Favored 'General case' 0 CA--C 1.516 -0.365 0 N-CA-C 109.623 -0.51 . . . . 2.54 109.623 179.178 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -63.12 -14.36 47.66 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.551 -0.749 . . . . 0.53000000000000003 110.975 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -57.47 -37.26 72.6 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.975 -0.557 . . . . 1.95 111.61 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 6.8 p30 -127.09 -36.95 2.12 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.597 -0.274 . . . . 2.48 111.563 -179.416 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 46.3 m-80 -62.0 -15.53 44.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.557 -0.292 . . . . 2.48 111.37 -179.777 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ASN . . . . . 0.407 ' C ' ' H ' ' A' ' 61' ' ' GLY . 14.4 m120 -123.24 1.28 9.09 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.436 -0.347 . . . . 2.0499999999999998 110.972 179.861 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 69.5 m-20 73.24 -31.24 0.22 Allowed 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.99 -0.55 . . . . 1.47 111.766 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' GLY . . . . . 0.407 ' H ' ' C ' ' A' ' 59' ' ' ASN . . . 140.5 15.5 0.49 Allowed Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.553 -0.832 . . . . 0.42999999999999999 112.738 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 8.8 mm-40 -138.66 151.49 47.24 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.077 0.465 . . . . 0.38 111.195 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.711 ' HB2' HG13 ' A' ' 27' ' ' ILE . 6.3 mp -119.12 150.02 40.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.627 -0.715 . . . . 1.4299999999999999 110.685 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ASN . . . . . 0.446 ' H ' ' HB2' ' A' ' 67' ' ' GLU . 50.0 m-80 -113.94 157.67 22.12 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.961 -0.385 . . . . 1.1899999999999999 109.961 178.876 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.544 ' O ' ' HB2' ' A' ' 69' ' ' CYS . 85.3 t80 -43.68 -35.32 1.76 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.881 0.372 . . . . 0.40000000000000002 110.411 179.147 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -77.08 -37.84 53.64 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.994 -0.548 . . . . 0.81000000000000005 111.748 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.446 ' HB2' ' H ' ' A' ' 64' ' ' ASN . 10.2 mm-40 -59.64 -49.4 77.88 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.144 0.497 . . . . 1.3600000000000001 110.016 179.486 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.487 ' HE2' ' HB2' ' A' ' 12' ' ' PHE . 28.5 t80 -69.08 -52.85 24.2 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.548 -0.751 . . . . 0.51000000000000001 111.087 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.552 ' SG ' HD13 ' A' ' 4' ' ' LEU . 1.4 t -52.44 -45.02 65.82 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 121.002 0.43 . . . . 0.75 110.311 179.788 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' GLY . . . . . 0.422 ' O ' ' HB3' ' A' ' 73' ' ' ALA . . . -54.26 -50.85 54.46 Favored Glycine 0 N--CA 1.451 -0.32 0 CA-C-N 115.644 -0.707 . . . . 0.40999999999999998 112.046 179.766 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.454 HG23 ' HE3' ' A' ' 74' ' ' LYS . 11.7 mt -62.54 -40.57 88.72 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.375 0 CA-C-O 120.973 0.416 . . . . 0.51000000000000001 110.523 179.296 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 3.6 mtp -58.92 -22.72 60.29 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.784 -0.644 . . . . 1.01 109.998 179.43 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.422 ' HB3' ' O ' ' A' ' 70' ' ' GLY . . . -74.89 -52.23 11.82 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.03 -0.532 . . . . 0.69999999999999996 109.969 178.964 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.454 ' HE3' HG23 ' A' ' 71' ' ' ILE . 61.2 pttt -67.05 -24.25 65.97 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 121.08 0.467 . . . . 1.3799999999999999 110.07 179.164 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 52.8 tt0 -78.08 -49.72 13.41 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.756 -0.657 . . . . 1.98 110.593 178.984 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' MET . . . . . 0.469 ' SD ' HD23 ' A' ' 4' ' ' LEU . 38.9 mtt . . . . . 0 N--CA 1.449 -0.497 0 CA-C-N 115.82 -0.627 . . . . 1.2 110.84 179.744 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.596 ' O ' ' HG2' ' A' ' 85' ' ' MET . 91.9 m . . . . . 0 N--CA 1.46 0.07 0 CA-C-O 120.825 0.345 . . . . 7.29 110.477 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.435 ' HB3' ' OH ' ' A' ' 138' ' ' TYR . 32.3 mt-10 -59.27 -14.88 12.68 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 113.034 0.753 . . . . 9.7400000000000002 113.034 -178.507 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -64.61 -56.71 12.14 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 120.821 0.344 . . . . 12.109999999999999 111.66 -179.259 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -67.43 -16.55 64.29 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.134 0.492 . . . . 10.869999999999999 110.381 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' MET . . . . . 0.596 ' HG2' ' O ' ' A' ' 81' ' ' THR . 7.1 mmm -80.36 -34.96 36.09 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.646 -0.706 . . . . 11.09 109.768 -179.702 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 17.8 ttm180 -65.82 -42.6 90.42 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.643 -0.708 . . . . 15.52 109.512 179.039 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.425 ' HA ' ' HE3' ' A' ' 90' ' ' LYS . 1.9 tm-20 -59.87 -47.43 85.77 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 109.272 -0.64 . . . . 14.85 109.272 178.62 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.79 -26.08 68.19 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.59 -0.732 . . . . 14.109999999999999 110.553 179.155 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -69.77 -38.22 76.65 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.203 -0.453 . . . . 15.73 110.229 179.481 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' LYS . . . . . 0.425 ' HE3' ' HA ' ' A' ' 87' ' ' GLU . 9.6 mtmp? -63.09 -48.79 77.09 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.929 -0.578 . . . . 17.66 110.416 179.57 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 84.1 mt -61.21 -46.25 96.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.179 -0.464 . . . . 18.149999999999999 110.882 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.671 ' HA ' HG21 ' A' ' 108' ' ' VAL . 0.9 OUTLIER -60.43 -39.91 89.16 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.147 -0.478 . . . . 18.34 111.132 -179.871 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 36.7 t0 -72.83 95.54 1.95 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.943 0.401 . . . . 19.289999999999999 110.0 179.425 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.444 ' HG3' ' HA ' ' A' ' 104' ' ' GLU . 0.6 OUTLIER -56.75 -16.25 6.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.754 -0.657 . . . . 22.25 111.177 -179.366 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.447 ' HB2' ' OD1' ' A' ' 97' ' ' ASP . 24.2 m-20 -118.14 169.43 9.69 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.94 0.4 . . . . 23.34 110.859 179.73 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.27 5.4 57.45 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.869 -0.681 . . . . 22.0 112.342 179.594 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.447 ' OD1' ' HB2' ' A' ' 95' ' ' ASP . 5.7 p-10 -62.0 -41.69 98.33 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.716 0.293 . . . . 22.280000000000001 111.147 -179.758 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 117.69 10.94 8.9 Favored Glycine 0 C--N 1.332 0.335 0 C-N-CA 120.717 -0.754 . . . . 19.93 112.767 179.783 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -137.87 150.84 47.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.786 0.327 . . . . 20.300000000000001 110.948 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 46.6 mt -114.81 139.44 40.97 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.141 0 CA-C-N 116.253 -0.43 . . . . 19.370000000000001 111.315 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 74.2 m -114.53 156.24 44.9 Favored Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 115.894 -0.594 . . . . 22.489999999999998 110.045 179.512 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_exo -44.16 -36.3 8.71 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.304 2.003 . . . . 23.0 112.846 -179.43 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.63 -39.72 88.41 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.223 0.535 . . . . 24.559999999999999 110.884 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' GLU . . . . . 0.491 ' O ' HG23 ' A' ' 108' ' ' VAL . 42.1 mt-10 -74.51 -44.65 50.31 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.409 -0.814 . . . . 22.23 110.202 -179.847 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.501 HD23 ' HE1' ' A' ' 109' ' ' MET . 2.8 tp -54.32 -51.66 63.98 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.232 -0.894 . . . . 20.359999999999999 110.246 179.733 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.443 ' HA ' ' HE3' ' A' ' 109' ' ' MET . 10.7 ttt85 -57.07 -55.24 37.32 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.337 -0.847 . . . . 27.190000000000001 111.633 -179.749 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 36.0 t80 -46.11 -44.35 15.6 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.102 -0.499 . . . . 25.359999999999999 112.32 -178.753 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.671 HG21 ' HA ' ' A' ' 92' ' ' PHE . 23.0 t -69.62 -54.55 18.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 N-CA-C 112.235 0.457 . . . . 21.059999999999999 112.235 -178.706 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.501 ' HE1' HD23 ' A' ' 105' ' ' LEU . 62.3 mtm -52.51 -37.38 57.31 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 120.886 0.374 . . . . 20.93 110.531 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 72.5 mt -64.88 -36.47 77.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.987 -0.552 . . . . 25.129999999999999 110.162 178.932 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 91.3 m-20 -67.31 -34.92 78.39 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.844 -0.616 . . . . 23.32 110.504 179.448 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 69.5 mt -72.0 -40.83 68.24 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.875 -0.602 . . . . 21.07 110.825 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 129.51 -3.48 6.18 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.759 -0.734 . . . . 23.050000000000001 112.557 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -86.94 93.92 9.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.679 0.276 . . . . 22.59 110.984 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -64.7 119.34 10.38 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.274 -0.421 . . . . 27.960000000000001 110.635 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 4.8 m -137.89 154.9 29.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.992 -0.549 . . . . 24.75 111.398 -179.638 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 71.3 p -98.12 147.37 24.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.804 -0.634 . . . . 27.239999999999998 110.576 179.463 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 118' ' ' ASP . . . . . 0.427 ' HA ' HG12 ' A' ' 121' ' ' ILE . 21.3 m-20 -53.7 -21.42 7.04 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.23 -0.441 . . . . 26.629999999999999 111.065 -179.908 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -80.5 -50.41 10.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.257 -0.429 . . . . 29.140000000000001 111.106 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.3 -33.62 75.91 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.265 -0.425 . . . . 24.190000000000001 111.121 -179.483 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.453 HG13 ' N ' ' A' ' 122' ' ' ASP . 32.6 pt -79.17 -35.08 16.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.399 -0.364 . . . . 22.329999999999998 110.946 -179.892 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 122' ' ' ASP . . . . . 0.453 ' N ' HG13 ' A' ' 121' ' ' ILE . 14.8 t70 -62.13 -32.0 72.54 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.041 0.448 . . . . 24.289999999999999 109.827 179.307 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -72.79 -47.08 49.61 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.763 -0.653 . . . . 24.739999999999998 110.203 179.278 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 49.3 ttp -55.62 -40.13 71.7 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.977 -0.556 . . . . 19.710000000000001 110.526 179.375 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.494 HD11 HD22 ' A' ' 105' ' ' LEU . 85.7 mt -65.89 -41.85 90.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.089 -0.505 . . . . 19.949999999999999 110.27 179.33 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 56.1 ttt180 -59.76 -31.96 70.14 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.697 -0.683 . . . . 24.949999999999999 110.826 179.585 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -77.79 -28.18 50.39 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.142 -0.481 . . . . 18.690000000000001 111.101 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.639 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -92.7 -14.13 28.44 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.17 -0.468 . . . . 16.469999999999999 111.029 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 129' ' ' ASP . . . . . 0.447 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 30.0 t70 -100.86 106.64 18.03 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.045 -0.525 . . . . 20.399999999999999 110.613 -179.798 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 74.1 m-85 -93.4 -41.83 9.61 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.739 -0.664 . . . . 21.43 111.499 -179.351 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -56.19 -26.17 49.82 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.417 -0.356 . . . . 23.370000000000001 111.021 -179.76 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 76.26 62.85 2.5 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.879 -0.677 . . . . 24.32 112.432 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 133' ' ' ASP . . . . . 0.4 ' OD2' ' HB2' ' A' ' 135' ' ' MET . 3.3 p-10 -130.35 -0.73 4.51 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.69 0.281 . . . . 23.879999999999999 111.258 -179.697 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 66.98 18.2 68.54 Favored Glycine 0 C--N 1.33 0.245 0 C-N-CA 120.814 -0.708 . . . . 22.670000000000002 112.731 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 135' ' ' MET . . . . . 0.4 ' HB2' ' OD2' ' A' ' 133' ' ' ASP . 68.4 mtp -134.3 155.36 50.35 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 110.183 -0.303 . . . . 22.91 110.183 179.857 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.696 HG23 ' HB2' ' A' ' 140' ' ' GLU . 47.5 mm -114.12 145.59 19.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 121.497 0.665 . . . . 18.41 112.119 -179.089 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 137' ' ' ASN . . . . . 0.428 ' O ' ' N ' ' A' ' 139' ' ' GLU . 26.9 t-20 -118.64 158.41 25.53 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 114.901 -1.045 . . . . 16.82 108.922 178.508 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.576 ' O ' HG23 ' A' ' 142' ' ' VAL . 8.2 t80 -38.72 -26.6 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 112.009 0.374 . . . . 14.65 112.009 -179.664 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 139' ' ' GLU . . . . . 0.428 ' N ' ' O ' ' A' ' 137' ' ' ASN . 45.4 mt-10 -80.68 -55.85 4.55 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.774 0.321 . . . . 14.82 111.097 -179.546 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.696 ' HB2' HG23 ' A' ' 136' ' ' ILE . 27.5 mt-10 -60.87 -24.41 65.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.164 0.507 . . . . 17.460000000000001 110.214 179.712 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.594 ' HA ' ' HE2' ' A' ' 144' ' ' MET . 86.6 t80 -74.0 -55.56 5.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.556 -0.747 . . . . 12.93 110.527 179.857 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.576 HG23 ' O ' ' A' ' 138' ' ' TYR . 42.9 t -48.63 -37.0 7.9 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 CA-C-N 115.9 -0.591 . . . . 10.699999999999999 111.417 179.499 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 76.8 t90 -70.57 -55.0 9.87 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.265 0.469 . . . . 13.66 112.265 -179.165 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 144' ' ' MET . . . . . 0.639 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 24.6 ptt? -65.13 -22.22 66.9 Favored 'General case' 0 N--CA 1.464 0.274 0 N-CA-C 113.339 0.866 . . . . 14.5 113.339 -177.611 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 145' ' ' ILE . . . . . 0.642 ' HA ' ' HB2' ' A' ' 148' ' ' LYS . 39.6 pt -80.55 -44.6 21.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 C-N-CA 120.751 -0.38 . . . . 11.25 111.833 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 146' ' ' SER . . . . . 0.538 ' N ' HG13 ' A' ' 145' ' ' ILE . 78.7 p -64.29 -14.19 54.41 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-O 121.448 0.642 . . . . 8.5399999999999991 109.59 179.629 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 8.0 mm-40 -125.35 19.93 8.11 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 114.967 -1.015 . . . . 11.869999999999999 110.245 -179.417 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 148' ' ' LYS . . . . . 0.642 ' HB2' ' HA ' ' A' ' 145' ' ' ILE . 16.5 ttpp . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.267 -0.873 . . . . 13.68 111.069 -179.451 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 65.2 mt . . . . . 0 CA--C 1.528 0.129 0 CA-C-O 120.767 0.318 . . . . 1.27 110.898 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.402 HG21 ' HB3' ' A' ' 147' ' ' GLN . 67.6 p -87.01 -165.55 1.32 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.242 -0.435 . . . . 1.1200000000000001 111.15 -179.92 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -73.78 -39.78 63.92 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.991 0.424 . . . . 2.2000000000000002 110.762 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -74.46 -41.13 61.32 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.827 -0.624 . . . . 1.3500000000000001 110.813 -179.665 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 -63.74 -49.39 73.2 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.164 -0.471 . . . . 2.2200000000000002 110.79 179.858 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.538 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 63.8 mt -55.95 -52.44 49.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.445 -0.343 . . . . 0.54000000000000004 110.882 179.76 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.86 -21.54 66.82 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.38 -0.373 . . . . 0.5 111.371 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -71.23 -56.75 5.41 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 116.441 -0.345 . . . . 2.27 111.923 -179.181 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.538 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 17.9 p90 -78.51 -26.11 45.81 Favored 'General case' 0 C--N 1.332 -0.154 0 C-N-CA 120.579 -0.448 . . . . 0.37 110.931 -179.666 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 49.9 tptt -66.15 -34.95 79.22 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.348 -0.612 . . . . 1.23 109.348 178.769 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.449 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 24.8 t70 -68.83 -50.94 45.84 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.349 -0.612 . . . . 0.44 109.349 178.489 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.58 -14.3 57.1 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.823 -0.626 . . . . 0.28999999999999998 110.445 178.925 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -80.09 -44.38 20.1 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.816 -0.629 . . . . 0.47999999999999998 111.016 -179.442 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.417 HG22 ' O ' ' A' ' 14' ' ' ASP . 34.2 m -73.45 -22.75 19.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.336 -0.393 . . . . 1.1100000000000001 111.021 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.449 ' HG2' ' O ' ' A' ' 14' ' ' ASP . 82.5 mm-40 -63.21 -34.16 77.05 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.137 -0.483 . . . . 1.6000000000000001 111.201 179.74 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 46.9 m-85 -86.95 -13.38 44.79 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.473 -0.331 . . . . 0.64000000000000001 111.579 -179.701 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -90.35 87.62 6.88 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.832 0.349 . . . . 0.44 110.596 179.777 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 70.4 mmtt -95.0 -19.78 19.91 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.078 -0.51 . . . . 2.1000000000000001 111.292 -179.605 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -78.59 -42.29 29.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.252 -0.431 . . . . 1.8 111.204 -179.669 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.95 3.94 29.77 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.649 -0.786 . . . . 0.46000000000000002 112.735 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 49.4 p -73.06 1.09 9.69 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.628 0.251 . . . . 0.40000000000000002 111.216 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 61.6 23.73 63.24 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.503 -0.856 . . . . 0.33000000000000002 111.679 -179.369 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.661 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 28.9 mtpt -133.83 155.76 49.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.817 0.341 . . . . 1.1000000000000001 111.065 -179.748 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.56 HG13 ' HB3' ' A' ' 63' ' ' LEU . 23.3 pt -117.41 131.77 69.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.108 -0.496 . . . . 0.5 111.714 -179.257 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -54.97 130.46 41.63 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.27 -0.423 . . . . 0.29999999999999999 110.974 179.599 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 81.5 p -62.68 -22.46 66.49 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.154 -0.475 . . . . 1.03 111.13 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 52.6 mtp180 -73.25 -18.03 61.27 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.087 -0.506 . . . . 3.0800000000000001 110.41 179.668 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -102.6 0.85 33.95 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.75 -0.659 . . . . 2.2599999999999998 110.595 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.488 HD23 HD22 ' A' ' 63' ' ' LEU . 0.5 OUTLIER -60.07 -52.44 65.36 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.939 -0.573 . . . . 1.3700000000000001 110.646 -179.818 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -54.12 -39.54 64.04 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.628 -0.796 . . . . 0.32000000000000001 111.799 179.542 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.408 ' O ' HG22 ' A' ' 38' ' ' THR . 60.7 m -70.04 -28.11 65.21 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.021 0.439 . . . . 0.31 110.559 179.462 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 52.4 tp -72.23 -34.41 68.3 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.66 -0.7 . . . . 1.24 111.526 -179.324 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.434 ' SD ' ' HG3' ' A' ' 43' ' ' PRO . 26.7 mtp -80.4 -29.02 37.73 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.439 -0.346 . . . . 1.1000000000000001 110.8 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 76.3 mtp180 -68.21 -41.86 80.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.269 -0.423 . . . . 2.6899999999999999 110.466 179.557 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.426 HG23 ' CD1' ' A' ' 39' ' ' LEU . 1.8 t -66.13 -13.07 59.54 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.153 -0.476 . . . . 1.0600000000000001 111.006 179.51 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.426 ' CD1' HG23 ' A' ' 38' ' ' THR . 10.5 mp -113.12 156.06 23.84 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.982 -0.553 . . . . 1.26 110.553 179.574 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -42.32 -33.48 1.38 Allowed Glycine 0 CA--C 1.52 0.378 0 C-N-CA 121.305 -0.474 . . . . 0.68999999999999995 113.817 -179.173 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 24.8 mp0 -52.52 143.7 15.06 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.883 0.373 . . . . 1.97 111.282 -179.544 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -133.43 72.75 74.45 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 115.886 -0.597 . . . . 2.6600000000000001 110.869 179.706 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.434 ' HG3' ' SD ' ' A' ' 36' ' ' MET . 28.0 Cg_endo -60.54 150.08 83.43 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.814 2.343 . . . . 0.51000000000000001 112.482 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.414 HG22 ' N ' ' A' ' 45' ' ' GLU . 9.3 m -78.61 159.92 27.83 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.191 -0.458 . . . . 0.72999999999999998 110.456 179.662 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.414 ' N ' HG22 ' A' ' 44' ' ' THR . 39.7 tt0 -59.52 -55.23 37.17 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.768 0.318 . . . . 2.7000000000000002 111.242 -179.741 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.0 -49.18 77.08 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.303 -0.408 . . . . 0.46000000000000002 111.459 -179.725 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.496 ' O ' HD23 ' A' ' 51' ' ' LEU . 42.2 tt0 -55.06 -43.95 74.31 Favored 'General case' 0 CA--C 1.518 -0.25 0 CA-C-N 116.322 -0.399 . . . . 2.23 110.086 -179.798 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.425 ' HA ' HD21 ' A' ' 51' ' ' LEU . 55.9 tp -56.55 -44.78 81.25 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.577 -0.738 . . . . 1.3600000000000001 110.806 179.765 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -70.59 -25.55 63.12 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.081 -0.509 . . . . 1.22 111.251 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -68.6 -51.54 41.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.539 -0.3 . . . . 0.62 111.39 179.904 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.496 HD23 ' O ' ' A' ' 47' ' ' GLU . 0.9 OUTLIER -70.64 -36.14 73.25 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.502 -0.317 . . . . 0.39000000000000001 111.363 -179.643 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.401 HD12 ' HG ' ' A' ' 48' ' ' LEU . 75.8 mt -65.68 -46.03 90.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.459 -0.337 . . . . 0.5 111.033 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.56 -34.45 78.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.393 -0.367 . . . . 0.58999999999999997 110.882 179.841 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -65.12 -47.12 78.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.136 -0.484 . . . . 2.54 110.691 179.778 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -79.0 -14.62 59.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.139 -0.482 . . . . 0.53000000000000003 111.383 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -71.33 -37.47 71.72 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.265 -0.425 . . . . 1.95 111.391 -179.556 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 30.5 p-10 -106.91 10.73 30.47 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.503 -0.317 . . . . 2.48 111.654 -179.372 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 24.0 t-20 -125.87 -11.99 6.54 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.91 0.386 . . . . 2.48 110.939 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -138.42 18.8 2.74 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.089 -0.505 . . . . 2.0499999999999998 110.599 179.764 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 21.6 m-80 64.6 -80.26 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 115.672 -0.694 . . . . 1.47 111.544 179.666 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -153.93 4.1 0.29 Allowed Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.502 -0.856 . . . . 0.42999999999999999 112.681 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.661 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 9.8 mm-40 -118.46 155.3 31.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.011 0.434 . . . . 0.38 111.271 179.88 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.658 ' HG ' ' HB2' ' A' ' 67' ' ' GLU . 2.4 tp -126.64 155.21 42.92 Favored 'General case' 0 C--O 1.223 -0.304 0 CA-C-N 115.778 -0.647 . . . . 1.4299999999999999 110.554 -179.389 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ASN . . . . . 0.477 ' OD1' ' HE3' ' A' ' 26' ' ' LYS . 0.7 OUTLIER -110.43 155.58 22.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.893 0.377 . . . . 1.1899999999999999 111.3 -179.113 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 82.0 t80 -44.93 -46.07 10.79 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.618 -0.719 . . . . 0.40000000000000002 111.424 179.869 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -64.3 -33.89 76.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.433 -0.349 . . . . 0.81000000000000005 111.926 -179.594 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.658 ' HB2' ' HG ' ' A' ' 63' ' ' LEU . 12.3 mm-40 -63.18 -55.84 21.73 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.778 0.323 . . . . 1.3600000000000001 110.446 179.901 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.466 ' HE2' ' HB2' ' A' ' 12' ' ' PHE . 41.6 t80 -59.93 -49.36 77.99 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.262 -0.426 . . . . 0.51000000000000001 110.337 179.142 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 1.7 t -53.22 -45.25 68.61 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.131 -0.486 . . . . 0.75 110.305 179.548 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -51.5 -47.14 52.24 Favored Glycine 0 N--CA 1.448 -0.512 0 N-CA-C 111.103 -0.799 . . . . 0.40999999999999998 111.103 179.135 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.528 HG23 ' HE3' ' A' ' 74' ' ' LYS . 14.1 mt -63.96 -40.99 91.05 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.45 0 CA-C-O 120.851 0.358 . . . . 0.51000000000000001 110.664 179.104 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' MET . . . . . 0.431 ' HG2' ' O ' ' A' ' 68' ' ' PHE . 95.3 mmm -51.82 -41.76 61.99 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.986 -0.552 . . . . 1.01 109.659 179.346 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.84 -55.35 35.26 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.561 -0.745 . . . . 0.69999999999999996 110.938 179.12 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.528 ' HE3' HG23 ' A' ' 71' ' ' ILE . 21.8 pttp -64.15 -25.95 68.31 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.422 -0.354 . . . . 1.3799999999999999 111.715 -179.411 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 22.3 tp60 -81.92 -33.7 30.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.352 0.596 . . . . 1.98 110.55 -179.865 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' MET . . . . . 0.404 ' HG3' ' O ' ' A' ' 72' ' ' MET . 54.7 mtt . . . . . 0 C--N 1.325 -0.479 0 CA-C-N 115.055 -0.975 . . . . 1.2 111.053 -179.614 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.588 ' O ' ' HG2' ' A' ' 85' ' ' MET . 52.7 m . . . . . 0 N--CA 1.46 0.075 0 N-CA-C 110.374 -0.232 . . . . 7.29 110.374 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -68.44 -25.12 64.85 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 112.857 0.688 . . . . 9.7400000000000002 112.857 -178.478 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 -54.35 -55.79 25.03 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 111.957 0.354 . . . . 12.109999999999999 111.957 -178.93 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -63.97 -20.82 66.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.949 0.404 . . . . 10.869999999999999 111.065 -179.743 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' MET . . . . . 0.632 ' HB3' HD11 ' A' ' 145' ' ' ILE . 4.7 mmm -79.89 -25.67 40.54 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.07 -0.514 . . . . 11.09 110.175 -179.336 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 29.2 ttt180 -74.19 -50.09 20.72 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.517 -0.765 . . . . 15.52 109.754 179.619 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -59.86 -36.45 76.9 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.826 -0.624 . . . . 14.85 109.512 178.864 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -72.16 -35.5 69.05 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-N 115.663 -0.698 . . . . 14.109999999999999 110.897 179.249 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -67.76 -20.57 65.24 Favored 'General case' 0 CA--C 1.52 -0.183 0 CA-C-O 121.326 0.584 . . . . 15.73 110.093 179.49 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 15.6 tttt -79.91 -47.13 15.55 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 115.298 -0.865 . . . . 17.66 110.169 179.775 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 73.7 mt -64.29 -43.47 97.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.496 -0.775 . . . . 18.149999999999999 111.111 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.536 ' HD1' HG11 ' A' ' 108' ' ' VAL . 5.5 m-85 -66.82 -52.66 41.13 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.271 -0.422 . . . . 18.34 111.025 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -59.63 99.83 0.07 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.303 -0.408 . . . . 19.289999999999999 110.386 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.522 ' HG2' ' HB3' ' A' ' 104' ' ' GLU . 22.4 mmm180 -53.04 -37.2 61.37 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.859 -0.61 . . . . 22.25 111.316 -179.393 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -107.84 -176.73 3.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.9 0.381 . . . . 23.34 111.09 -179.697 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.77 4.26 56.25 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.944 -0.646 . . . . 22.0 112.631 179.754 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -63.66 -31.25 72.37 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.64 0.257 . . . . 22.280000000000001 111.29 -179.761 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 92.89 35.18 6.49 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.791 -0.718 . . . . 19.93 112.83 179.771 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' PHE . . . . . 0.425 ' HA ' ' O ' ' A' ' 136' ' ' ILE . 96.6 m-85 -147.54 142.27 26.7 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.638 0.256 . . . . 20.300000000000001 110.811 179.857 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 59.6 mt -114.35 125.83 71.74 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.162 0 CA-C-O 121.054 0.454 . . . . 19.370000000000001 110.998 179.672 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 23.5 p -114.48 156.07 45.07 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 115.793 -0.639 . . . . 22.489999999999998 110.626 -179.843 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_exo -39.95 -35.61 1.16 Allowed 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.608 2.206 . . . . 23.0 112.681 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.07 -53.43 25.63 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.254 -0.43 . . . . 24.559999999999999 110.973 179.782 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' GLU . . . . . 0.522 ' HB3' ' HG2' ' A' ' 94' ' ' ARG . 46.8 mt-10 -62.29 -38.78 90.66 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.872 -0.604 . . . . 22.23 110.55 179.87 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.54 HD23 ' HB ' ' A' ' 121' ' ' ILE . 39.9 tp -64.48 -35.6 81.47 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.541 -0.754 . . . . 20.359999999999999 110.869 -179.892 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 10.4 ttp180 -63.97 -52.53 59.25 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.343 -0.389 . . . . 27.190000000000001 110.858 179.69 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 35.7 t80 -54.27 -47.92 71.79 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.088 -0.506 . . . . 25.359999999999999 111.563 -179.407 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.536 HG11 ' HD1' ' A' ' 92' ' ' PHE . 7.7 p -70.77 -46.98 66.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 N-CA-C 112.144 0.424 . . . . 21.059999999999999 112.144 -179.14 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.516 ' N ' HG13 ' A' ' 108' ' ' VAL . 0.4 OUTLIER -57.2 -20.68 28.37 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 111.728 0.27 . . . . 20.93 111.728 -179.018 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.589 ' HA ' ' HA ' ' A' ' 114' ' ' GLU . 83.0 mt -82.67 -28.71 8.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 120.943 0.402 . . . . 25.129999999999999 110.353 178.915 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -73.87 -36.21 64.79 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.103 -0.499 . . . . 23.32 109.904 178.765 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.47 HD13 HG22 ' A' ' 108' ' ' VAL . 7.0 mp -85.85 -41.69 14.78 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.648 -0.705 . . . . 21.07 109.762 179.223 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -148.93 80.83 0.2 Allowed Glycine 0 C--N 1.33 0.235 0 CA-C-N 115.33 -0.85 . . . . 23.050000000000001 111.769 179.498 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 114' ' ' GLU . . . . . 0.589 ' HA ' ' HA ' ' A' ' 110' ' ' ILE . 0.0 OUTLIER -48.14 160.48 0.15 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.064 0.459 . . . . 22.59 112.136 -179.356 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 23.6 ttmm 70.67 62.97 0.19 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.238 -0.892 . . . . 27.960000000000001 111.858 179.488 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 116' ' ' VAL . . . . . 0.495 HG12 ' OE1' ' A' ' 120' ' ' GLU . 1.6 m -125.81 114.73 40.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.165 -0.47 . . . . 24.75 110.625 178.286 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 72.7 p -67.51 147.42 52.84 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.295 -0.411 . . . . 27.239999999999998 110.419 179.8 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 28.8 m-20 -56.3 -14.73 3.09 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.208 -0.451 . . . . 26.629999999999999 110.581 179.804 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 0.4 ' O ' ' HG2' ' A' ' 123' ' ' GLU . 12.6 mm-40 -79.7 -55.17 5.2 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.032 -0.531 . . . . 29.140000000000001 111.249 -179.876 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 120' ' ' GLU . . . . . 0.495 ' OE1' HG12 ' A' ' 116' ' ' VAL . 14.0 pt-20 -58.57 -42.56 88.25 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.748 -0.205 . . . . 24.190000000000001 111.46 -179.576 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.54 ' HB ' HD23 ' A' ' 105' ' ' LEU . 2.7 pt -68.37 -42.92 84.5 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-O 120.643 0.259 . . . . 22.329999999999998 111.144 179.487 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 122' ' ' ASP . . . . . 0.513 ' H ' HG13 ' A' ' 121' ' ' ILE . 17.8 t70 -60.24 -40.42 90.17 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.826 0.346 . . . . 24.289999999999999 110.444 179.666 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 123' ' ' GLU . . . . . 0.4 ' HG2' ' O ' ' A' ' 119' ' ' GLU . 16.5 mm-40 -58.34 -46.05 86.96 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.002 -0.545 . . . . 24.739999999999998 110.201 179.382 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.42 ' HE1' HD11 ' A' ' 105' ' ' LEU . 58.9 ttp -55.54 -37.17 67.62 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.214 -0.448 . . . . 19.710000000000001 110.328 179.195 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.5 HG23 HD11 ' A' ' 136' ' ' ILE . 78.6 mt -65.92 -42.38 91.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.049 -0.523 . . . . 19.949999999999999 110.337 179.341 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 21.4 tpp180 -63.43 -25.26 68.19 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.806 -0.634 . . . . 24.949999999999999 111.042 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -78.53 -30.02 46.81 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.229 -0.441 . . . . 18.690000000000001 111.308 -179.535 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.709 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -99.73 -12.39 20.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.309 -0.405 . . . . 16.469999999999999 111.479 -179.689 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 129' ' ' ASP . . . . . 0.457 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 25.4 t0 -100.68 104.03 15.31 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.977 0.418 . . . . 20.399999999999999 110.906 -179.615 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 88.1 m-85 -82.79 -39.46 21.74 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.962 -0.563 . . . . 21.43 111.174 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -69.07 -13.35 62.39 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.381 -0.372 . . . . 23.370000000000001 111.007 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 47.63 82.38 0.03 OUTLIER Glycine 0 C--N 1.331 0.256 0 C-N-CA 121.19 -0.528 . . . . 24.32 113.212 179.629 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -133.22 -24.49 1.84 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.846 0.355 . . . . 23.879999999999999 110.617 179.579 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 105.84 10.62 30.16 Favored Glycine 0 C--N 1.332 0.321 0 C-N-CA 120.794 -0.717 . . . . 22.670000000000002 112.562 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 91.1 mmm -135.37 150.42 49.92 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.805 0.336 . . . . 22.91 110.756 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.587 HG23 ' HB2' ' A' ' 140' ' ' GLU . 46.9 mm -114.83 141.17 32.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.037 0.446 . . . . 18.41 111.486 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 137' ' ' ASN . . . . . 0.451 ' O ' ' N ' ' A' ' 139' ' ' GLU . 29.2 p-10 -114.78 157.51 23.13 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.002 -0.74 . . . . 16.82 109.002 178.405 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.566 ' O ' HG23 ' A' ' 142' ' ' VAL . 42.4 t80 -40.59 -21.51 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 111.97 0.359 . . . . 14.65 111.97 -179.754 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 139' ' ' GLU . . . . . 0.451 ' N ' ' O ' ' A' ' 137' ' ' ASN . 44.2 mt-10 -80.76 -56.76 3.92 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.786 0.327 . . . . 14.82 111.261 -179.615 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.587 ' HB2' HG23 ' A' ' 136' ' ' ILE . 45.5 mt-10 -61.16 -29.82 70.02 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 121.0 0.429 . . . . 17.460000000000001 110.102 179.93 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.562 ' CE2' HD13 ' A' ' 145' ' ' ILE . 83.9 t80 -67.09 -55.52 13.93 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.848 -0.614 . . . . 12.93 110.186 179.403 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.566 HG23 ' O ' ' A' ' 138' ' ' TYR . 42.9 t -51.42 -30.77 11.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.667 -0.697 . . . . 10.699999999999999 111.392 179.811 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 143' ' ' TRP . . . . . 0.495 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 90.3 t90 -70.65 -55.84 7.82 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.496 0.554 . . . . 13.66 112.496 -179.122 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 144' ' ' MET . . . . . 0.709 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 18.8 ptt? -63.48 -28.79 70.2 Favored 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 113.272 0.842 . . . . 14.5 113.272 -177.771 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 145' ' ' ILE . . . . . 0.632 HD11 ' HB3' ' A' ' 85' ' ' MET . 42.8 pt -80.76 -35.9 15.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 112.383 0.512 . . . . 11.25 112.383 -179.304 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 146' ' ' SER . . . . . 0.493 ' N ' HG13 ' A' ' 145' ' ' ILE . 42.0 t -60.69 -14.12 18.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.198 0.523 . . . . 8.5399999999999991 110.432 -179.679 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 147' ' ' GLN . . . . . 0.495 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 4.0 mm-40 -101.04 -16.22 17.19 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.362 -0.835 . . . . 11.869999999999999 111.089 -179.053 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 65.1 mttm . . . . . 0 C--O 1.25 1.111 0 CA-C-O 118.296 -0.859 . . . . 13.68 110.829 179.685 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.5 mp . . . . . 0 C--O 1.232 0.149 0 CA-C-O 120.878 0.371 . . . . 1.27 110.961 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 6.8 m -90.49 158.89 16.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.034 -0.53 . . . . 1.1200000000000001 110.565 179.853 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -47.34 -42.83 22.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.709 0.29 . . . . 2.2000000000000002 111.63 -179.651 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -73.32 -41.41 63.56 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.033 0.444 . . . . 1.3500000000000001 111.005 -179.476 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 80.3 mt-30 -63.99 -40.43 96.36 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.833 -0.622 . . . . 2.2200000000000002 111.001 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.496 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 89.2 mt -62.11 -50.79 78.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.117 -0.492 . . . . 0.54000000000000004 110.628 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.41 -24.81 67.6 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.001 -0.545 . . . . 0.5 111.366 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -69.91 -56.35 7.27 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.39 -0.368 . . . . 2.27 111.939 -179.033 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.496 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 10.5 p90 -78.4 -28.07 46.81 Favored 'General case' 0 C--N 1.332 -0.155 0 C-N-CA 120.603 -0.439 . . . . 0.37 111.009 -179.532 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 21.2 tptm -62.65 -35.62 80.2 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.153 -0.684 . . . . 1.23 109.153 178.669 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.472 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 33.1 t70 -69.44 -50.12 48.66 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 115.706 -0.679 . . . . 0.44 109.179 178.315 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.27 -17.67 54.63 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.68 -0.691 . . . . 0.28999999999999998 110.574 179.058 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -77.96 -48.21 16.78 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.003 -0.544 . . . . 0.47999999999999998 110.638 -179.495 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 23.3 m -70.32 -15.85 19.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.146 -0.479 . . . . 1.1100000000000001 110.532 179.648 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.472 ' HG3' ' O ' ' A' ' 14' ' ' ASP . 73.2 mt-30 -64.01 -44.53 92.3 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.787 -0.642 . . . . 1.6000000000000001 111.111 179.326 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -90.39 31.16 1.04 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.16 -0.473 . . . . 0.64000000000000001 111.71 -179.298 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -118.96 70.96 0.84 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.001 0.429 . . . . 0.44 110.4 179.284 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 33.7 mmtp -76.5 -17.63 59.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.866 -0.606 . . . . 2.1000000000000001 111.205 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -83.05 -10.94 58.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.212 -0.449 . . . . 1.8 110.907 -179.936 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 65.44 14.3 59.72 Favored Glycine 0 C--N 1.33 0.236 0 C-N-CA 120.869 -0.681 . . . . 0.46000000000000002 112.648 179.874 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 30.0 p -83.74 11.86 6.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.671 0.272 . . . . 0.40000000000000002 111.205 -179.929 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 56.22 18.88 22.3 Favored Glycine 0 C--N 1.332 0.361 0 C-N-CA 120.709 -0.758 . . . . 0.33000000000000002 111.596 -179.383 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.633 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 51.7 mtpt -135.43 155.26 50.84 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.501 -0.35 . . . . 1.1000000000000001 110.334 -179.488 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.401 ' O ' ' HG ' ' A' ' 63' ' ' LEU . 42.4 pt -120.9 140.65 44.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.871 0.367 . . . . 0.5 111.286 -179.799 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -57.97 135.95 57.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.153 -0.476 . . . . 0.29999999999999999 110.612 179.651 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.418 ' HA ' HD23 ' A' ' 63' ' ' LEU . 5.7 t -64.69 -8.56 15.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.19 -0.459 . . . . 1.03 110.994 179.808 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 43.5 mtt180 -89.76 -11.21 42.89 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.043 -0.526 . . . . 3.0800000000000001 110.851 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -107.57 -4.58 18.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.92 -0.582 . . . . 2.2599999999999998 110.908 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.647 HD23 HD21 ' A' ' 63' ' ' LEU . 1.4 tm? -57.72 -51.0 71.32 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.355 -0.384 . . . . 1.3700000000000001 110.311 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -53.59 -42.71 67.25 Favored Glycine 0 C--N 1.332 0.344 0 C-N-CA 120.617 -0.801 . . . . 0.32000000000000001 111.692 179.438 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 94.9 m -63.88 -36.07 82.73 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.226 0.536 . . . . 0.31 109.868 179.038 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 38.8 tp -65.94 -24.05 66.74 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.369 -0.832 . . . . 1.24 110.773 -179.921 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.462 ' HG2' ' O ' ' A' ' 32' ' ' LEU . 79.9 mmm -80.36 -37.87 31.53 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.252 -0.431 . . . . 1.1000000000000001 110.19 179.346 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 69.6 mtp180 -59.64 -44.34 93.53 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.942 -0.572 . . . . 2.6899999999999999 110.964 179.89 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.426 HG23 HD13 ' A' ' 39' ' ' LEU . 1.3 t -64.23 -13.52 49.61 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.235 -0.439 . . . . 1.0600000000000001 111.321 179.835 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.426 HD13 HG23 ' A' ' 38' ' ' THR . 10.8 mp -113.75 156.14 24.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.115 -0.493 . . . . 1.26 110.412 179.365 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -58.35 -5.69 2.67 Favored Glycine 0 CA--C 1.518 0.255 0 CA-C-N 116.014 -0.539 . . . . 0.68999999999999995 113.759 -178.997 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 15.9 mp0 -88.29 130.91 34.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 117.107 0.453 . . . . 1.97 110.972 179.746 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -131.88 87.05 46.06 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.092 -0.503 . . . . 2.6600000000000001 110.775 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -70.47 151.37 64.98 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 122.511 2.141 . . . . 0.51000000000000001 112.275 -179.839 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 27.4 m -64.35 150.06 46.99 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.22 -0.445 . . . . 0.72999999999999998 110.738 179.746 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -48.07 -54.51 12.86 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.562 -0.29 . . . . 2.7000000000000002 111.336 -179.631 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.57 -53.27 54.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.264 -0.426 . . . . 0.46000000000000002 111.745 -179.574 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -53.79 -46.03 70.9 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-O 120.938 0.399 . . . . 2.23 110.446 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.569 HD12 HD11 ' A' ' 51' ' ' LEU . 32.5 tp -57.27 -42.69 82.12 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.741 -0.663 . . . . 1.3600000000000001 110.71 179.837 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -68.46 -30.19 69.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.227 -0.442 . . . . 1.22 111.095 -179.8 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -68.45 -53.55 22.81 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.382 -0.372 . . . . 0.62 110.965 179.551 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.569 HD11 HD12 ' A' ' 48' ' ' LEU . 1.0 OUTLIER -65.38 -34.87 79.34 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.318 -0.401 . . . . 0.39000000000000001 110.979 179.931 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 34.9 mt -59.78 -44.73 94.58 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.134 0 CA-C-N 116.523 -0.308 . . . . 0.5 110.458 179.467 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.68 -32.47 73.81 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.236 -0.438 . . . . 0.58999999999999997 110.53 179.624 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -66.53 -46.04 77.48 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.007 -0.542 . . . . 2.54 110.178 179.352 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ALA . . . . . 0.433 ' HB1' ' HB3' ' A' ' 63' ' ' LEU . . . -76.21 -20.76 57.17 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.014 -0.539 . . . . 0.53000000000000003 111.078 179.585 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -80.35 -31.74 37.89 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.277 -0.42 . . . . 1.95 110.985 -179.88 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -91.98 -12.95 31.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.053 -0.522 . . . . 2.48 110.763 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 30.4 t-20 -81.2 -84.02 0.11 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.098 -0.501 . . . . 2.48 110.785 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ASN . . . . . 0.492 ' HB2' ' O ' ' A' ' 62' ' ' GLN . 15.7 m-80 -101.54 35.97 2.16 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.885 0.374 . . . . 2.0499999999999998 110.805 -179.914 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 11.6 m-20 62.27 -132.82 0.55 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.883 -0.599 . . . . 1.47 111.116 179.62 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -78.71 29.65 2.04 Favored Glycine 0 C--N 1.334 0.419 0 C-N-CA 120.638 -0.791 . . . . 0.42999999999999999 112.526 -179.706 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.633 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 16.1 mm-40 -145.1 155.32 43.25 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.17 0.51 . . . . 0.38 111.338 179.829 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.647 HD21 HD23 ' A' ' 32' ' ' LEU . 2.1 pp -142.07 157.93 44.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.442 -0.799 . . . . 1.4299999999999999 109.084 179.529 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ASN . . . . . 0.482 ' OD1' ' HE3' ' A' ' 26' ' ' LYS . 0.7 OUTLIER -110.23 157.37 19.51 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.74 -0.384 . . . . 1.1899999999999999 111.856 -177.411 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -39.28 -33.47 0.15 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.476 -0.784 . . . . 0.40000000000000002 111.846 -179.794 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 2.8 m -64.25 -43.9 93.47 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 111.663 0.245 . . . . 0.81000000000000005 111.663 -179.582 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.535 ' HB2' HD13 ' A' ' 63' ' ' LEU . 22.7 mm-40 -61.96 -55.14 32.49 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.853 0.359 . . . . 1.3600000000000001 110.958 179.818 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -59.39 -49.7 76.78 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.041 -0.527 . . . . 0.51000000000000001 111.376 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 6.3 t -61.14 -39.24 89.3 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-O 120.869 0.366 . . . . 0.75 110.692 -179.978 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' GLY . . . . . 0.528 ' O ' ' HB3' ' A' ' 73' ' ' ALA . . . -60.08 -42.86 98.65 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.648 -0.787 . . . . 0.40999999999999998 111.85 179.783 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.56 HD13 HD13 ' A' ' 51' ' ' LEU . 64.8 mt -63.59 -51.23 72.92 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.688 0 CA-C-O 121.657 0.742 . . . . 0.51000000000000001 109.294 177.997 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' MET . . . . . 0.497 ' O ' ' HB2' ' A' ' 76' ' ' MET . 14.2 mtp -53.73 -29.63 40.36 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.027 -0.988 . . . . 1.01 108.729 178.375 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.528 ' HB3' ' O ' ' A' ' 70' ' ' GLY . . . -72.14 -35.39 69.06 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.12 -0.945 . . . . 0.69999999999999996 110.623 179.866 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.555 ' HG2' ' O ' ' A' ' 71' ' ' ILE . 0.1 OUTLIER -80.34 -32.83 37.75 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.338 -0.392 . . . . 1.3799999999999999 111.73 -179.724 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -82.71 -42.72 17.72 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.082 0.468 . . . . 1.98 111.195 -178.882 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' MET . . . . . 0.497 ' HB2' ' O ' ' A' ' 72' ' ' MET . 80.7 mtp . . . . . 0 C--N 1.324 -0.522 0 CA-C-N 115.574 -0.739 . . . . 1.2 112.005 -179.299 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.509 ' O ' ' HG2' ' A' ' 85' ' ' MET . 3.9 t . . . . . 0 N--CA 1.468 0.432 0 CA-C-O 120.988 0.423 . . . . 7.29 111.298 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -47.32 -24.23 0.72 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.51 -0.768 . . . . 9.7400000000000002 112.3 -179.138 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -64.14 -55.28 22.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.753 0.311 . . . . 12.109999999999999 111.391 -179.78 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -64.03 -18.3 64.19 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.379 -0.373 . . . . 10.869999999999999 110.908 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' MET . . . . . 0.554 ' HB3' HD11 ' A' ' 145' ' ' ILE . 4.1 mmm -78.81 -48.03 15.55 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.104 -0.498 . . . . 11.09 110.059 -179.662 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 21.0 ttt180 -55.71 -39.0 70.45 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.517 -0.765 . . . . 15.52 110.134 179.272 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -65.2 -47.66 76.15 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.989 -0.551 . . . . 14.85 110.228 179.158 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -65.57 -24.26 67.05 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.057 -0.52 . . . . 14.109999999999999 111.332 179.781 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 86.7 t80 -73.83 -46.91 42.18 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.95 0.405 . . . . 15.73 110.852 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -60.65 -38.31 84.42 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.991 -0.549 . . . . 17.66 110.866 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 67.7 mt -70.98 -46.27 68.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.863 -0.608 . . . . 18.149999999999999 111.166 -179.631 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.514 ' HA ' HG21 ' A' ' 108' ' ' VAL . 0.7 OUTLIER -66.96 -26.67 66.94 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.382 -0.372 . . . . 18.34 111.099 -179.885 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 23.7 t0 -96.16 93.92 7.21 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.153 -0.476 . . . . 19.289999999999999 110.237 179.69 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -69.61 -11.46 60.85 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.083 -0.508 . . . . 22.25 111.354 -179.386 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 47.8 m-20 -101.71 167.75 9.9 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.341 -0.391 . . . . 23.34 110.94 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.07 5.18 57.66 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.842 -0.694 . . . . 22.0 112.072 179.513 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -70.84 -31.47 68.19 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.682 0.277 . . . . 22.280000000000001 111.267 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 92.37 27.25 15.81 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.686 -0.768 . . . . 19.93 112.519 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 90.1 m-85 -139.47 147.23 41.04 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.498 0.19 . . . . 20.300000000000001 110.632 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.466 ' HB ' ' HB ' ' A' ' 136' ' ' ILE . 71.1 mt -113.92 131.37 66.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 121.149 0.5 . . . . 19.370000000000001 111.223 179.789 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 79.4 p -114.02 157.8 41.09 Favored Pre-proline 0 C--N 1.326 -0.42 0 CA-C-N 115.509 -0.769 . . . . 22.489999999999998 110.049 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_exo -47.94 -31.55 15.9 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.068 1.845 . . . . 23.0 111.676 -179.658 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.57 -36.86 79.33 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.726 -0.67 . . . . 24.559999999999999 111.11 179.668 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' GLU . . . . . 0.431 ' O ' HG23 ' A' ' 108' ' ' VAL . 39.0 mt-10 -80.26 -36.68 34.23 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.938 -0.574 . . . . 22.23 109.889 -179.477 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.563 HD22 ' HB ' ' A' ' 121' ' ' ILE . 5.5 tt -62.12 -43.57 98.54 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.331 -0.85 . . . . 20.359999999999999 110.267 179.859 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.432 ' O ' HG13 ' A' ' 110' ' ' ILE . 61.1 ttt180 -65.59 -54.63 25.24 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.933 -0.576 . . . . 27.190000000000001 110.89 179.783 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 4.3 m-85 -49.38 -49.46 44.46 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.137 -0.483 . . . . 25.359999999999999 111.973 -179.454 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.514 HG21 ' HA ' ' A' ' 92' ' ' PHE . 83.6 t -64.46 -50.72 74.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.695 -0.23 . . . . 21.059999999999999 111.557 -179.475 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.464 ' HG3' HD23 ' A' ' 105' ' ' LEU . 0.3 OUTLIER -53.15 -39.22 63.38 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.741 0.305 . . . . 20.93 110.739 -179.951 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.432 HG13 ' O ' ' A' ' 106' ' ' ARG . 82.7 mt -70.74 -29.59 38.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 120.999 0.428 . . . . 25.129999999999999 110.28 179.329 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -71.13 -39.73 71.83 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.828 -0.624 . . . . 23.32 110.741 179.604 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.433 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 38.2 mt -65.33 -32.57 74.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.043 -0.526 . . . . 21.07 110.664 179.879 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 126.87 -11.98 6.92 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.828 -0.701 . . . . 23.050000000000001 112.271 -179.854 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -91.06 114.49 27.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.743 0.306 . . . . 22.59 111.127 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.43 ' HD3' ' N ' ' A' ' 115' ' ' LYS . 3.8 mppt? -84.08 125.65 32.32 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.225 -0.443 . . . . 27.960000000000001 110.779 179.848 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 116' ' ' VAL . . . . . 0.403 HG12 ' OE1' ' A' ' 120' ' ' GLU . 2.4 m -135.57 147.27 28.79 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.241 -0.436 . . . . 24.75 111.44 -179.951 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 82.2 p -87.99 147.24 25.11 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.935 -0.575 . . . . 27.239999999999998 110.198 179.105 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 118' ' ' ASP . . . . . 0.408 ' O ' ' HB2' ' A' ' 122' ' ' ASP . 8.1 m-20 -53.64 -19.93 4.63 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.259 -0.428 . . . . 26.629999999999999 111.576 -179.529 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 23.1 mm-40 -77.61 -55.69 5.15 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.01 0.374 . . . . 29.140000000000001 112.01 -179.264 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 120' ' ' GLU . . . . . 0.403 ' OE1' HG12 ' A' ' 116' ' ' VAL . 14.6 pt-20 -58.47 -41.69 85.82 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.636 0.255 . . . . 24.190000000000001 111.563 -179.306 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.563 ' HB ' HD22 ' A' ' 105' ' ' LEU . 45.7 pt -70.74 -33.59 53.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 C-N-CA 120.903 -0.319 . . . . 22.329999999999998 110.749 179.67 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 122' ' ' ASP . . . . . 0.408 ' HB2' ' O ' ' A' ' 118' ' ' ASP . 16.2 t70 -56.03 -50.98 69.41 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 120.768 0.318 . . . . 24.289999999999999 110.617 179.401 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.55 -43.35 99.02 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.204 -0.453 . . . . 24.739999999999998 110.736 179.797 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 51.0 ttp -54.66 -38.6 67.13 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.174 -0.466 . . . . 19.710000000000001 110.915 179.65 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.551 HG23 HD11 ' A' ' 136' ' ' ILE . 85.0 mt -68.47 -37.07 77.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.232 -0.44 . . . . 19.949999999999999 110.742 179.682 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 70.3 ttt180 -65.94 -30.08 70.59 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.155 -0.475 . . . . 24.949999999999999 110.637 179.677 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -74.67 -24.86 58.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.077 -0.511 . . . . 18.690000000000001 111.173 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.613 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -100.58 -13.63 18.52 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.183 -0.462 . . . . 16.469999999999999 111.118 179.855 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -97.14 105.31 17.43 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.052 -0.522 . . . . 20.399999999999999 110.931 -179.684 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 -97.96 -33.94 11.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.931 -0.577 . . . . 21.43 111.153 -179.651 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -66.02 -13.86 60.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.365 -0.38 . . . . 23.370000000000001 110.777 -179.835 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.13 85.31 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.834 -0.698 . . . . 24.32 112.521 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -153.8 -19.53 0.14 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.661 0.267 . . . . 23.879999999999999 111.475 -179.84 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 87.21 16.25 61.09 Favored Glycine 0 N--CA 1.453 -0.211 0 C-N-CA 120.67 -0.776 . . . . 22.670000000000002 112.6 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 70.3 mtp -132.72 155.54 48.65 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.625 0.25 . . . . 22.91 110.539 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.742 HG23 ' HB2' ' A' ' 140' ' ' GLU . 50.5 mm -114.61 138.65 44.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.367 0.604 . . . . 18.41 112.076 -179.238 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 137' ' ' ASN . . . . . 0.472 ' O ' ' N ' ' A' ' 139' ' ' GLU . 21.8 p30 -115.5 159.06 21.69 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.194 -0.912 . . . . 16.82 108.644 177.893 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.611 ' O ' HG23 ' A' ' 142' ' ' VAL . 47.0 t80 -38.21 -24.67 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 112.416 0.524 . . . . 14.65 112.416 -178.789 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 139' ' ' GLU . . . . . 0.472 ' N ' ' O ' ' A' ' 137' ' ' ASN . 47.2 mt-10 -80.44 -55.27 5.0 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.742 0.306 . . . . 14.82 111.19 -179.636 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.742 ' HB2' HG23 ' A' ' 136' ' ' ILE . 30.2 mt-10 -60.69 -28.4 68.6 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.319 -0.4 . . . . 17.460000000000001 110.738 -179.851 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.681 ' HA ' ' HE2' ' A' ' 144' ' ' MET . 86.5 t80 -72.46 -56.12 5.93 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.292 -0.413 . . . . 12.93 110.703 179.841 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.611 HG23 ' O ' ' A' ' 138' ' ' TYR . 50.3 t -48.32 -37.01 7.09 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 CA-C-N 115.939 -0.573 . . . . 10.699999999999999 111.589 179.478 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 143' ' ' TRP . . . . . 0.522 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 92.7 t90 -71.11 -55.58 7.91 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.296 0.48 . . . . 13.66 112.296 -178.872 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 144' ' ' MET . . . . . 0.681 ' HE2' ' HA ' ' A' ' 141' ' ' PHE . 22.8 ptt? -63.11 -24.38 67.87 Favored 'General case' 0 N--CA 1.464 0.237 0 N-CA-C 112.957 0.725 . . . . 14.5 112.957 -177.808 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 145' ' ' ILE . . . . . 0.554 HD11 ' HB3' ' A' ' 85' ' ' MET . 48.6 pt -80.73 -40.48 19.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 N-CA-C 112.182 0.438 . . . . 11.25 112.182 -179.513 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 146' ' ' SER . . . . . 0.521 ' N ' HG13 ' A' ' 145' ' ' ILE . 86.4 p -59.38 -13.61 9.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.275 0.559 . . . . 8.5399999999999991 110.436 -179.759 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 147' ' ' GLN . . . . . 0.522 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 1.6 mm100 -105.34 26.71 9.08 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.304 -0.862 . . . . 11.869999999999999 111.529 -178.692 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 9.6 mtmp? . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.158 -0.925 . . . . 13.68 110.721 179.593 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 20.1 mt . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.851 0.358 . . . . 1.27 110.806 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 6.2 m -84.0 158.99 21.31 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.139 -0.482 . . . . 1.1200000000000001 110.801 -179.9 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -47.63 -30.84 4.0 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 111.818 0.303 . . . . 2.2000000000000002 111.818 -179.624 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.413 ' HG3' ' N ' ' A' ' 8' ' ' GLN . 11.0 pt-20 -76.58 -51.29 11.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.947 0.403 . . . . 1.3500000000000001 110.916 -179.567 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' GLN . . . . . 0.413 ' N ' ' HG3' ' A' ' 7' ' ' GLU . 86.0 mt-30 -63.18 -36.08 82.44 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.025 -0.534 . . . . 2.2200000000000002 110.682 179.924 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.559 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 97.1 mt -62.68 -52.09 63.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.959 -0.564 . . . . 0.54000000000000004 110.65 179.859 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.25 -26.48 67.78 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.888 -0.596 . . . . 0.5 111.4 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -69.61 -56.93 5.91 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 111.889 0.329 . . . . 2.27 111.889 -179.161 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.559 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 4.1 p90 -76.47 -23.6 53.83 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 120.54 -0.464 . . . . 0.37 110.92 -179.557 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.442 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 18.1 tptm -66.33 -35.59 80.76 Favored 'General case' 0 C--N 1.332 -0.163 0 N-CA-C 109.145 -0.687 . . . . 1.23 109.145 178.911 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.44 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 23.5 t70 -68.03 -49.82 59.1 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 108.777 -0.823 . . . . 0.44 108.777 177.995 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.28 -13.95 52.82 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.303 -0.862 . . . . 0.28999999999999998 110.453 178.824 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.519 ' HA ' HD11 ' A' ' 35' ' ' LEU . 83.4 t80 -79.65 -48.9 12.96 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.842 -0.617 . . . . 0.47999999999999998 110.823 -179.629 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 19.7 m -67.89 -20.88 26.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 120.974 0.416 . . . . 1.1100000000000001 110.415 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.44 ' HG2' ' O ' ' A' ' 14' ' ' ASP . 77.6 mm-40 -60.36 -32.82 71.63 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.827 -0.624 . . . . 1.6000000000000001 111.455 179.334 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 82.3 m-85 -93.93 4.02 54.52 Favored 'General case' 0 N--CA 1.463 0.191 0 N-CA-C 111.721 0.267 . . . . 0.64000000000000001 111.721 -179.578 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -101.79 87.21 3.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.002 0.43 . . . . 0.44 110.672 179.672 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -97.4 -15.0 20.88 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.9 -0.591 . . . . 2.1000000000000001 111.322 -179.878 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -83.58 1.14 43.58 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.225 -0.443 . . . . 1.8 111.365 -179.547 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 63.67 16.07 58.43 Favored Glycine 0 C--N 1.331 0.268 0 C-N-CA 120.987 -0.625 . . . . 0.46000000000000002 113.032 179.645 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 46.1 p -92.65 8.34 39.55 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.642 0.258 . . . . 0.40000000000000002 111.124 179.838 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 57.1 18.19 26.35 Favored Glycine 0 C--N 1.331 0.304 0 C-N-CA 120.823 -0.703 . . . . 0.33000000000000002 111.822 -179.677 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.492 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 35.7 mtpt -127.4 155.54 43.47 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.82 0.343 . . . . 1.1000000000000001 111.06 -179.512 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 43.6 pt -116.67 134.72 59.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.272 -0.422 . . . . 0.5 111.601 -179.711 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -53.47 138.91 32.49 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.083 -0.508 . . . . 0.29999999999999999 111.282 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.585 ' HA ' HD11 ' A' ' 63' ' ' LEU . 7.7 t -68.98 -5.39 21.35 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.073 -0.512 . . . . 1.03 111.161 -179.901 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 49.6 mtp180 -97.53 4.93 50.22 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.954 -0.566 . . . . 3.0800000000000001 110.385 179.717 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -128.7 -1.49 5.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.864 -0.607 . . . . 2.2599999999999998 110.824 -179.862 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.461 HD21 ' CD1' ' A' ' 68' ' ' PHE . 2.6 tm? -55.3 -54.15 47.11 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.158 -0.474 . . . . 1.3700000000000001 110.495 179.834 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.411 ' O ' ' HG3' ' A' ' 37' ' ' ARG . . . -56.01 -42.25 86.59 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.578 -0.82 . . . . 0.32000000000000001 111.815 179.433 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 56.6 m -55.63 -37.19 67.86 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.023 0.44 . . . . 0.31 110.256 179.291 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.519 HD11 ' HA ' ' A' ' 16' ' ' PHE . 1.2 tt -65.36 -36.23 83.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.681 -0.69 . . . . 1.24 110.031 179.386 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.495 ' SD ' ' HG3' ' A' ' 43' ' ' PRO . 25.1 mtp -78.2 -20.35 52.04 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.788 -0.642 . . . . 1.1000000000000001 110.853 179.887 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.411 ' HG3' ' O ' ' A' ' 33' ' ' GLY . 62.3 mtp180 -77.57 -38.52 48.28 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.315 -0.402 . . . . 2.6899999999999999 110.498 179.527 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.444 HG23 ' CD1' ' A' ' 39' ' ' LEU . 1.5 t -71.39 -13.31 61.81 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.222 -0.444 . . . . 1.0600000000000001 110.943 179.588 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.449 ' HB3' ' OE1' ' A' ' 41' ' ' GLN . 10.9 mp -113.28 156.23 23.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.096 -0.502 . . . . 1.26 110.701 179.691 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -49.5 -20.69 2.67 Favored Glycine 0 CA--C 1.521 0.46 0 CA-C-N 115.679 -0.691 . . . . 0.68999999999999995 114.303 -178.824 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.449 ' OE1' ' HB3' ' A' ' 39' ' ' LEU . 20.0 mp0 -60.78 139.06 58.04 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 117.382 0.591 . . . . 1.97 111.09 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 74.9 m-20 -130.97 78.51 73.32 Favored Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 116.179 -0.464 . . . . 2.6600000000000001 110.966 179.851 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.495 ' HG3' ' SD ' ' A' ' 36' ' ' MET . 59.9 Cg_endo -68.97 147.59 68.3 Favored 'Trans proline' 0 C--N 1.343 0.259 0 C-N-CA 122.767 2.311 . . . . 0.51000000000000001 112.256 179.757 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 63.5 m -68.9 143.34 54.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.339 -0.391 . . . . 0.72999999999999998 110.59 179.505 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.47 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 8.9 tp10 -47.93 -55.32 10.2 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.612 0.244 . . . . 2.7000000000000002 111.051 -179.601 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -55.09 -45.08 75.41 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.296 -0.411 . . . . 0.46000000000000002 111.164 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -53.27 -53.8 45.49 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.278 -0.419 . . . . 2.23 110.704 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.442 ' HA ' HD21 ' A' ' 51' ' ' LEU . 12.3 mt -56.6 -38.14 71.62 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.313 -0.403 . . . . 1.3600000000000001 110.47 179.44 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.47 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 84.0 mm-40 -67.25 -27.17 66.99 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.394 -0.366 . . . . 1.22 110.585 179.603 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 38.5 m-20 -77.35 -55.35 5.48 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.207 -0.451 . . . . 0.62 111.8 -179.646 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.56 HD13 HD13 ' A' ' 71' ' ' ILE . 1.1 pp -65.8 -35.88 81.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.497 -0.319 . . . . 0.39000000000000001 111.8 -179.19 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 82.6 mt -71.21 -43.22 74.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.698 0.285 . . . . 0.5 111.016 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.58 -49.94 71.39 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.406 -0.361 . . . . 0.58999999999999997 111.0 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -58.91 -36.15 74.23 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.892 0.377 . . . . 2.54 110.072 179.474 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -76.23 -19.63 58.18 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.077 -0.511 . . . . 0.53000000000000003 110.767 179.217 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -79.16 -31.21 43.91 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.164 -0.471 . . . . 1.95 110.802 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 85.2 m-20 -111.5 41.75 1.83 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.145 -0.48 . . . . 2.48 110.875 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 -158.03 -63.42 0.09 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.076 -0.511 . . . . 2.48 110.519 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -87.42 23.1 1.98 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.122 -0.49 . . . . 2.0499999999999998 110.803 179.827 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 68.0 m-20 66.27 -76.69 0.05 OUTLIER 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.009 -0.541 . . . . 1.47 111.086 -179.814 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -165.15 21.01 0.12 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.842 -0.694 . . . . 0.42999999999999999 112.373 179.767 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.492 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 10.8 mm-40 -132.14 155.22 48.56 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.982 0.42 . . . . 0.38 111.406 -179.814 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.585 HD11 ' HA ' ' A' ' 29' ' ' THR . 24.1 mt -123.88 152.38 42.43 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.837 -0.619 . . . . 1.4299999999999999 110.403 179.858 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 19.9 m-80 -113.2 157.77 21.29 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.884 0.373 . . . . 1.1899999999999999 111.132 -179.757 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -42.3 -37.71 1.6 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.67 -0.695 . . . . 0.40000000000000002 111.158 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -72.32 -38.96 68.56 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.206 -0.452 . . . . 0.81000000000000005 111.544 179.8 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -58.07 -51.2 70.66 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.026 0.441 . . . . 1.3600000000000001 110.4 179.744 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.461 ' CD1' HD21 ' A' ' 32' ' ' LEU . 29.5 t80 -67.1 -46.83 73.03 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.739 -0.664 . . . . 0.51000000000000001 110.797 179.904 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 10.6 m -55.12 -50.82 68.29 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.148 -0.478 . . . . 0.75 111.038 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -52.82 -52.4 39.1 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.891 -0.671 . . . . 0.40999999999999998 112.007 179.799 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.687 HG23 ' HE2' ' A' ' 74' ' ' LYS . 70.2 mt -58.24 -50.28 78.95 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.601 0 CA-C-O 120.967 0.413 . . . . 0.51000000000000001 110.8 179.204 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 2.3 mtp -43.39 -37.63 2.39 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.569 -0.741 . . . . 1.01 110.819 179.625 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.27 -55.28 10.98 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.118 -0.492 . . . . 0.69999999999999996 111.133 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.687 ' HE2' HG23 ' A' ' 71' ' ' ILE . 57.7 pttt -59.8 -30.26 68.79 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.963 -0.562 . . . . 1.3799999999999999 111.411 -179.389 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 6.9 tm0? -81.59 -46.46 14.39 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.289 -0.414 . . . . 1.98 111.919 -179.369 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 32.4 mtt . . . . . 0 N--CA 1.452 -0.356 0 CA-C-N 116.328 -0.396 . . . . 1.2 111.632 -179.431 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.53 ' O ' ' HG2' ' A' ' 85' ' ' MET . 1.7 t . . . . . 0 N--CA 1.466 0.339 0 CA-C-O 120.972 0.415 . . . . 7.29 110.723 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.426 ' HA ' ' HG2' ' A' ' 85' ' ' MET . 43.8 mt-10 -49.34 -19.88 0.58 Allowed 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 113.353 0.871 . . . . 9.7400000000000002 113.353 -178.221 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -62.28 -55.87 24.05 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 120.992 0.425 . . . . 12.109999999999999 111.461 -179.423 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -69.63 -16.01 63.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.131 -0.486 . . . . 10.869999999999999 111.17 -179.525 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' MET . . . . . 0.537 ' HB3' HG22 ' A' ' 142' ' ' VAL . 2.8 mmm -82.61 -32.12 28.53 Favored 'General case' 0 CA--C 1.508 -0.639 0 CA-C-O 121.979 0.895 . . . . 11.09 108.84 -179.24 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 25.9 tpt180 -64.67 -50.12 68.28 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 113.655 -1.611 . . . . 15.52 110.037 179.404 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -65.54 -37.09 85.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.8 -0.636 . . . . 14.85 110.195 179.164 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.79 -31.13 69.92 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.973 -0.558 . . . . 14.109999999999999 111.128 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 87.6 t80 -68.04 -39.59 83.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.137 0.494 . . . . 15.73 110.373 179.789 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 65.7 mttm -65.83 -39.51 90.88 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.543 -0.753 . . . . 17.66 110.918 179.769 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 78.2 mt -70.46 -45.43 74.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.059 -0.518 . . . . 18.149999999999999 111.59 -179.755 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.534 ' HD1' HG11 ' A' ' 108' ' ' VAL . 1.9 m-85 -67.51 -55.46 13.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.452 -0.34 . . . . 18.34 111.511 -179.503 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 27.9 t0 -58.35 109.14 0.72 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.879 0.371 . . . . 19.289999999999999 110.523 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.516 ' HG2' ' HB3' ' A' ' 104' ' ' GLU . 22.4 mmm180 -57.88 -37.0 73.18 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.967 -0.56 . . . . 22.25 111.129 -179.464 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.418 ' HB2' ' OD1' ' A' ' 97' ' ' ASP . 0.3 OUTLIER -107.8 176.46 5.14 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.22 -0.445 . . . . 23.34 110.784 -179.78 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.03 5.34 57.79 Favored Glycine 0 N--CA 1.449 -0.433 0 C-N-CA 120.896 -0.668 . . . . 22.0 112.157 179.721 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.437 ' OD2' ' HB2' ' A' ' 99' ' ' PHE . 11.6 p-10 -58.8 -38.79 79.38 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.808 0.337 . . . . 22.280000000000001 110.98 -179.875 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 105.21 28.15 5.62 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.858 -0.687 . . . . 19.93 113.076 179.427 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' PHE . . . . . 0.437 ' HB2' ' OD2' ' A' ' 97' ' ' ASP . 59.8 m-85 -145.39 139.06 26.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.012 0.435 . . . . 20.300000000000001 111.622 179.89 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.426 ' HB ' ' HB ' ' A' ' 136' ' ' ILE . 84.3 mt -114.84 124.59 71.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 115.774 -0.648 . . . . 19.370000000000001 110.619 179.414 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 58.4 m -114.21 156.55 44.1 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.154 -0.475 . . . . 22.489999999999998 110.958 -179.56 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -41.25 -32.54 1.18 Allowed 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 122.723 2.282 . . . . 23.0 112.181 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.55 -51.08 62.53 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.1 0.476 . . . . 24.559999999999999 110.531 179.299 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 104' ' ' GLU . . . . . 0.543 ' O ' HG12 ' A' ' 108' ' ' VAL . 45.0 mt-10 -69.57 -26.99 64.75 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.674 -0.694 . . . . 22.23 110.875 179.851 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.493 HD23 ' C ' ' A' ' 105' ' ' LEU . 5.8 tt -69.13 -55.83 9.51 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.333 -0.394 . . . . 20.359999999999999 111.161 -179.583 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 7.1 ppt_? -62.49 -30.57 71.36 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.034 0.445 . . . . 27.190000000000001 110.597 -179.679 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -74.19 -36.59 64.02 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.785 -0.643 . . . . 25.359999999999999 112.043 -179.866 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.543 HG12 ' O ' ' A' ' 104' ' ' GLU . 7.2 p -80.0 -44.88 22.85 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 N-CA-C 111.947 0.351 . . . . 21.059999999999999 111.947 -179.352 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.473 ' N ' HG13 ' A' ' 108' ' ' VAL . 12.0 mmt -52.69 -38.98 61.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.49 -0.323 . . . . 20.93 111.429 -179.587 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 89.6 mt -65.65 -34.48 70.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.843 0.354 . . . . 25.129999999999999 110.538 179.488 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 11.5 m120 -65.64 -22.93 66.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.09 -0.505 . . . . 23.32 110.444 179.559 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 7.5 mt -88.42 -27.87 21.28 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.954 -0.566 . . . . 21.07 110.531 179.722 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 106.22 10.8 29.02 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.896 -0.668 . . . . 23.050000000000001 112.217 -179.741 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -74.61 -34.86 62.9 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.65 0.262 . . . . 22.59 111.306 -179.737 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 57.3 tptt 53.85 90.69 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.119 -0.491 . . . . 27.960000000000001 110.76 -179.708 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 116' ' ' VAL . . . . . 0.414 ' HB ' HG23 ' A' ' 121' ' ' ILE . 3.3 m -124.23 156.33 31.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.919 -0.582 . . . . 24.75 111.698 -179.525 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 117' ' ' THR . . . . . 0.45 ' O ' HG12 ' A' ' 121' ' ' ILE . 61.9 p -99.22 147.16 25.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.696 -0.683 . . . . 27.239999999999998 110.272 179.676 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 118' ' ' ASP . . . . . 0.436 ' O ' ' HB2' ' A' ' 122' ' ' ASP . 14.8 m-20 -53.55 -17.67 2.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.258 -0.428 . . . . 26.629999999999999 111.439 -179.593 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -79.93 -55.71 4.77 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.739 0.304 . . . . 29.140000000000001 111.381 -179.807 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 120' ' ' GLU . . . . . 0.401 ' OE1' HG12 ' A' ' 116' ' ' VAL . 14.7 pt-20 -61.79 -35.03 76.99 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.412 -0.358 . . . . 24.190000000000001 111.44 -179.539 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.462 ' O ' HG13 ' A' ' 125' ' ' ILE . 7.4 pt -78.01 -33.52 18.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 C-N-CA 120.976 -0.289 . . . . 22.329999999999998 111.174 -179.909 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 122' ' ' ASP . . . . . 0.442 ' N ' HG13 ' A' ' 121' ' ' ILE . 12.7 t70 -55.85 -44.83 78.37 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.598 -0.519 . . . . 24.289999999999999 109.598 178.819 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -67.66 -42.59 81.95 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.621 -0.718 . . . . 24.739999999999998 110.214 179.073 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 54.7 ttp -58.1 -37.06 73.82 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.026 -0.533 . . . . 19.710000000000001 110.99 179.643 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.462 HG13 ' O ' ' A' ' 121' ' ' ILE . 77.3 mt -65.87 -45.32 91.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.278 -0.419 . . . . 19.949999999999999 110.38 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 61.3 ttt180 -58.68 -38.05 77.38 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.81 -0.632 . . . . 24.949999999999999 111.089 179.753 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -63.01 -28.12 69.89 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.205 -0.452 . . . . 18.690000000000001 111.076 -179.88 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.536 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -103.44 -6.61 21.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.259 -0.428 . . . . 16.469999999999999 111.038 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 54.4 t0 -109.34 100.96 10.0 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.15 -0.477 . . . . 20.399999999999999 111.071 -179.583 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 92.6 m-85 -70.38 -48.82 54.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.948 -0.569 . . . . 21.43 111.018 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -64.99 -21.85 66.91 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.182 -0.463 . . . . 23.370000000000001 110.863 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 55.26 55.51 28.01 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.941 -0.647 . . . . 24.32 112.698 179.74 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -101.73 -7.07 22.93 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.826 0.346 . . . . 23.879999999999999 110.765 179.8 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 89.93 9.49 65.85 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.844 -0.693 . . . . 22.670000000000002 112.305 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 68.3 mtp -134.93 154.38 51.71 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.843 0.354 . . . . 22.91 110.835 -179.901 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.554 HG23 ' HB2' ' A' ' 140' ' ' GLU . 27.8 mm -114.87 144.0 23.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.1 -0.5 . . . . 18.41 111.812 -179.516 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 137' ' ' ASN . . . . . 0.415 ' O ' ' N ' ' A' ' 139' ' ' GLU . 24.4 t-20 -114.59 157.15 23.43 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.43 -0.805 . . . . 16.82 108.993 178.437 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.683 ' O ' HG23 ' A' ' 142' ' ' VAL . 39.4 t80 -40.85 -24.08 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 111.821 0.304 . . . . 14.65 111.821 -179.828 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 139' ' ' GLU . . . . . 0.415 ' N ' ' O ' ' A' ' 137' ' ' ASN . 10.6 mm-40 -80.8 -56.25 4.26 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 120.818 0.342 . . . . 14.82 110.983 -179.359 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.554 ' HB2' HG23 ' A' ' 136' ' ' ILE . 39.5 mt-10 -59.09 -29.45 67.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.134 0.492 . . . . 17.460000000000001 109.892 179.539 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.451 ' CZ ' HG21 ' A' ' 145' ' ' ILE . 86.5 t80 -66.37 -55.41 16.0 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.585 -0.734 . . . . 12.93 109.834 179.141 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.683 HG23 ' O ' ' A' ' 138' ' ' TYR . 55.3 t -47.67 -36.53 5.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.65 -0.704 . . . . 10.699999999999999 111.273 179.022 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 79.4 t90 -67.81 -55.97 10.98 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.833 0.679 . . . . 13.66 112.833 -178.656 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 144' ' ' MET . . . . . 0.536 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 15.5 ptt? -65.72 -28.72 69.26 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 113.348 0.87 . . . . 14.5 113.348 -177.564 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 145' ' ' ILE . . . . . 0.542 ' O ' ' HG2' ' A' ' 148' ' ' LYS . 49.2 pt -73.19 -42.05 58.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 C-N-CA 120.832 -0.347 . . . . 11.25 111.763 -179.388 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 146' ' ' SER . . . . . 0.538 ' N ' HG13 ' A' ' 145' ' ' ILE . 79.0 p -64.6 -13.03 51.52 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.227 0.536 . . . . 8.5399999999999991 109.845 179.374 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 11.1 mm-40 -122.11 13.1 10.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.265 -0.88 . . . . 11.869999999999999 111.839 -178.355 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 148' ' ' LYS . . . . . 0.542 ' HG2' ' O ' ' A' ' 145' ' ' ILE . 19.2 pttp . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.162 -0.923 . . . . 13.68 110.914 179.611 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.442 HD13 ' SG ' ' A' ' 69' ' ' CYS . 56.2 mt . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.754 0.311 . . . . 1.27 110.674 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 58.8 p -80.02 -170.71 2.58 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.261 -0.427 . . . . 1.1200000000000001 111.423 -179.679 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -66.15 -46.79 76.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.277 -0.42 . . . . 2.2000000000000002 111.259 -179.829 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -71.9 -38.81 69.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.235 -0.439 . . . . 1.3500000000000001 110.947 -179.519 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 15.9 mm100 -64.64 -44.38 90.65 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.108 -0.496 . . . . 2.2200000000000002 110.676 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.519 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 45.7 mt -59.35 -50.47 79.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.376 -0.374 . . . . 0.54000000000000004 110.484 179.598 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.89 -19.78 65.79 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.111 -0.495 . . . . 0.5 111.08 179.888 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -71.44 -56.2 6.42 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.231 -0.44 . . . . 2.27 111.887 -178.941 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.519 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 20.1 p90 -78.67 -27.96 45.24 Favored 'General case' 0 C--N 1.333 -0.122 0 C-N-CA 120.565 -0.454 . . . . 0.37 110.863 -179.823 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 27.3 tptp -61.83 -37.65 85.23 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.272 -0.64 . . . . 1.23 109.272 178.663 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.412 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 22.8 t70 -69.39 -49.93 50.82 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.719 -0.673 . . . . 0.44 109.488 178.483 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.26 -14.82 42.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.617 -0.72 . . . . 0.28999999999999998 110.79 179.389 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 47.3 t80 -80.5 -51.84 8.32 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.975 -0.557 . . . . 0.47999999999999998 110.863 -179.61 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 13.6 m -66.1 -19.55 25.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.091 0.472 . . . . 1.1100000000000001 110.629 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.412 ' HG2' ' O ' ' A' ' 14' ' ' ASP . 73.5 mm-40 -65.22 -21.8 66.8 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.648 -0.706 . . . . 1.6000000000000001 111.37 179.588 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 -110.85 12.34 22.34 Favored 'General case' 0 N--CA 1.462 0.174 0 N-CA-C 112.026 0.38 . . . . 0.64000000000000001 112.026 -179.499 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -100.96 92.55 5.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.023 0.44 . . . . 0.44 110.716 179.483 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -99.7 -1.13 38.66 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.885 -0.598 . . . . 2.1000000000000001 111.222 -179.883 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -95.29 -23.19 17.33 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.186 -0.461 . . . . 1.8 111.465 -179.299 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.1 7.21 87.69 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.831 -0.7 . . . . 0.46000000000000002 112.796 179.784 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 24.3 p -84.53 17.36 2.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.589 0.233 . . . . 0.40000000000000002 111.172 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 57.48 18.0 28.27 Favored Glycine 0 C--N 1.332 0.332 0 C-N-CA 120.718 -0.753 . . . . 0.33000000000000002 111.841 -179.475 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.667 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 44.8 mtpt -136.82 154.71 50.45 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.598 -0.301 . . . . 1.1000000000000001 110.444 -179.443 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.48 ' CD1' HD12 ' A' ' 35' ' ' LEU . 44.1 pt -119.68 135.45 59.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 120.612 0.244 . . . . 0.5 111.048 179.948 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -49.17 132.12 19.54 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.499 -0.319 . . . . 0.29999999999999999 110.894 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 5.9 t -61.03 -17.05 50.19 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.129 -0.487 . . . . 1.03 111.019 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 69.3 mtt180 -79.23 -2.67 42.22 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.826 -0.625 . . . . 3.0800000000000001 110.653 179.894 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -116.83 -8.8 11.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.79 -0.641 . . . . 2.2599999999999998 110.799 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.402 ' O ' ' HG3' ' A' ' 36' ' ' MET . 0.8 OUTLIER -55.64 -48.09 75.55 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.155 -0.475 . . . . 1.3700000000000001 110.228 179.916 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.595 ' HA2' HD11 ' A' ' 48' ' ' LEU . . . -56.1 -41.34 85.44 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.503 -0.856 . . . . 0.32000000000000001 111.485 179.28 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 77.3 m -65.54 -28.91 69.51 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.066 0.46 . . . . 0.31 110.314 179.069 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.48 HD12 ' CD1' ' A' ' 27' ' ' ILE . 0.2 OUTLIER -70.83 -35.07 72.31 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.751 -0.659 . . . . 1.24 110.593 -179.982 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.441 ' SD ' ' HG3' ' A' ' 43' ' ' PRO . 26.7 mtp -80.27 -21.62 42.53 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.224 -0.444 . . . . 1.1000000000000001 110.648 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -77.0 -37.33 55.3 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.069 -0.514 . . . . 2.6899999999999999 110.224 179.277 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 5.9 t -73.41 -12.17 60.72 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.802 -0.636 . . . . 1.0600000000000001 110.636 179.266 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 65.5 mt -111.86 155.71 23.18 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.798 -0.637 . . . . 1.26 110.366 -179.895 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -50.73 -18.12 2.49 Favored Glycine 0 CA--C 1.52 0.352 0 CA-C-N 115.929 -0.578 . . . . 0.68999999999999995 114.358 -178.737 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 26.7 mp0 -65.54 141.61 58.4 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 117.354 0.577 . . . . 1.97 111.352 -179.859 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 48.9 m-80 -129.29 72.65 81.96 Favored Pre-proline 0 C--N 1.331 -0.225 0 CA-C-N 116.196 -0.456 . . . . 2.6600000000000001 110.857 179.393 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.441 ' HG3' ' SD ' ' A' ' 36' ' ' MET . 29.4 Cg_endo -60.83 148.96 90.54 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.719 2.28 . . . . 0.51000000000000001 112.309 179.806 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 32.3 m -77.34 150.02 35.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.167 -0.469 . . . . 0.72999999999999998 110.6 179.565 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.409 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 1.0 OUTLIER -49.41 -55.23 13.79 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.573 0.225 . . . . 2.7000000000000002 111.483 -179.556 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -55.89 -42.79 76.49 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.443 -0.344 . . . . 0.46000000000000002 111.735 -179.497 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -62.29 -53.89 48.62 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.375 -0.375 . . . . 2.23 110.95 -179.57 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.595 HD11 ' HA2' ' A' ' 33' ' ' GLY . 14.5 tp -55.57 -42.22 74.42 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.009 -0.541 . . . . 1.3600000000000001 111.168 -179.745 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.409 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 85.2 mm-40 -69.27 -32.13 71.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.47 -0.332 . . . . 1.22 111.281 -179.686 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 76.6 m-20 -70.62 -51.5 27.7 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.527 -0.306 . . . . 0.62 111.638 -179.727 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.489 HD21 ' HA ' ' A' ' 48' ' ' LEU . 1.8 pp -65.85 -41.16 92.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.624 -0.262 . . . . 0.39000000000000001 111.508 -179.516 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 60.5 mt -62.79 -49.2 84.65 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-O 120.808 0.337 . . . . 0.5 110.477 179.51 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.77 -34.19 76.73 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.214 -0.448 . . . . 0.58999999999999997 110.381 179.471 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -63.85 -50.22 69.7 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.008 -0.542 . . . . 2.54 110.145 179.305 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -71.99 -14.59 61.93 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.93 -0.577 . . . . 0.53000000000000003 110.984 179.446 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -68.99 -55.4 10.98 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.303 -0.408 . . . . 1.95 111.301 -179.751 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 -97.03 48.58 1.05 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.033 0.444 . . . . 2.48 111.083 -179.757 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 32.3 m-80 -156.21 -41.31 0.08 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.721 -0.672 . . . . 2.48 110.719 179.887 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 12.4 m120 -115.17 23.33 12.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.967 -0.56 . . . . 2.0499999999999998 110.694 179.866 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 70.2 m-20 65.87 -78.21 0.04 OUTLIER 'General case' 0 C--O 1.232 0.178 0 CA-C-N 115.869 -0.605 . . . . 1.47 111.052 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -159.24 23.21 0.3 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.671 -0.776 . . . . 0.42999999999999999 112.729 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.667 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 11.3 mm-40 -126.93 155.19 43.47 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.348 0.594 . . . . 0.38 111.639 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.492 HD13 ' N ' ' A' ' 64' ' ' ASN . 1.2 tm? -121.97 148.25 45.03 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.108 -0.951 . . . . 1.4299999999999999 109.002 -179.714 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ASN . . . . . 0.518 ' OD1' ' HE3' ' A' ' 26' ' ' LYS . 0.1 OUTLIER -111.35 155.67 22.75 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.587 -0.445 . . . . 1.1899999999999999 111.965 -178.561 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.482 ' O ' ' HB2' ' A' ' 69' ' ' CYS . 70.0 t80 -51.99 -31.52 29.83 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.638 -0.71 . . . . 0.40000000000000002 110.713 179.491 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -77.13 -36.6 55.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.327 -0.397 . . . . 0.81000000000000005 111.868 -179.914 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -63.68 -46.46 85.44 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 110.043 -0.354 . . . . 1.3600000000000001 110.043 179.767 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.451 ' HE2' ' HB2' ' A' ' 12' ' ' PHE . 31.0 t80 -68.44 -51.52 42.76 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.183 -0.462 . . . . 0.51000000000000001 110.472 179.263 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.482 ' HB2' ' O ' ' A' ' 65' ' ' PHE . 2.1 t -53.43 -45.86 69.57 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-O 120.945 0.402 . . . . 0.75 110.121 179.739 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -52.61 -51.27 44.84 Favored Glycine 0 N--CA 1.448 -0.542 0 CA-C-N 115.666 -0.697 . . . . 0.40999999999999998 111.68 179.463 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.472 ' HA ' ' HG2' ' A' ' 74' ' ' LYS . 13.0 mt -61.9 -39.44 83.57 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.316 0 CA-C-O 121.026 0.441 . . . . 0.51000000000000001 110.602 179.429 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 3.4 mtp -57.88 -30.21 65.66 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.802 -0.635 . . . . 1.01 110.096 179.618 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.25 -45.72 65.87 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.965 -0.561 . . . . 0.69999999999999996 110.799 179.694 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.472 ' HG2' ' HA ' ' A' ' 71' ' ' ILE . 58.2 pttt -75.52 -25.46 57.26 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.194 -0.457 . . . . 1.3799999999999999 111.767 -179.667 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 75' ' ' GLN . . . . . 0.43 HE21 ' HB2' ' A' ' 75' ' ' GLN . 4.4 tt0 -82.53 -43.95 16.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.056 0.455 . . . . 1.98 110.851 -179.533 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' MET . . . . . 0.433 ' SD ' HD23 ' A' ' 4' ' ' LEU . 29.0 mtt . . . . . 0 C--N 1.325 -0.472 0 CA-C-N 115.787 -0.642 . . . . 1.2 111.41 179.751 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.577 ' O ' ' HG3' ' A' ' 85' ' ' MET . 61.9 m . . . . . 0 N--CA 1.469 0.501 0 N-CA-C 111.993 0.368 . . . . 7.29 111.993 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.459 ' HA ' ' SD ' ' A' ' 85' ' ' MET . 38.6 tt0 -44.88 -41.73 7.39 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.002 -0.544 . . . . 9.7400000000000002 112.456 -179.163 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -55.92 -54.02 49.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.786 0.327 . . . . 12.109999999999999 111.623 -179.372 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.528 ' H ' HG22 ' A' ' 81' ' ' THR . 37.0 tt0 -63.24 -18.75 63.89 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.305 -0.407 . . . . 10.869999999999999 111.386 -179.467 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 85' ' ' MET . . . . . 0.577 ' HG3' ' O ' ' A' ' 81' ' ' THR . 6.6 mtp -74.74 -35.62 62.62 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-O 121.185 0.517 . . . . 11.09 109.894 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 15.9 ttm180 -68.63 -51.46 41.97 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.542 -0.754 . . . . 15.52 110.295 179.457 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.438 ' HA ' ' HD3' ' A' ' 90' ' ' LYS . 16.2 mm-40 -58.41 -39.16 78.98 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.11 -0.496 . . . . 14.85 110.501 179.32 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -69.87 -33.02 71.68 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.006 -0.543 . . . . 14.109999999999999 110.568 179.543 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 52.8 t80 -66.78 -29.05 68.9 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.949 -0.568 . . . . 15.73 110.234 179.594 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' LYS . . . . . 0.438 ' HD3' ' HA ' ' A' ' 87' ' ' GLU . 24.9 mtpp -73.32 -46.48 49.19 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.475 -0.784 . . . . 17.66 110.945 179.783 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 75.2 mt -58.6 -50.52 78.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.164 -0.471 . . . . 18.149999999999999 111.245 -179.751 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.553 ' HD1' HG11 ' A' ' 108' ' ' VAL . 22.3 m-85 -64.08 -43.4 95.51 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.36 -0.382 . . . . 18.34 110.976 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 30.7 t0 -64.47 93.28 0.1 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.997 0.427 . . . . 19.289999999999999 110.297 179.621 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -56.48 -29.42 61.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.778 -0.646 . . . . 22.25 111.532 -179.269 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -101.12 177.97 4.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.874 0.369 . . . . 23.34 111.028 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -101.0 0.27 54.99 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.949 -0.643 . . . . 22.0 112.002 179.364 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -70.36 -22.36 62.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.701 0.286 . . . . 22.280000000000001 111.659 -179.691 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 86.39 45.45 5.56 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.705 -0.76 . . . . 19.93 112.492 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' PHE . . . . . 0.43 ' HA ' ' O ' ' A' ' 136' ' ' ILE . 99.6 m-85 -147.64 138.86 23.62 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.595 0.236 . . . . 20.300000000000001 111.04 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 53.7 mt -114.13 117.43 55.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 121.009 0.433 . . . . 19.370000000000001 110.756 179.407 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 68.1 m -114.11 157.32 42.49 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 115.736 -0.666 . . . . 22.489999999999998 111.046 -179.296 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' PRO . . . . . 0.434 ' HG3' HD12 ' A' ' 125' ' ' ILE . 94.4 Cg_exo -41.45 -36.57 2.92 Favored 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 122.602 2.201 . . . . 23.0 112.742 -179.832 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.32 -40.9 81.52 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.161 -0.472 . . . . 24.559999999999999 111.17 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 104' ' ' GLU . . . . . 0.487 ' O ' HG12 ' A' ' 108' ' ' VAL . 43.2 mt-10 -78.02 -22.85 48.64 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.835 -0.62 . . . . 22.23 109.878 -179.473 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.563 HD22 ' HB ' ' A' ' 121' ' ' ILE . 3.4 tt -77.0 -43.04 36.3 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 115.215 -0.902 . . . . 20.359999999999999 111.128 -179.445 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.414 ' O ' HG13 ' A' ' 110' ' ' ILE . 54.2 ttt180 -66.57 -48.27 70.15 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.468 -0.333 . . . . 27.190000000000001 110.346 179.463 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 8.5 m-85 -55.86 -50.69 69.9 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.159 -0.473 . . . . 25.359999999999999 111.492 -179.681 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.553 HG11 ' HD1' ' A' ' 92' ' ' PHE . 9.3 p -63.99 -43.13 97.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.582 0.229 . . . . 21.059999999999999 111.568 -179.623 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.472 ' N ' HG13 ' A' ' 108' ' ' VAL . 9.0 mmt -58.98 -43.19 91.37 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 120.773 0.32 . . . . 20.93 111.013 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.414 HG13 ' O ' ' A' ' 106' ' ' ARG . 90.9 mt -67.33 -21.6 28.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.144 -0.48 . . . . 25.129999999999999 110.313 179.704 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 84.1 m-20 -79.74 -37.64 35.06 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.861 -0.609 . . . . 23.32 110.495 179.345 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.451 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 58.2 mt -59.64 -36.02 75.54 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.103 -0.499 . . . . 21.07 110.422 179.754 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 133.84 -15.88 4.55 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.858 -0.687 . . . . 23.050000000000001 112.22 -179.808 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -93.62 165.2 12.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.863 0.363 . . . . 22.59 111.227 -179.689 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -124.07 128.06 48.76 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.064 -0.517 . . . . 27.960000000000001 110.676 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 116' ' ' VAL . . . . . 0.424 ' HB ' HG23 ' A' ' 121' ' ' ILE . 2.8 m -135.57 146.79 29.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.207 -0.451 . . . . 24.75 111.624 -179.885 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 59.5 p -89.32 147.15 24.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.734 -0.666 . . . . 27.239999999999998 110.223 179.331 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -53.74 -19.04 3.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.21 -0.45 . . . . 26.629999999999999 111.411 -179.521 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -78.5 -54.64 5.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.405 -0.362 . . . . 29.140000000000001 111.575 -179.51 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 120' ' ' GLU . . . . . 0.413 ' OE1' HG12 ' A' ' 116' ' ' VAL . 14.0 pt-20 -61.46 -37.92 85.34 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.557 -0.292 . . . . 24.190000000000001 111.769 -179.063 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.563 ' HB ' HD22 ' A' ' 105' ' ' LEU . 47.8 pt -74.32 -35.88 41.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 C-N-CA 120.689 -0.404 . . . . 22.329999999999998 111.062 179.99 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -58.72 -37.6 76.5 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.915 0.388 . . . . 24.289999999999999 110.365 179.251 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -69.53 -47.1 64.85 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.912 -0.585 . . . . 24.739999999999998 110.709 179.693 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 56.5 ttp -53.37 -38.71 63.59 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 116.246 -0.433 . . . . 19.710000000000001 110.76 179.658 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.535 HG23 HD11 ' A' ' 136' ' ' ILE . 79.7 mt -67.42 -42.99 87.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.118 -0.492 . . . . 19.949999999999999 110.473 179.686 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 3.2 tmt_? -61.87 -30.52 70.92 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.989 -0.551 . . . . 24.949999999999999 110.942 179.793 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -69.87 -28.01 65.29 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.354 -0.385 . . . . 18.690000000000001 111.127 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.652 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -104.66 -6.73 20.17 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.087 -0.506 . . . . 16.469999999999999 111.347 -179.808 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 129' ' ' ASP . . . . . 0.409 ' OD1' ' N ' ' A' ' 132' ' ' GLY . 3.0 t0 -112.36 105.0 13.18 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.033 0.444 . . . . 20.399999999999999 111.431 -179.102 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 74.3 m-85 -71.51 -7.58 48.44 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.749 -0.659 . . . . 21.43 111.031 179.597 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -128.21 -7.62 5.35 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.091 -0.504 . . . . 23.370000000000001 110.718 179.914 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 132' ' ' GLY . . . . . 0.412 ' O ' ' N ' ' A' ' 134' ' ' GLY . . . 61.31 -84.93 0.03 OUTLIER Glycine 0 N--CA 1.447 -0.607 0 CA-C-N 115.703 -0.68 . . . . 24.32 112.049 -179.484 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 133' ' ' ASP . . . . . 0.474 ' O ' ' HG3' ' A' ' 135' ' ' MET . 0.8 OUTLIER 44.08 17.14 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 123.43 0.692 . . . . 23.879999999999999 111.809 -179.669 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 134' ' ' GLY . . . . . 0.412 ' N ' ' O ' ' A' ' 132' ' ' GLY . . . 53.33 23.56 19.01 Favored Glycine 0 CA--C 1.522 0.487 0 CA-C-N 115.923 -0.58 . . . . 22.670000000000002 114.085 179.547 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 135' ' ' MET . . . . . 0.474 ' HG3' ' O ' ' A' ' 133' ' ' ASP . 40.3 mtp -145.35 142.73 29.65 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 117.431 0.616 . . . . 22.91 110.828 179.408 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.61 HG23 ' HB2' ' A' ' 140' ' ' GLU . 29.9 mm -113.56 146.82 17.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 121.233 0.539 . . . . 18.41 111.586 -179.091 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -114.65 156.96 23.77 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.413 -0.812 . . . . 16.82 109.525 179.025 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 49.1 t80 -43.14 -21.48 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 111.789 0.292 . . . . 14.65 111.789 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -80.95 -56.35 4.17 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 120.949 0.404 . . . . 14.82 111.032 -179.517 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.61 ' HB2' HG23 ' A' ' 136' ' ' ILE . 58.6 mt-10 -61.9 -32.79 73.2 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.216 0.532 . . . . 17.460000000000001 110.104 179.797 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.455 ' CZ ' HG21 ' A' ' 145' ' ' ILE . 81.2 t80 -65.28 -54.15 33.48 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.586 -0.734 . . . . 12.93 109.854 178.951 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.524 HG13 ' SD ' ' A' ' 85' ' ' MET . 2.5 t -48.89 -35.21 6.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.39 -0.823 . . . . 10.699999999999999 111.555 179.265 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 143' ' ' TRP . . . . . 0.511 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 92.0 t90 -69.27 -55.94 9.03 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.588 0.588 . . . . 13.66 112.588 -179.066 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 144' ' ' MET . . . . . 0.652 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 21.9 ptt? -64.26 -24.93 67.84 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 113.324 0.861 . . . . 14.5 113.324 -177.674 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 145' ' ' ILE . . . . . 0.534 HG13 ' N ' ' A' ' 146' ' ' SER . 39.7 pt -80.61 -38.27 17.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 111.993 0.368 . . . . 11.25 111.993 -179.51 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 146' ' ' SER . . . . . 0.534 ' N ' HG13 ' A' ' 145' ' ' ILE . 39.9 t -59.67 -13.55 10.25 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.225 0.536 . . . . 8.5399999999999991 110.559 -179.883 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 147' ' ' GLN . . . . . 0.511 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 1.5 mm100 -94.51 -22.8 18.0 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.402 -0.817 . . . . 11.869999999999999 111.032 -179.152 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 99.1 mttt . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.223 -0.894 . . . . 13.68 111.003 179.808 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 18.5 mt . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.863 0.364 . . . . 1.27 110.684 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.55 HG22 ' H ' ' A' ' 6' ' ' GLU . 0.2 OUTLIER -84.87 176.17 8.66 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.006 -0.543 . . . . 1.1200000000000001 110.857 -179.813 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.55 ' H ' HG22 ' A' ' 5' ' ' THR . 33.6 tt0 -62.59 -37.75 87.42 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.251 0.548 . . . . 2.2000000000000002 110.32 179.883 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -75.38 -45.76 37.17 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.377 -0.829 . . . . 1.3500000000000001 110.923 -179.634 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -62.46 -45.73 91.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.056 -0.52 . . . . 2.2200000000000002 110.909 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.543 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 80.7 mt -57.46 -54.74 27.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.123 -0.49 . . . . 0.54000000000000004 111.096 179.926 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.78 -24.08 65.5 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.246 -0.434 . . . . 0.5 111.88 -179.525 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -72.54 -56.19 5.76 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 112.135 0.42 . . . . 2.27 112.135 -179.08 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.543 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 5.2 p90 -76.98 -24.29 52.26 Favored 'General case' 0 C--N 1.332 -0.158 0 C-N-CA 120.614 -0.434 . . . . 0.37 110.728 -179.591 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.429 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 18.6 tptp -65.62 -39.77 91.85 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.259 -0.645 . . . . 1.23 109.259 178.87 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.456 ' O ' HG22 ' A' ' 17' ' ' VAL . 17.9 t70 -68.1 -44.33 76.47 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 108.994 -0.743 . . . . 0.44 108.994 177.979 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.09 -15.11 62.8 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 115.249 -0.887 . . . . 0.28999999999999998 110.42 179.275 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.429 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 74.1 t80 -79.6 -48.28 14.04 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.821 -0.627 . . . . 0.47999999999999998 110.527 -179.734 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.456 HG22 ' O ' ' A' ' 14' ' ' ASP . 30.1 m -66.01 -23.1 31.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 121.0 0.428 . . . . 1.1100000000000001 110.253 179.822 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.45 ' HG2' ' O ' ' A' ' 14' ' ' ASP . 26.5 mm-40 -57.02 -45.79 82.82 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 115.791 -0.641 . . . . 1.6000000000000001 111.799 179.358 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -85.63 22.5 1.58 Allowed 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 112.053 0.39 . . . . 0.64000000000000001 112.053 -179.252 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -120.87 78.82 1.43 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.026 0.441 . . . . 0.44 110.815 179.646 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 11.4 mmmm -89.86 -24.71 21.33 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.854 -0.612 . . . . 2.1000000000000001 110.999 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -67.54 -35.66 79.48 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.963 -0.562 . . . . 1.8 111.23 -179.608 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 101.83 3.51 52.17 Favored Glycine 0 C--N 1.331 0.255 0 C-N-CA 120.686 -0.768 . . . . 0.46000000000000002 112.819 179.847 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 53.6 p -80.2 7.12 10.02 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.731 0.3 . . . . 0.40000000000000002 111.202 179.885 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 56.96 19.42 30.11 Favored Glycine 0 C--N 1.333 0.405 0 C-N-CA 120.746 -0.74 . . . . 0.33000000000000002 111.986 -179.611 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.41 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 29.6 mtpt -126.34 155.7 41.64 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.696 0.284 . . . . 1.1000000000000001 111.104 -179.593 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.466 HG13 ' HB2' ' A' ' 63' ' ' LEU . 41.3 pt -114.69 130.12 69.64 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 CA-C-O 120.915 0.388 . . . . 0.5 111.591 -179.843 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -54.53 134.36 46.35 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.091 -0.504 . . . . 0.29999999999999999 111.161 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.486 ' HA ' HD11 ' A' ' 63' ' ' LEU . 6.1 t -66.82 -8.22 27.15 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.055 -0.52 . . . . 1.03 111.053 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 53.9 mtp180 -89.34 -1.19 57.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.912 -0.586 . . . . 3.0800000000000001 110.491 179.652 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -127.62 2.05 6.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.808 -0.633 . . . . 2.2599999999999998 110.971 -179.658 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.464 HD21 ' CD1' ' A' ' 68' ' ' PHE . 2.7 tm? -57.09 -51.8 67.82 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.396 -0.365 . . . . 1.3700000000000001 110.581 -179.791 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.466 ' O ' ' HG3' ' A' ' 37' ' ' ARG . . . -55.55 -44.22 85.75 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.376 -0.916 . . . . 0.32000000000000001 111.443 179.236 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 87.9 m -56.32 -36.17 68.41 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.105 0.478 . . . . 0.31 110.22 179.124 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.449 ' HB3' ' O ' ' A' ' 32' ' ' LEU . 42.2 tp -65.92 -32.4 73.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.635 -0.712 . . . . 1.24 110.347 179.483 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 16.6 mtp -80.91 -20.17 42.72 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.744 -0.662 . . . . 1.1000000000000001 110.812 179.793 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.466 ' HG3' ' O ' ' A' ' 33' ' ' GLY . 71.8 mtp180 -74.72 -43.36 55.47 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.344 -0.389 . . . . 2.6899999999999999 110.646 179.753 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.3 t -65.74 -14.0 60.45 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.168 -0.469 . . . . 1.0600000000000001 110.981 179.658 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.507 ' HB3' ' OE1' ' A' ' 41' ' ' GLN . 9.7 mp -113.9 156.14 24.5 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.028 -0.533 . . . . 1.26 110.539 179.491 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -55.15 -7.37 1.14 Allowed Glycine 0 CA--C 1.521 0.455 0 N-CA-C 114.931 0.732 . . . . 0.68999999999999995 114.931 -178.497 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.507 ' OE1' ' HB3' ' A' ' 39' ' ' LEU . 16.0 mp0 -59.44 -79.72 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 117.86 0.83 . . . . 1.97 110.998 179.697 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 53.69 74.24 0.79 Allowed Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.216 -0.447 . . . . 2.6600000000000001 111.118 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -71.42 -167.76 0.31 Allowed 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.509 2.14 . . . . 0.51000000000000001 112.442 179.79 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.9 m -86.27 157.16 19.99 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.125 -0.489 . . . . 0.72999999999999998 110.934 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -61.32 -55.05 36.1 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.677 0.275 . . . . 2.7000000000000002 111.056 -179.745 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.57 -53.09 56.66 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.216 -0.447 . . . . 0.46000000000000002 111.374 -179.843 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -54.87 -41.66 71.1 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.207 -0.451 . . . . 2.23 110.247 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.451 ' HA ' HD21 ' A' ' 51' ' ' LEU . 27.3 tp -60.61 -39.44 88.19 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.722 -0.672 . . . . 1.3600000000000001 110.641 179.68 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 86.2 mm-40 -70.49 -30.8 67.68 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.145 -0.48 . . . . 1.22 110.823 179.769 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 30.4 m-20 -67.08 -49.31 65.48 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.208 -0.451 . . . . 0.62 111.481 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.451 HD21 ' HA ' ' A' ' 48' ' ' LEU . 1.0 OUTLIER -71.06 -38.96 72.49 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.637 -0.256 . . . . 0.39000000000000001 111.401 -179.586 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 73.4 mt -65.88 -32.19 57.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 120.74 0.305 . . . . 0.5 110.636 179.607 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -68.66 -50.8 48.29 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.254 -0.43 . . . . 0.58999999999999997 110.839 179.695 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -65.24 -32.91 74.82 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.892 0.377 . . . . 2.54 110.277 179.526 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ALA . . . . . 0.45 ' HB1' HD21 ' A' ' 63' ' ' LEU . . . -79.85 -14.83 58.37 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.044 -0.525 . . . . 0.53000000000000003 110.838 179.415 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -70.09 -39.41 75.6 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.189 -0.459 . . . . 1.95 110.84 179.838 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -82.64 -22.83 34.53 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.145 -0.48 . . . . 2.48 110.969 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -91.42 136.74 32.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.201 -0.454 . . . . 2.48 111.015 -179.899 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ASN . . . . . 0.418 ' C ' ' H ' ' A' ' 61' ' ' GLY . 88.0 m-20 64.01 6.46 2.85 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.957 -0.565 . . . . 2.0499999999999998 111.362 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 12.4 m120 71.01 -27.03 0.17 Allowed 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 112.474 0.546 . . . . 1.47 112.474 179.244 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' GLY . . . . . 0.418 ' H ' ' C ' ' A' ' 59' ' ' ASN . . . 160.91 34.97 0.02 OUTLIER Glycine 0 C--N 1.33 0.23 0 C-N-CA 120.301 -0.952 . . . . 0.42999999999999999 112.933 -179.937 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.41 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 9.7 mm-40 -141.65 154.69 45.52 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.929 0.395 . . . . 0.38 111.167 179.663 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.486 HD11 ' HA ' ' A' ' 29' ' ' THR . 17.9 mt -127.96 153.84 46.26 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.876 -0.602 . . . . 1.4299999999999999 110.332 179.908 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -113.43 156.99 22.5 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 110.288 -0.264 . . . . 1.1899999999999999 110.288 -179.91 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.494 ' O ' ' HB2' ' A' ' 69' ' ' CYS . 77.6 t80 -44.32 -34.6 2.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.813 0.34 . . . . 0.40000000000000002 110.44 179.339 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.97 -33.7 57.62 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.088 -0.505 . . . . 0.81000000000000005 111.926 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -64.67 -50.13 68.27 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.012 0.434 . . . . 1.3600000000000001 110.062 179.208 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.466 ' HE2' ' HB2' ' A' ' 12' ' ' PHE . 31.3 t80 -64.8 -53.54 45.26 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.902 -0.59 . . . . 0.51000000000000001 110.518 179.64 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.494 ' HB2' ' O ' ' A' ' 65' ' ' PHE . 0.1 OUTLIER -55.13 -41.38 71.65 Favored 'General case' 0 CA--C 1.521 -0.168 0 CA-C-O 120.827 0.346 . . . . 0.75 110.429 179.691 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -53.06 -46.56 61.58 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.791 -0.718 . . . . 0.40999999999999998 111.392 179.375 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.492 HG23 ' CE ' ' A' ' 74' ' ' LYS . 11.3 mt -65.15 -38.53 82.91 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.421 0 CA-C-O 120.936 0.398 . . . . 0.51000000000000001 110.314 178.979 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' MET . . . . . 0.5 ' O ' ' HG3' ' A' ' 76' ' ' MET . 79.4 mmm -61.99 -30.58 71.04 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.075 -0.511 . . . . 1.01 109.796 179.282 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -67.82 -43.31 79.9 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.807 -0.633 . . . . 0.69999999999999996 110.278 179.512 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.492 ' CE ' HG23 ' A' ' 71' ' ' ILE . 64.1 pttt -75.63 -29.83 59.3 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.32 -0.4 . . . . 1.3799999999999999 110.762 179.572 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 4.6 tt0 -73.0 -55.95 5.82 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.306 -0.406 . . . . 1.98 110.794 179.426 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' MET . . . . . 0.5 ' HG3' ' O ' ' A' ' 72' ' ' MET . 43.1 mtt . . . . . 0 N--CA 1.445 -0.712 0 CA-C-O 120.933 0.397 . . . . 1.2 110.584 179.375 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.474 ' O ' ' HG3' ' A' ' 85' ' ' MET . 2.6 t . . . . . 0 N--CA 1.469 0.503 0 CA-C-O 120.987 0.422 . . . . 7.29 111.736 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.49 ' HA ' ' SD ' ' A' ' 85' ' ' MET . 11.7 pt-20 -80.16 -15.85 56.16 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.044 -0.526 . . . . 9.7400000000000002 112.29 -178.895 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -59.74 -55.71 30.87 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 120.988 0.423 . . . . 12.109999999999999 110.991 -179.829 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -67.99 -15.76 63.75 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.976 -0.556 . . . . 10.869999999999999 110.558 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' MET . . . . . 0.555 ' SD ' HG13 ' A' ' 142' ' ' VAL . 8.5 mtt -80.4 -34.44 36.29 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.089 -0.505 . . . . 11.09 110.302 -179.875 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 37.3 ttt180 -68.78 -46.76 67.89 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.747 -0.66 . . . . 15.52 109.875 179.454 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.464 ' O ' HG12 ' A' ' 91' ' ' ILE . 38.3 tt0 -59.45 -45.19 92.3 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.886 -0.597 . . . . 14.85 109.818 178.981 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.88 -35.28 80.64 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.832 -0.622 . . . . 14.109999999999999 111.074 179.755 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -58.55 -39.2 79.57 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.099 0.476 . . . . 15.73 110.237 179.637 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 58.7 mttp -68.41 -40.1 81.4 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.665 -0.698 . . . . 17.66 110.682 179.497 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.464 HG12 ' O ' ' A' ' 87' ' ' GLU . 42.0 mm -60.06 -38.54 77.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.086 -0.506 . . . . 18.149999999999999 111.287 -179.826 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.573 ' HA ' HG21 ' A' ' 108' ' ' VAL . 12.8 m-85 -79.21 -35.37 41.78 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.386 -0.37 . . . . 18.34 111.333 -179.798 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 46.4 t0 -79.22 108.16 12.51 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.9 0.381 . . . . 19.289999999999999 110.946 -179.64 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.13 -9.55 58.82 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.979 -0.555 . . . . 22.25 111.313 -179.639 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.433 ' HB2' ' OD1' ' A' ' 97' ' ' ASP . 22.0 m-20 -117.18 168.08 10.62 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.888 0.375 . . . . 23.34 110.85 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -99.76 5.28 58.19 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.781 -0.723 . . . . 22.0 112.081 179.659 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.453 ' OD2' ' HB2' ' A' ' 99' ' ' PHE . 6.0 p-10 -63.27 -39.66 95.23 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.726 0.298 . . . . 22.280000000000001 111.061 -179.612 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 110.99 15.71 10.51 Favored Glycine 0 C--N 1.332 0.324 0 C-N-CA 120.659 -0.781 . . . . 19.93 112.921 179.727 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' PHE . . . . . 0.453 ' HB2' ' OD2' ' A' ' 97' ' ' ASP . 82.3 m-85 -139.69 152.12 46.45 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.892 0.377 . . . . 20.300000000000001 111.263 179.795 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.449 ' HB ' ' HB ' ' A' ' 136' ' ' ILE . 63.5 mt -114.68 132.13 64.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 115.964 -0.562 . . . . 19.370000000000001 110.8 179.71 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 35.2 p -114.35 155.96 45.06 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.206 -0.452 . . . . 22.489999999999998 110.756 -179.841 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_exo -40.54 -37.6 2.2 Favored 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 122.586 2.191 . . . . 23.0 112.567 -179.842 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.07 -49.52 77.02 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.131 0.491 . . . . 24.559999999999999 110.59 179.461 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 104' ' ' GLU . . . . . 0.432 ' O ' HG23 ' A' ' 108' ' ' VAL . 40.8 mt-10 -69.46 -32.75 71.88 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.612 -0.722 . . . . 22.23 110.694 179.922 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.55 HD12 HD12 ' A' ' 121' ' ' ILE . 3.4 tm? -62.24 -56.03 22.56 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.018 -0.537 . . . . 20.359999999999999 110.359 -179.775 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 3.2 ttp180 -56.06 -40.59 73.77 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.193 -0.458 . . . . 27.190000000000001 111.03 179.712 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -58.38 -46.9 85.47 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.189 0.44 . . . . 25.359999999999999 112.189 -179.316 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.573 HG21 ' HA ' ' A' ' 92' ' ' PHE . 17.6 t -78.77 -54.06 12.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 N-CA-C 111.967 0.358 . . . . 21.059999999999999 111.967 -179.1 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.495 ' HG3' ' CD1' ' A' ' 105' ' ' LEU . 1.1 mmt -47.03 -22.22 0.31 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 120.706 0.289 . . . . 20.93 111.4 -179.77 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 78.1 mt -95.26 -38.83 9.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 121.023 0.439 . . . . 25.129999999999999 110.354 178.88 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -58.57 -33.16 69.63 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.681 -0.69 . . . . 23.32 110.893 179.858 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.534 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 19.1 mt -66.7 -24.93 66.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.139 -0.482 . . . . 21.07 110.832 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 117.34 -7.99 15.92 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.945 -0.645 . . . . 23.050000000000001 112.49 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -82.54 127.43 33.32 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.718 0.294 . . . . 22.59 110.918 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -87.17 104.38 16.3 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.229 -0.441 . . . . 27.960000000000001 110.713 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 116' ' ' VAL . . . . . 0.483 ' HB ' HG23 ' A' ' 121' ' ' ILE . 3.2 m -123.42 149.94 27.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.158 -0.474 . . . . 24.75 111.504 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 117' ' ' THR . . . . . 0.453 ' O ' HG12 ' A' ' 121' ' ' ILE . 67.5 p -98.73 144.54 27.86 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.791 -0.64 . . . . 27.239999999999998 110.061 179.182 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 118' ' ' ASP . . . . . 0.464 ' HA ' HD11 ' A' ' 121' ' ' ILE . 5.7 m-20 -48.65 -23.08 0.9 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.051 -0.522 . . . . 26.629999999999999 111.775 -179.492 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -77.31 -55.74 5.15 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 111.743 0.275 . . . . 29.140000000000001 111.743 -179.394 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 120' ' ' GLU . . . . . 0.406 ' OE1' HG12 ' A' ' 116' ' ' VAL . 13.2 pt-20 -59.52 -38.43 80.96 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.624 -0.262 . . . . 24.190000000000001 111.588 -179.19 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.55 HD12 HD12 ' A' ' 105' ' ' LEU . 33.5 pt -73.15 -34.53 45.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 C-N-CA 120.996 -0.282 . . . . 22.329999999999998 111.515 -179.946 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 122' ' ' ASP . . . . . 0.415 ' N ' HG13 ' A' ' 121' ' ' ILE . 15.5 t70 -57.05 -46.23 82.61 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.91 -0.404 . . . . 24.289999999999999 109.91 179.513 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.86 -37.69 88.47 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.068 -0.515 . . . . 24.739999999999998 110.119 179.038 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 5.2 ttp -53.16 -48.41 68.01 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.034 -0.53 . . . . 19.710000000000001 110.676 179.237 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.418 HG23 HD11 ' A' ' 136' ' ' ILE . 76.8 mt -61.05 -43.13 95.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.026 -0.534 . . . . 19.949999999999999 110.449 179.711 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 29.3 ttm180 -61.76 -33.82 74.76 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.957 -0.565 . . . . 24.949999999999999 110.87 179.841 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -69.06 -19.17 64.08 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.983 -0.553 . . . . 18.690000000000001 111.171 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.634 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -113.5 -5.06 13.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.228 -0.442 . . . . 16.469999999999999 111.217 -179.922 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 18.9 t0 -107.02 101.61 11.02 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.071 0.462 . . . . 20.399999999999999 110.903 -179.679 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 85.6 m-85 -86.77 -42.72 13.1 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.797 -0.638 . . . . 21.43 111.374 -179.784 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -59.69 -23.72 63.35 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.314 -0.403 . . . . 23.370000000000001 110.909 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 64.25 78.21 0.21 Allowed Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.857 -0.687 . . . . 24.32 112.739 179.632 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -143.38 6.56 1.49 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.844 0.354 . . . . 23.879999999999999 110.794 179.568 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 67.58 20.06 71.58 Favored Glycine 0 C--N 1.331 0.289 0 C-N-CA 120.87 -0.681 . . . . 22.670000000000002 112.698 179.888 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 72.8 mtp -136.76 155.24 50.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.805 0.336 . . . . 22.91 110.636 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.715 HG23 ' HB2' ' A' ' 140' ' ' GLU . 43.6 mm -114.7 144.76 21.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 121.163 0.506 . . . . 18.41 111.51 -179.566 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 137' ' ' ASN . . . . . 0.412 ' O ' ' N ' ' A' ' 139' ' ' GLU . 43.4 t30 -114.58 156.59 24.39 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.44 -0.8 . . . . 16.82 109.031 178.744 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 34.1 t80 -41.8 -24.07 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 120.864 0.364 . . . . 14.65 111.141 179.82 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 139' ' ' GLU . . . . . 0.412 ' N ' ' O ' ' A' ' 137' ' ' ASN . 47.3 mt-10 -81.02 -55.35 4.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.113 -0.494 . . . . 14.82 110.632 179.928 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.715 ' HB2' HG23 ' A' ' 136' ' ' ILE . 36.9 mt-10 -57.38 -29.22 63.89 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.905 -0.589 . . . . 17.460000000000001 110.487 179.786 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.648 ' HA ' ' HE2' ' A' ' 144' ' ' MET . 86.0 t80 -71.68 -55.57 7.45 Favored 'General case' 0 C--N 1.334 -0.108 0 CA-C-N 116.06 -0.518 . . . . 12.93 110.122 179.322 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.555 HG13 ' SD ' ' A' ' 85' ' ' MET . 6.7 t -46.69 -35.13 2.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 CA-C-N 115.748 -0.66 . . . . 10.699999999999999 111.507 179.217 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 143' ' ' TRP . . . . . 0.569 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 84.1 t90 -73.35 -55.82 5.89 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.215 0.45 . . . . 13.66 112.215 -179.092 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 144' ' ' MET . . . . . 0.648 ' HE2' ' HA ' ' A' ' 141' ' ' PHE . 20.1 ptt? -63.11 -19.97 64.93 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.916 0.709 . . . . 14.5 112.916 -177.884 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 145' ' ' ILE . . . . . 0.57 HG13 ' N ' ' A' ' 146' ' ' SER . 33.3 pt -81.44 -48.73 18.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 N-CA-C 112.02 0.378 . . . . 11.25 112.02 179.851 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 146' ' ' SER . . . . . 0.57 ' N ' HG13 ' A' ' 145' ' ' ILE . 29.3 t -63.95 -14.29 52.66 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-O 121.264 0.554 . . . . 8.5399999999999991 109.999 -179.711 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 147' ' ' GLN . . . . . 0.569 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 2.1 mm100 -124.67 18.25 8.74 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.188 -0.915 . . . . 11.869999999999999 110.268 -179.235 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 148' ' ' LYS . . . . . 0.549 ' HB2' ' HA ' ' A' ' 145' ' ' ILE . 14.8 ttpp . . . . . 0 C--O 1.249 1.043 0 CA-C-N 115.289 -0.869 . . . . 13.68 111.053 -179.684 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.499 HD13 ' SG ' ' A' ' 69' ' ' CYS . 72.5 mt . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.928 0.394 . . . . 1.27 110.631 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -77.79 166.62 22.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.986 -0.552 . . . . 1.1200000000000001 111.008 -179.653 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -52.52 -52.31 55.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.512 -0.313 . . . . 2.2000000000000002 111.677 179.822 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -68.58 -40.16 80.65 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.049 0.452 . . . . 1.3500000000000001 110.838 -179.374 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -60.63 -40.88 93.54 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.644 -0.707 . . . . 2.2200000000000002 111.014 -179.837 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.518 ' HA ' ' CZ ' ' A' ' 12' ' ' PHE . 72.7 mt -63.58 -49.4 82.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.264 -0.426 . . . . 0.54000000000000004 110.414 179.821 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.98 -18.96 65.63 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.949 -0.569 . . . . 0.5 110.849 179.658 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -71.76 -56.96 4.81 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 116.06 -0.518 . . . . 2.27 111.646 -179.117 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.518 ' CZ ' ' HA ' ' A' ' 9' ' ' ILE . 9.3 p90 -77.76 -26.65 49.97 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.595 -0.442 . . . . 0.37 110.751 -179.714 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.419 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 20.0 tptm -64.23 -36.71 84.97 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.234 -0.654 . . . . 1.23 109.234 178.639 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.423 ' O ' HG22 ' A' ' 17' ' ' VAL . 19.7 t70 -67.46 -48.18 67.95 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.772 -0.649 . . . . 0.44 109.393 178.374 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.18 -14.81 61.5 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.884 -0.598 . . . . 0.28999999999999998 110.952 179.002 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.419 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 36.9 t80 -79.16 -47.49 15.96 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.866 -0.606 . . . . 0.47999999999999998 110.807 -179.4 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.423 HG22 ' O ' ' A' ' 14' ' ' ASP . 31.6 m -70.18 -24.75 26.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.135 -0.484 . . . . 1.1100000000000001 110.849 -179.916 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.415 ' HG2' ' O ' ' A' ' 14' ' ' ASP . 76.6 mm-40 -60.58 -32.14 71.24 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.96 -0.564 . . . . 1.6000000000000001 111.365 179.816 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 20.5 m-85 -85.93 -20.96 28.2 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.569 -0.287 . . . . 0.64000000000000001 111.537 -179.57 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -80.19 90.13 5.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.934 0.397 . . . . 0.44 110.855 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 12.3 mmmm -100.18 4.49 44.43 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.03 -0.532 . . . . 2.1000000000000001 111.218 -179.688 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -99.41 -36.72 9.49 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.225 -0.443 . . . . 1.8 111.233 -179.434 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 96.85 30.06 7.75 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.774 -0.727 . . . . 0.46000000000000002 112.811 179.614 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 31.1 p -103.57 10.79 36.85 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.655 0.264 . . . . 0.40000000000000002 111.166 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.93 15.96 30.12 Favored Glycine 0 C--N 1.331 0.282 0 C-N-CA 120.715 -0.755 . . . . 0.33000000000000002 112.045 -179.67 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.508 ' HE3' ' HB3' ' A' ' 62' ' ' GLN . 5.1 mtmt -139.79 151.95 46.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.661 0.267 . . . . 1.1000000000000001 110.712 -179.769 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 50.3 pt -119.28 136.25 57.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.49 -0.323 . . . . 0.5 111.251 -179.839 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -50.39 125.9 13.81 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.356 -0.384 . . . . 0.29999999999999999 110.949 179.891 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 6.9 t -62.62 -16.15 55.23 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.119 -0.491 . . . . 1.03 111.036 -179.869 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 65.8 mtp180 -75.99 -18.79 59.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.082 -0.508 . . . . 3.0800000000000001 110.353 179.701 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -104.28 0.57 29.45 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.707 -0.678 . . . . 2.2599999999999998 110.478 179.621 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.419 ' O ' ' HG2' ' A' ' 36' ' ' MET . 0.9 OUTLIER -60.85 -49.49 77.26 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.025 -0.534 . . . . 1.3700000000000001 110.311 179.936 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.584 ' HA2' HD11 ' A' ' 48' ' ' LEU . . . -54.18 -39.17 63.24 Favored Glycine 0 C--N 1.332 0.343 0 C-N-CA 120.502 -0.856 . . . . 0.32000000000000001 111.347 179.077 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 94.2 m -66.24 -33.03 74.83 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.243 0.544 . . . . 0.31 109.963 178.882 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 65.6 tp -70.96 -20.68 62.42 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.536 -0.756 . . . . 1.24 110.701 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.419 ' HG2' ' O ' ' A' ' 32' ' ' LEU . 90.8 mmm -80.29 -49.64 11.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.259 -0.428 . . . . 1.1000000000000001 111.104 179.757 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 10.6 ptm180 -60.62 -34.39 74.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.446 -0.343 . . . . 2.6899999999999999 110.983 179.905 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 14.5 t -72.25 -13.16 61.45 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.065 0.46 . . . . 1.0600000000000001 110.611 179.295 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 86.1 mt -113.11 156.91 22.34 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.581 -0.736 . . . . 1.26 110.487 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -44.35 -31.73 2.42 Favored Glycine 0 CA--C 1.52 0.345 0 C-N-CA 120.686 -0.769 . . . . 0.68999999999999995 112.689 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -64.14 160.07 19.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.827 0.346 . . . . 1.97 110.965 179.762 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 17.6 p-10 -164.28 76.23 1.59 Allowed Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.153 -0.476 . . . . 2.6600000000000001 110.739 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -66.19 150.18 85.07 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.642 2.228 . . . . 0.51000000000000001 112.562 -179.712 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 19.6 m -71.29 157.06 38.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.04 -0.527 . . . . 0.72999999999999998 110.469 179.588 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.425 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 0.9 OUTLIER -48.48 -54.76 13.01 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 111.608 0.225 . . . . 2.7000000000000002 111.608 -179.703 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -48.16 -55.49 10.23 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.569 -0.287 . . . . 0.46000000000000002 111.749 -179.496 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -56.74 -48.44 77.78 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.318 -0.401 . . . . 2.23 110.564 -179.785 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.584 HD11 ' HA2' ' A' ' 33' ' ' GLY . 14.3 tp -57.26 -35.65 70.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.116 -0.493 . . . . 1.3600000000000001 110.888 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.425 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 37.0 mm-40 -72.57 -33.33 66.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.386 -0.37 . . . . 1.22 110.509 179.663 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 63.1 m-20 -69.31 -54.11 16.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.083 -0.508 . . . . 0.62 111.707 -179.725 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.54 HD21 ' HA ' ' A' ' 48' ' ' LEU . 1.2 pp -63.78 -44.08 94.44 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 112.077 0.399 . . . . 0.39000000000000001 112.077 -179.123 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 76.8 mt -64.1 -44.94 97.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.742 0.306 . . . . 0.5 111.081 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.77 -52.42 63.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.322 -0.399 . . . . 0.58999999999999997 111.152 -179.821 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -60.38 -34.05 73.34 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.423 -0.353 . . . . 2.54 110.637 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -77.78 -15.8 58.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.366 -0.379 . . . . 0.53000000000000003 110.914 179.553 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -80.3 -51.3 9.07 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.252 -0.431 . . . . 1.95 111.309 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 9.5 p30 -88.44 30.4 0.89 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.423 -0.353 . . . . 2.48 111.504 -179.416 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -149.34 -18.09 0.28 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.39 -0.368 . . . . 2.48 110.971 179.534 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -135.79 21.38 3.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.217 -0.447 . . . . 2.0499999999999998 110.731 179.887 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 65.7 m-20 61.49 -86.38 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.928 -0.578 . . . . 1.47 111.522 179.821 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -146.53 4.28 1.07 Allowed Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.564 -0.827 . . . . 0.42999999999999999 112.833 -179.683 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.508 ' HB3' ' HE3' ' A' ' 26' ' ' LYS . 9.8 mm-40 -114.96 150.41 35.79 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.03 0.443 . . . . 0.38 111.093 179.863 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.434 ' HG ' ' HB2' ' A' ' 67' ' ' GLU . 0.5 OUTLIER -118.02 153.02 34.38 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.603 -0.726 . . . . 1.4299999999999999 109.96 -179.939 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ASN . . . . . 0.454 ' OD1' ' N ' ' A' ' 64' ' ' ASN . 0.6 OUTLIER -112.59 156.49 22.59 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.648 0.261 . . . . 1.1899999999999999 111.304 -178.388 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -48.54 -38.93 21.71 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.142 -0.481 . . . . 0.40000000000000002 110.919 179.862 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.22 -33.07 71.23 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.502 -0.317 . . . . 0.81000000000000005 111.065 179.779 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.434 ' HB2' ' HG ' ' A' ' 63' ' ' LEU . 12.9 mm-40 -66.32 -47.42 73.57 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.312 0.577 . . . . 1.3600000000000001 109.547 178.616 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.42 ' HE2' ' HB2' ' A' ' 12' ' ' PHE . 27.1 t80 -63.3 -55.35 25.45 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.297 -0.865 . . . . 0.51000000000000001 110.504 179.282 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.499 ' SG ' HD13 ' A' ' 4' ' ' LEU . 0.5 OUTLIER -56.18 -39.1 71.86 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.001 -0.545 . . . . 0.75 110.222 179.609 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -53.27 -50.25 53.02 Favored Glycine 0 N--CA 1.451 -0.343 0 CA-C-N 115.637 -0.711 . . . . 0.40999999999999998 112.148 179.682 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.546 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 11.6 mt -65.48 -44.09 94.29 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.36 0 CA-C-O 121.136 0.494 . . . . 0.51000000000000001 110.66 179.632 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' MET . . . . . 0.456 ' O ' ' HB2' ' A' ' 76' ' ' MET . 21.4 mtp -53.27 -33.07 51.63 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.9 -0.591 . . . . 1.01 109.654 179.613 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.11 -44.63 68.6 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.99 -0.55 . . . . 0.69999999999999996 110.791 179.479 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.546 ' HG2' ' O ' ' A' ' 71' ' ' ILE . 0.0 OUTLIER -65.96 -33.25 75.38 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.394 -0.366 . . . . 1.3799999999999999 111.58 -179.355 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 -83.16 -55.42 4.36 Favored 'General case' 0 CA--C 1.521 -0.135 0 CA-C-O 121.235 0.541 . . . . 1.98 111.14 -179.153 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' MET . . . . . 0.456 ' HB2' ' O ' ' A' ' 72' ' ' MET . 84.0 mtp . . . . . 0 C--N 1.325 -0.461 0 CA-C-N 115.12 -0.946 . . . . 1.2 112.633 -178.82 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.507 ' O ' ' HG2' ' A' ' 85' ' ' MET . 5.2 t . . . . . 0 N--CA 1.469 0.497 0 CA-C-O 121.039 0.447 . . . . 7.29 111.64 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -41.33 -41.84 2.05 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.552 -0.749 . . . . 9.7400000000000002 112.743 -179.025 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -55.52 -53.37 57.25 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 111.861 0.319 . . . . 12.109999999999999 111.861 -179.171 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -64.26 -15.64 60.52 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.36 -0.382 . . . . 10.869999999999999 111.572 -179.308 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' MET . . . . . 0.507 ' HG2' ' O ' ' A' ' 81' ' ' THR . 13.3 mmm -81.02 -36.6 30.39 Favored 'General case' 0 CA--C 1.511 -0.537 0 CA-C-O 121.738 0.78 . . . . 11.09 109.304 -178.837 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 6.2 tpt180 -64.2 -52.67 57.75 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.246 -1.343 . . . . 15.52 110.353 179.351 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -58.6 -36.11 73.48 Favored 'General case' 0 C--O 1.233 0.187 0 N-CA-C 109.754 -0.462 . . . . 14.85 109.754 178.99 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.75 -36.47 80.6 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.049 -0.523 . . . . 14.109999999999999 110.589 178.688 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 94.7 t80 -72.3 -16.82 61.9 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 116.014 -0.539 . . . . 15.73 110.465 179.711 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 16.8 tttt -79.46 -49.03 12.92 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 115.572 -0.74 . . . . 17.66 110.684 -179.625 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 65.7 mt -71.71 -44.79 68.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.809 -0.632 . . . . 18.149999999999999 111.517 -179.708 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.566 ' HD1' HG11 ' A' ' 108' ' ' VAL . 2.5 m-85 -61.11 -44.29 97.58 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.396 -0.365 . . . . 18.34 111.314 -179.656 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 45.7 t0 -72.33 105.03 3.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.386 -0.37 . . . . 19.289999999999999 110.354 179.766 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.543 ' HG2' ' HB3' ' A' ' 104' ' ' GLU . 19.7 mmm180 -59.42 -53.79 54.07 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.007 -0.542 . . . . 22.25 110.933 -179.561 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.43 ' HB2' ' OD1' ' A' ' 97' ' ' ASP . 0.6 OUTLIER -86.24 170.82 11.76 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.068 -0.515 . . . . 23.34 110.722 -179.88 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -97.74 5.53 62.06 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.901 -0.666 . . . . 22.0 112.155 179.866 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.43 ' OD1' ' HB2' ' A' ' 95' ' ' ASP . 6.5 p-10 -56.97 -43.82 82.02 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.734 0.302 . . . . 22.280000000000001 111.109 -179.777 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 114.61 20.84 5.65 Favored Glycine 0 CA--C 1.518 0.241 0 C-N-CA 120.837 -0.697 . . . . 19.93 112.869 179.633 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' PHE . . . . . 0.408 ' HA ' ' O ' ' A' ' 136' ' ' ILE . 98.5 m-85 -144.98 145.76 31.66 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.785 0.326 . . . . 20.300000000000001 111.071 179.861 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 56.2 mt -114.6 130.4 69.03 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 CA-C-N 116.208 -0.451 . . . . 19.370000000000001 110.679 179.429 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 68.6 m -114.41 156.06 45.0 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-N 116.148 -0.478 . . . . 22.489999999999998 110.684 -179.666 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_exo -43.59 -37.55 8.2 Favored 'Trans proline' 0 C--N 1.349 0.564 0 C-N-CA 122.38 2.053 . . . . 23.0 112.492 -179.807 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -62.21 -43.5 98.68 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.096 0.474 . . . . 24.559999999999999 110.657 179.569 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 104' ' ' GLU . . . . . 0.543 ' HB3' ' HG2' ' A' ' 94' ' ' ARG . 43.8 mt-10 -73.82 -35.91 64.91 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.636 -0.711 . . . . 22.23 110.545 179.827 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.693 HD23 ' HB ' ' A' ' 121' ' ' ILE . 35.7 tp -60.75 -40.6 93.06 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.625 -0.716 . . . . 20.359999999999999 110.873 -179.606 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 8.7 ttm180 -69.98 -46.57 64.9 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.28 -0.418 . . . . 27.190000000000001 110.449 179.16 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -56.18 -41.83 76.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.992 -0.549 . . . . 25.359999999999999 111.58 -179.511 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.566 HG11 ' HD1' ' A' ' 92' ' ' PHE . 5.3 p -73.2 -49.23 39.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 C-N-CA 121.057 -0.257 . . . . 21.059999999999999 111.627 -179.516 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.464 ' N ' HG13 ' A' ' 108' ' ' VAL . 0.4 OUTLIER -50.5 -45.75 56.65 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.804 0.335 . . . . 20.93 110.667 179.936 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 42.4 mt -70.06 -30.16 42.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.174 -0.467 . . . . 25.129999999999999 110.185 179.31 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -68.18 -29.71 68.64 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.735 -0.666 . . . . 23.32 110.538 179.475 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.531 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 62.6 mt -72.97 -40.63 65.13 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.02 -0.536 . . . . 21.07 110.451 179.829 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 136.8 -1.59 3.21 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.941 -0.647 . . . . 23.050000000000001 112.331 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -117.02 130.73 56.87 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.926 0.393 . . . . 22.59 111.298 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 9.8 ptpp? -88.18 153.3 21.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.136 -0.484 . . . . 27.960000000000001 110.928 179.933 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 116' ' ' VAL . . . . . 0.435 ' HB ' HG23 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -152.1 155.6 6.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.03 -0.532 . . . . 24.75 111.314 -179.814 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 117' ' ' THR . . . . . 0.467 ' O ' HG12 ' A' ' 121' ' ' ILE . 73.0 p -94.42 138.41 32.39 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.935 -0.575 . . . . 27.239999999999998 110.186 179.671 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 118' ' ' ASP . . . . . 0.414 ' HA ' HD11 ' A' ' 121' ' ' ILE . 22.2 m-20 -50.0 -19.63 0.76 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.017 -0.538 . . . . 26.629999999999999 111.571 -179.49 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -77.48 -55.24 5.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.47 -0.332 . . . . 29.140000000000001 111.842 -179.414 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -62.48 -41.15 98.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.479 -0.328 . . . . 24.190000000000001 111.773 -179.091 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.693 ' HB ' HD23 ' A' ' 105' ' ' LEU . 15.1 pt -70.35 -38.14 73.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 C-N-CA 120.982 -0.287 . . . . 22.329999999999998 111.412 -179.431 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 122' ' ' ASP . . . . . 0.421 ' N ' HG13 ' A' ' 121' ' ' ILE . 17.0 t70 -63.16 -32.87 74.36 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.928 0.394 . . . . 24.289999999999999 110.27 179.303 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 22.3 mm-40 -65.79 -46.97 76.7 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.012 -0.54 . . . . 24.739999999999998 110.53 179.541 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 55.5 ttp -56.73 -39.14 73.4 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.084 -0.507 . . . . 19.710000000000001 110.853 179.526 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.42 HD11 HD22 ' A' ' 105' ' ' LEU . 66.6 mt -64.92 -42.05 93.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.983 0.421 . . . . 19.949999999999999 110.301 179.61 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 35.2 ttp180 -59.14 -46.12 89.18 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.745 -0.662 . . . . 24.949999999999999 110.875 179.517 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -63.43 -29.73 70.97 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.832 -0.622 . . . . 18.690000000000001 111.237 -179.551 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.603 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -91.48 -13.84 31.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.852 0.358 . . . . 16.469999999999999 111.079 179.829 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 129' ' ' ASP . . . . . 0.42 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 5.9 t70 -101.04 105.86 17.1 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.123 -0.49 . . . . 20.399999999999999 110.924 -179.723 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -89.6 -41.36 12.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.951 -0.568 . . . . 21.43 111.609 -179.6 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -59.95 -26.14 65.75 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.867 0.365 . . . . 23.370000000000001 110.769 -179.614 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 72.05 79.34 0.44 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.804 -0.712 . . . . 24.32 112.87 179.782 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 13.3 p-10 -138.83 -33.28 0.65 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.651 0.263 . . . . 23.879999999999999 111.031 179.641 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 108.21 7.91 29.99 Favored Glycine 0 N--CA 1.452 -0.233 0 C-N-CA 120.799 -0.715 . . . . 22.670000000000002 112.669 179.892 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 63.9 mtp -130.71 155.53 46.46 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.622 0.249 . . . . 22.91 110.508 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.566 HG23 ' HB2' ' A' ' 140' ' ' GLU . 46.6 mm -114.69 143.34 24.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 121.207 0.527 . . . . 18.41 111.973 -179.501 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 137' ' ' ASN . . . . . 0.443 ' O ' ' N ' ' A' ' 139' ' ' GLU . 28.9 p-10 -115.71 157.94 23.54 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.282 -0.872 . . . . 16.82 108.749 178.257 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.669 ' O ' HG23 ' A' ' 142' ' ' VAL . 48.7 t80 -39.33 -24.23 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 112.312 0.486 . . . . 14.65 112.312 -179.358 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 139' ' ' GLU . . . . . 0.443 ' N ' ' O ' ' A' ' 137' ' ' ASN . 12.8 mm-40 -80.77 -56.29 4.24 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 120.742 0.306 . . . . 14.82 111.45 -179.55 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.566 ' HB2' HG23 ' A' ' 136' ' ' ILE . 44.0 mt-10 -62.1 -25.57 67.79 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.149 0.499 . . . . 17.460000000000001 110.015 179.788 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.549 ' CE2' HD13 ' A' ' 145' ' ' ILE . 63.7 t80 -70.13 -55.29 9.78 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.618 -0.719 . . . . 12.93 110.111 179.235 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.669 HG23 ' O ' ' A' ' 138' ' ' TYR . 43.6 t -47.83 -44.21 10.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.697 -0.683 . . . . 10.699999999999999 111.463 179.736 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 84.2 t90 -63.77 -55.34 23.89 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.406 0.521 . . . . 13.66 112.406 -178.883 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 144' ' ' MET . . . . . 0.603 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 18.8 ptt? -61.31 -35.48 77.49 Favored 'General case' 0 N--CA 1.463 0.191 0 N-CA-C 112.726 0.639 . . . . 14.5 112.726 -177.921 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 145' ' ' ILE . . . . . 0.549 HD13 ' CE2' ' A' ' 141' ' ' PHE . 13.9 pt -76.53 -23.07 15.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 C-N-CA 120.809 -0.357 . . . . 11.25 111.721 -179.388 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 146' ' ' SER . . . . . 0.418 ' HB3' ' NE2' ' A' ' 147' ' ' GLN . 48.0 t -67.64 -29.84 69.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.99 0.424 . . . . 8.5399999999999991 110.245 179.945 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 147' ' ' GLN . . . . . 0.418 ' NE2' ' HB3' ' A' ' 146' ' ' SER . 13.9 mm-40 -91.61 -21.9 20.57 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.728 -0.669 . . . . 11.869999999999999 111.38 -179.759 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 148' ' ' LYS . . . . . 0.446 ' HG3' ' O ' ' A' ' 144' ' ' MET . 88.1 mttt . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.264 -0.874 . . . . 13.68 111.098 179.653 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.9 mp . . . . . 0 C--O 1.232 0.159 0 CA-C-O 120.699 0.285 . . . . 1.27 110.624 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -66.19 -153.71 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.846 0.355 . . . . 1.1200000000000001 111.242 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -80.3 -54.95 5.26 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.116 0.484 . . . . 2.2000000000000002 110.537 -179.561 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -70.29 -28.59 65.31 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.722 -0.672 . . . . 1.3500000000000001 110.199 179.812 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -66.57 -48.17 70.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.675 -0.693 . . . . 2.2200000000000002 110.565 179.575 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.541 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 64.5 mt -60.28 -40.68 84.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.08 -0.509 . . . . 0.54000000000000004 110.885 179.831 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -77.12 -18.79 57.66 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.979 0.418 . . . . 0.5 110.673 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -72.24 -56.26 5.83 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.865 -0.607 . . . . 2.27 111.751 -179.154 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.541 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 8.3 p90 -75.99 -26.83 57.1 Favored 'General case' 0 C--N 1.333 -0.152 0 C-N-CA 120.577 -0.449 . . . . 0.37 110.758 -179.843 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 26.1 tptp -64.12 -37.05 86.04 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 109.467 -0.568 . . . . 1.23 109.467 178.74 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -70.12 -46.79 64.06 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.857 -0.61 . . . . 0.44 109.691 178.666 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.69 -19.9 66.01 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.903 -0.59 . . . . 0.28999999999999998 110.392 179.246 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -79.4 -39.15 33.16 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.573 -0.739 . . . . 0.47999999999999998 110.522 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -71.57 -26.04 25.63 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.701 0 CA-C-N 115.939 -0.573 . . . . 1.1100000000000001 111.05 -179.888 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 82.2 mm-40 -61.13 -29.48 69.8 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.793 -0.64 . . . . 1.6000000000000001 111.357 -179.752 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 47.9 m-85 -93.16 -6.95 46.71 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.596 -0.275 . . . . 0.64000000000000001 111.338 -179.792 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -97.85 89.62 4.66 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.889 0.376 . . . . 0.44 110.697 179.395 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -99.52 -21.18 16.03 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.042 -0.526 . . . . 2.1000000000000001 111.266 -179.759 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -78.05 -11.08 59.88 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.262 -0.426 . . . . 1.8 111.193 -179.711 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.5 7.45 87.1 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.765 -0.731 . . . . 0.46000000000000002 112.814 179.702 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 76.2 p -76.67 5.36 7.68 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.674 0.273 . . . . 0.40000000000000002 111.146 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 56.15 23.84 41.58 Favored Glycine 0 C--N 1.332 0.331 0 C-N-CA 120.811 -0.709 . . . . 0.33000000000000002 111.73 -179.608 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.675 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 36.1 mtpt -136.09 155.87 49.56 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.725 0.298 . . . . 1.1000000000000001 111.346 -179.244 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.493 HG13 HD12 ' A' ' 63' ' ' LEU . 44.3 pt -117.93 129.8 73.77 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.2 0 CA-C-O 120.951 0.405 . . . . 0.5 111.367 179.876 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -52.47 141.3 20.33 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.186 -0.461 . . . . 0.29999999999999999 111.29 -179.732 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.511 ' HA ' HD11 ' A' ' 63' ' ' LEU . 38.7 p -66.69 -12.84 60.09 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.852 -0.613 . . . . 1.03 111.254 -179.896 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 39.0 mtp180 -89.43 5.34 45.73 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.974 -0.557 . . . . 3.0800000000000001 110.676 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -124.57 -7.92 7.43 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.081 -0.509 . . . . 2.2599999999999998 111.296 -179.537 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.669 HD23 HD13 ' A' ' 63' ' ' LEU . 1.2 tm? -56.15 -52.73 63.31 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.553 -0.294 . . . . 1.3700000000000001 110.746 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -53.95 -44.9 72.16 Favored Glycine 0 C--N 1.33 0.244 0 C-N-CA 120.598 -0.81 . . . . 0.32000000000000001 111.979 179.701 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 45.2 m -60.55 -32.52 71.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.037 0.446 . . . . 0.31 110.512 179.432 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -69.06 -31.36 70.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.815 -0.63 . . . . 1.24 110.701 -179.99 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.401 ' HG2' ' O ' ' A' ' 32' ' ' LEU . 69.7 mmm -76.96 -24.86 52.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.205 -0.452 . . . . 1.1000000000000001 110.325 179.766 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -71.32 -48.43 50.52 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.256 -0.429 . . . . 2.6899999999999999 110.581 179.319 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.2 t -64.52 -13.81 54.28 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.037 -0.529 . . . . 1.0600000000000001 111.21 179.847 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 10.4 mp -113.54 156.38 23.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.187 -0.46 . . . . 1.26 110.441 179.778 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -50.2 -18.32 2.14 Favored Glycine 0 CA--C 1.52 0.38 0 CA-C-N 115.827 -0.624 . . . . 0.68999999999999995 114.175 -179.014 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 11.8 mp0 -64.61 163.09 14.35 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 117.42 0.61 . . . . 1.97 111.105 -179.881 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -165.21 72.27 1.41 Allowed Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 115.932 -0.576 . . . . 2.6600000000000001 110.834 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -66.61 164.22 29.81 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.648 2.232 . . . . 0.51000000000000001 112.437 -179.833 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 44.2 m -82.58 152.05 26.12 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.028 -0.533 . . . . 0.72999999999999998 110.752 179.757 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -45.47 -52.52 10.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.441 -0.345 . . . . 2.7000000000000002 111.344 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.95 -47.82 70.9 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.215 -0.448 . . . . 0.46000000000000002 111.592 -179.738 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -53.38 -55.0 28.54 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.391 -0.368 . . . . 2.23 111.282 -179.851 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.408 HD23 HD21 ' A' ' 51' ' ' LEU . 39.6 mt -57.98 -44.86 87.35 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.537 -0.302 . . . . 1.3600000000000001 110.955 -179.998 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 83.5 mm-40 -62.56 -29.88 70.91 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.728 0.299 . . . . 1.22 111.288 -179.788 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -76.09 -52.59 9.83 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.345 -0.389 . . . . 0.62 111.903 -179.285 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.408 HD21 HD23 ' A' ' 48' ' ' LEU . 2.2 pp -68.94 -38.19 79.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.567 -0.288 . . . . 0.39000000000000001 111.602 -179.133 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 85.0 mt -65.06 -53.28 43.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.628 -0.26 . . . . 0.5 110.969 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.5 -35.47 79.47 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.799 0.333 . . . . 0.58999999999999997 111.145 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -62.92 -55.16 28.48 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.319 -0.401 . . . . 2.54 110.535 179.734 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -71.18 -14.83 62.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.076 -0.511 . . . . 0.53000000000000003 111.348 179.777 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -65.98 -51.93 54.01 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.435 -0.348 . . . . 1.95 110.979 -179.876 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 28.7 p-10 -94.58 22.22 6.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.215 -0.448 . . . . 2.48 111.352 -179.649 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 -134.36 -5.26 2.62 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.371 -0.377 . . . . 2.48 110.979 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 17.0 m120 -146.4 14.35 1.26 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.34 -0.391 . . . . 2.0499999999999998 111.046 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 28.4 m-80 62.96 7.69 2.79 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.027 -0.533 . . . . 1.47 111.845 179.578 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 108.0 38.66 1.97 Allowed Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.617 -0.801 . . . . 0.42999999999999999 112.945 179.49 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.675 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 10.9 mm-40 -144.21 155.51 43.92 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.974 0.416 . . . . 0.38 111.195 179.749 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.669 HD13 HD23 ' A' ' 32' ' ' LEU . 8.4 mt -128.37 153.99 46.47 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-N 116.033 -0.53 . . . . 1.4299999999999999 110.395 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -112.43 156.38 22.64 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 121.143 -0.223 . . . . 1.1899999999999999 110.696 -179.633 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -42.74 -32.44 0.6 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.285 -0.416 . . . . 0.40000000000000002 111.074 179.646 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.49 -41.27 55.82 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.209 -0.45 . . . . 0.81000000000000005 112.012 -179.727 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -63.36 -52.76 60.38 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.323 -0.399 . . . . 1.3600000000000001 110.493 -179.949 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.488 ' HD1' HD21 ' A' ' 32' ' ' LEU . 17.8 t80 -59.69 -55.16 37.87 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.933 -0.576 . . . . 0.51000000000000001 110.478 179.312 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 8.4 t -55.72 -41.96 74.61 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-N 116.077 -0.51 . . . . 0.75 110.468 179.902 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -48.81 -55.36 11.5 Favored Glycine 0 N--CA 1.45 -0.378 0 CA-C-N 115.462 -0.79 . . . . 0.40999999999999998 111.952 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.424 ' HA ' ' HG2' ' A' ' 74' ' ' LYS . 9.3 mt -64.41 -36.9 78.57 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 CA-C-O 120.897 0.379 . . . . 0.51000000000000001 110.422 179.386 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' MET . . . . . 0.471 ' HG3' ' O ' ' A' ' 68' ' ' PHE . 42.4 mtp -60.57 -28.67 68.64 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.87 -0.604 . . . . 1.01 110.055 179.27 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.31 -47.23 62.06 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.672 -0.694 . . . . 0.69999999999999996 110.433 179.788 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.424 ' HG2' ' HA ' ' A' ' 71' ' ' ILE . 54.2 pttt -75.14 -24.71 58.02 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.196 -0.457 . . . . 1.3799999999999999 111.203 179.671 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 19.8 tp60 -80.13 -55.39 4.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.18 -0.464 . . . . 1.98 111.452 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 11.5 mtm . . . . . 0 N--CA 1.449 -0.495 0 CA-C-N 116.296 -0.411 . . . . 1.2 111.16 -179.754 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.622 ' O ' ' HG3' ' A' ' 85' ' ' MET . 96.7 m . . . . . 0 C--O 1.226 -0.156 0 N-CA-C 110.249 -0.278 . . . . 7.29 110.249 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.512 ' HA ' ' SD ' ' A' ' 85' ' ' MET . 11.8 pt-20 -76.9 -20.65 55.97 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 113.362 0.875 . . . . 9.7400000000000002 113.362 -177.895 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.421 ' HG3' ' N ' ' A' ' 84' ' ' GLU . 10.9 pt-20 -59.61 -54.8 42.31 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.949 -0.3 . . . . 12.109999999999999 111.579 -179.245 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.499 ' HG2' HG22 ' A' ' 81' ' ' THR . 13.0 pt-20 -68.21 -14.39 62.95 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.772 0.32 . . . . 10.869999999999999 111.099 -179.678 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' MET . . . . . 0.622 ' HG3' ' O ' ' A' ' 81' ' ' THR . 20.2 mtt -77.66 -52.66 8.62 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.224 -0.444 . . . . 11.09 110.75 -179.5 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.403 ' O ' ' HG3' ' A' ' 90' ' ' LYS . 28.2 ttp180 -58.48 -46.92 85.65 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.961 -0.563 . . . . 15.52 110.402 179.862 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.46 ' HA ' ' HE2' ' A' ' 90' ' ' LYS . 1.4 tm-20 -55.78 -48.97 74.41 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 121.146 0.498 . . . . 14.85 109.976 178.917 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -63.76 -28.3 69.78 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.823 -0.626 . . . . 14.109999999999999 110.984 179.631 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 70.6 t80 -67.97 -38.02 82.24 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.018 0.437 . . . . 15.73 110.315 179.586 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' LYS . . . . . 0.46 ' HE2' ' HA ' ' A' ' 87' ' ' GLU . 44.1 mtmt -64.05 -43.77 94.53 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.837 -0.62 . . . . 17.66 110.496 179.583 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 58.2 mt -63.76 -45.59 96.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.172 -0.467 . . . . 18.149999999999999 111.254 -179.922 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.606 ' HA ' HG21 ' A' ' 108' ' ' VAL . 6.3 m-85 -70.82 -14.7 62.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.473 -0.33 . . . . 18.34 111.449 -179.688 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -105.8 106.3 16.73 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.897 0.379 . . . . 19.289999999999999 110.868 179.791 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.67 -49.56 18.0 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.006 -0.543 . . . . 22.25 111.106 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -74.36 167.52 21.49 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.206 -0.452 . . . . 23.34 110.907 -179.884 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -94.19 5.16 71.42 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.886 -0.673 . . . . 22.0 112.033 179.609 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -67.89 -27.23 66.48 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.757 0.313 . . . . 22.280000000000001 111.189 -179.914 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 87.43 34.41 10.49 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.796 -0.716 . . . . 19.93 112.506 179.658 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' PHE . . . . . 0.502 ' HA ' ' O ' ' A' ' 136' ' ' ILE . 96.4 m-85 -141.08 147.46 38.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.663 0.268 . . . . 20.300000000000001 110.982 -179.954 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.523 ' HB ' ' HB ' ' A' ' 136' ' ' ILE . 58.3 mt -114.48 122.44 68.6 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 CA-C-N 116.24 -0.436 . . . . 19.370000000000001 111.265 -179.904 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 23.3 m -115.04 156.7 44.93 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 115.781 -0.645 . . . . 22.489999999999998 110.338 179.796 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 92.1 Cg_exo -41.18 -33.16 1.26 Allowed 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.408 2.072 . . . . 23.0 112.764 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.76 -41.73 87.29 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.249 -0.432 . . . . 24.559999999999999 111.498 -179.776 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 104' ' ' GLU . . . . . 0.435 ' O ' HG23 ' A' ' 108' ' ' VAL . 44.4 mt-10 -79.87 -49.53 11.81 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.863 -0.608 . . . . 22.23 110.114 -179.482 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.526 HD11 ' HE3' ' A' ' 109' ' ' MET . 49.3 tp -51.95 -32.56 33.78 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.274 -0.875 . . . . 20.359999999999999 110.922 179.515 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 7.3 tmm_? -77.39 -48.23 17.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.754 -0.657 . . . . 27.190000000000001 110.987 -179.747 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 66.2 t80 -58.82 -34.41 71.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.215 -0.448 . . . . 25.359999999999999 111.557 -179.636 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.606 HG21 ' HA ' ' A' ' 92' ' ' PHE . 46.5 t -80.26 -53.71 12.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 N-CA-C 112.352 0.501 . . . . 21.059999999999999 112.352 -178.719 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.526 ' HE3' HD11 ' A' ' 105' ' ' LEU . 1.5 mtt -47.06 -37.44 9.47 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 111.858 0.318 . . . . 20.93 111.858 -179.333 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 89.2 mt -64.7 -35.02 73.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.773 0.32 . . . . 25.129999999999999 110.928 179.919 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 -67.61 -39.1 84.77 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.185 -0.461 . . . . 23.32 110.598 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.411 HD12 ' N ' ' A' ' 112' ' ' LEU . 8.6 mp -67.29 -43.25 82.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.987 -0.551 . . . . 21.07 110.822 -179.971 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 117.98 21.16 4.26 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.771 -0.728 . . . . 23.050000000000001 112.617 179.636 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -83.16 -23.01 33.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.566 0.222 . . . . 22.59 111.352 -179.841 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp 50.21 85.39 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.278 -0.419 . . . . 27.960000000000001 110.994 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 116' ' ' VAL . . . . . 0.434 HG12 ' OE1' ' A' ' 120' ' ' GLU . 8.8 m -129.17 155.79 41.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.138 -0.483 . . . . 24.75 111.844 -179.545 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 117' ' ' THR . . . . . 0.471 ' O ' HG12 ' A' ' 121' ' ' ILE . 57.8 p -100.62 148.48 24.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.673 -0.694 . . . . 27.239999999999998 110.084 179.072 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 118' ' ' ASP . . . . . 0.455 ' HA ' HD11 ' A' ' 121' ' ' ILE . 9.2 m-20 -51.83 -19.48 1.72 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.363 -0.38 . . . . 26.629999999999999 111.727 -179.37 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -78.95 -55.43 5.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.441 -0.345 . . . . 29.140000000000001 111.755 -179.443 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 120' ' ' GLU . . . . . 0.434 ' OE1' HG12 ' A' ' 116' ' ' VAL . 14.5 pt-20 -60.84 -39.33 88.7 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.569 -0.287 . . . . 24.190000000000001 111.754 -179.245 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.564 HG13 ' N ' ' A' ' 122' ' ' ASP . 9.5 pt -69.86 -46.69 73.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 120.918 -0.313 . . . . 22.329999999999998 111.517 -179.69 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 122' ' ' ASP . . . . . 0.564 ' N ' HG13 ' A' ' 121' ' ' ILE . 13.7 t70 -50.95 -41.11 58.83 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.835 0.35 . . . . 24.289999999999999 110.529 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -61.84 -54.37 43.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.045 -0.525 . . . . 24.739999999999998 110.131 179.189 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.431 ' CE ' HD21 ' A' ' 105' ' ' LEU . 5.4 tmm? -51.2 -34.26 31.04 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 115.817 -0.629 . . . . 19.710000000000001 110.745 179.357 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.46 HG13 ' O ' ' A' ' 121' ' ' ILE . 69.9 mt -65.01 -41.3 91.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.0 -0.546 . . . . 19.949999999999999 110.448 179.519 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 55.3 ttt180 -57.62 -38.26 74.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.745 -0.661 . . . . 24.949999999999999 110.402 179.888 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -61.69 -48.21 81.81 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.647 -0.706 . . . . 18.690000000000001 111.186 179.622 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.57 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -81.73 -7.38 59.59 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.097 -0.502 . . . . 16.469999999999999 111.167 -179.674 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -100.42 107.23 18.92 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.221 -0.445 . . . . 20.399999999999999 110.857 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 68.9 m-85 -94.06 -42.76 8.84 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.684 -0.689 . . . . 21.43 111.128 -179.748 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -55.9 -34.48 65.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.053 -0.521 . . . . 23.370000000000001 111.048 -179.627 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 81.17 72.24 1.24 Allowed Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.858 -0.686 . . . . 24.32 112.589 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -143.08 -5.54 0.87 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.717 0.294 . . . . 23.879999999999999 111.305 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 77.47 8.8 87.1 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.795 -0.717 . . . . 22.670000000000002 112.536 179.839 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 61.9 mtp -121.34 155.33 34.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.752 0.311 . . . . 22.91 110.516 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.712 HG23 ' HB2' ' A' ' 140' ' ' GLU . 38.7 mm -115.61 142.33 29.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 121.217 0.532 . . . . 18.41 112.092 -179.434 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 137' ' ' ASN . . . . . 0.443 ' O ' ' N ' ' A' ' 139' ' ' GLU . 54.3 t30 -115.71 157.54 24.12 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.323 -0.853 . . . . 16.82 108.985 178.431 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 45.7 t80 -39.7 -24.62 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 120.628 0.251 . . . . 14.65 111.604 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 139' ' ' GLU . . . . . 0.443 ' N ' ' O ' ' A' ' 137' ' ' ASN . 46.7 mt-10 -80.79 -55.42 4.82 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.724 0.297 . . . . 14.82 110.803 -179.871 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.712 ' HB2' HG23 ' A' ' 136' ' ' ILE . 29.6 mt-10 -58.66 -35.64 72.87 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.152 0.501 . . . . 17.460000000000001 110.256 179.614 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.473 ' CE2' HD13 ' A' ' 145' ' ' ILE . 86.9 t80 -65.39 -55.43 18.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.658 -0.701 . . . . 12.93 110.296 179.484 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.587 HG13 ' SD ' ' A' ' 85' ' ' MET . 2.6 t -48.53 -34.18 5.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.55 -0.75 . . . . 10.699999999999999 111.78 179.366 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 143' ' ' TRP . . . . . 0.515 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 92.5 t90 -71.53 -55.51 7.69 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.577 0.584 . . . . 13.66 112.577 -178.79 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 144' ' ' MET . . . . . 0.57 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 21.5 ptt? -63.33 -26.53 68.8 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 112.819 0.674 . . . . 14.5 112.819 -177.675 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 145' ' ' ILE . . . . . 0.525 HG13 ' N ' ' A' ' 146' ' ' SER . 47.4 pt -81.01 -37.67 16.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 112.318 0.488 . . . . 11.25 112.318 -179.525 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 146' ' ' SER . . . . . 0.525 ' N ' HG13 ' A' ' 145' ' ' ILE . 33.2 t -59.32 -14.25 10.92 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.32 0.581 . . . . 8.5399999999999991 110.583 -179.537 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 147' ' ' GLN . . . . . 0.515 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 1.5 mm100 -100.58 -20.5 15.66 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.298 -0.865 . . . . 11.869999999999999 111.245 -178.993 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 68.5 mttm . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.179 -0.915 . . . . 13.68 110.87 179.744 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.53 HD12 ' SG ' ' A' ' 69' ' ' CYS . 15.6 mt . . . . . 0 C--O 1.232 0.135 0 CA-C-O 120.843 0.354 . . . . 1.27 111.051 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 75.0 p -69.41 -169.11 0.19 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.103 -0.499 . . . . 1.1200000000000001 111.44 -179.65 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -76.25 -38.26 56.54 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.35 -0.386 . . . . 2.2000000000000002 111.025 -179.565 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -72.75 -42.45 64.04 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.143 -0.48 . . . . 1.3500000000000001 110.928 -179.837 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -60.16 -47.81 84.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.144 -0.48 . . . . 2.2200000000000002 110.645 179.758 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.571 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 82.4 mt -57.38 -52.23 59.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.863 -0.608 . . . . 0.54000000000000004 111.195 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.91 -23.67 65.41 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.276 -0.42 . . . . 0.5 112.024 -179.411 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -71.42 -57.36 4.51 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 111.865 0.32 . . . . 2.27 111.865 -179.124 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.571 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 17.2 p90 -77.52 -23.43 50.19 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 120.47 -0.492 . . . . 0.37 110.645 -179.546 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.452 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 19.9 tptm -66.94 -36.07 81.4 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 109.229 -0.656 . . . . 1.23 109.229 178.528 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -67.89 -46.3 72.02 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 108.75 -0.833 . . . . 0.44 108.75 178.081 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.03 -14.46 61.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.488 -0.778 . . . . 0.28999999999999998 110.188 178.628 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.452 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 49.9 t80 -80.0 -52.16 8.18 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.819 -0.628 . . . . 0.47999999999999998 110.683 -179.839 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 24.6 m -63.43 -24.95 37.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.118 -0.492 . . . . 1.1100000000000001 110.516 -179.968 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 61.3 mm-40 -57.7 -28.67 64.04 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.671 -0.695 . . . . 1.6000000000000001 111.331 179.544 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -105.23 36.53 2.45 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.665 0.269 . . . . 0.64000000000000001 111.472 -179.692 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -129.69 68.9 1.42 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.157 0.503 . . . . 0.44 110.396 179.398 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -83.07 5.14 23.4 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.655 -0.702 . . . . 2.1000000000000001 111.222 -179.727 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -103.0 -2.77 27.03 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.367 -0.379 . . . . 1.8 111.193 -179.519 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 63.23 17.89 59.85 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.828 -0.701 . . . . 0.46000000000000002 112.812 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 37.5 p -92.18 8.39 38.24 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.71 0.291 . . . . 0.40000000000000002 111.242 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 54.14 21.45 18.26 Favored Glycine 0 C--N 1.333 0.383 0 C-N-CA 120.732 -0.747 . . . . 0.33000000000000002 111.79 -179.445 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.664 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 36.5 mtpt -133.96 155.76 49.37 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.549 -0.326 . . . . 1.1000000000000001 110.551 -179.295 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.45 HG13 ' O ' ' A' ' 27' ' ' ILE . 49.1 pt -118.73 130.89 72.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 120.901 0.382 . . . . 0.5 111.684 -179.781 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -54.1 135.68 43.1 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.226 -0.443 . . . . 0.29999999999999999 111.025 179.897 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.505 ' HA ' HD11 ' A' ' 63' ' ' LEU . 7.3 t -63.11 -22.2 66.7 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.047 -0.524 . . . . 1.03 111.223 -179.851 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 41.1 mtp180 -77.74 -3.89 43.56 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.082 -0.508 . . . . 3.0800000000000001 110.459 179.774 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -113.53 -5.43 13.45 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.942 -0.572 . . . . 2.2599999999999998 111.142 -179.804 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.57 -44.76 95.84 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 110.15 -0.315 . . . . 1.3700000000000001 110.15 179.65 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -58.43 -43.39 95.86 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.332 -0.937 . . . . 0.32000000000000001 110.976 178.828 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 44.8 m -65.16 -30.72 71.66 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.494 -0.558 . . . . 0.31 109.494 178.544 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 13.7 tp -64.21 -35.4 80.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.382 -0.826 . . . . 1.24 109.506 179.247 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.529 ' HG3' ' HG3' ' A' ' 43' ' ' PRO . 20.3 mmt -66.4 -41.28 89.56 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 115.535 -0.757 . . . . 1.1000000000000001 109.895 178.852 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 59.8 mtp180 -63.5 -26.95 68.95 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.628 -0.715 . . . . 2.6899999999999999 109.93 179.075 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.521 HG22 HD12 ' A' ' 39' ' ' LEU . 2.5 m -79.32 -16.56 56.16 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.536 -0.757 . . . . 1.0600000000000001 110.025 179.322 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.521 HD12 HG22 ' A' ' 38' ' ' THR . 10.3 mp -113.99 157.74 22.07 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.261 -0.881 . . . . 1.26 110.225 179.861 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -74.03 36.33 0.91 Allowed Glycine 0 CA--C 1.519 0.319 0 C-N-CA 120.498 -0.858 . . . . 0.68999999999999995 112.439 179.485 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.427 ' HG2' ' HB3' ' A' ' 39' ' ' LEU . 4.5 mm100 -89.29 -70.57 0.65 Allowed 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.831 0.348 . . . . 1.97 111.306 -179.88 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 60.24 67.48 1.64 Allowed Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 115.945 -0.57 . . . . 2.6600000000000001 110.488 -179.189 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.529 ' HG3' ' HG3' ' A' ' 36' ' ' MET . 69.3 Cg_endo -72.8 -172.86 1.04 Allowed 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.68 2.253 . . . . 0.51000000000000001 112.466 -179.88 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -93.01 150.35 20.6 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.936 -0.574 . . . . 0.72999999999999998 111.003 179.684 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.482 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 15.6 mt-10 -54.6 -46.13 73.77 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.524 -0.307 . . . . 2.7000000000000002 110.645 179.685 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -55.69 -52.94 62.16 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.302 -0.408 . . . . 0.46000000000000002 111.067 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -54.62 -47.26 73.65 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.182 -0.463 . . . . 2.23 110.893 -179.884 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.478 HD22 HD11 ' A' ' 52' ' ' ILE . 15.3 mt -60.39 -45.29 94.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.323 -0.399 . . . . 1.3600000000000001 110.971 179.746 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.482 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 33.0 mm-40 -63.08 -33.67 75.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.693 0.282 . . . . 1.22 111.145 -179.717 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -72.12 -54.03 10.97 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.214 0.45 . . . . 0.62 112.214 -179.299 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 3.2 pp -69.99 -41.26 74.63 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.127 0.417 . . . . 0.39000000000000001 112.127 -178.768 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.478 HD11 HD22 ' A' ' 48' ' ' LEU . 86.6 mt -65.3 -38.72 83.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-O 120.485 0.183 . . . . 0.5 111.093 -179.654 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.65 -37.91 83.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.89 0.376 . . . . 0.58999999999999997 110.516 179.487 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -64.38 -40.89 96.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.069 -0.514 . . . . 2.54 109.994 179.164 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -80.16 -14.76 58.22 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.968 -0.56 . . . . 0.53000000000000003 111.021 179.241 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -66.57 -49.96 64.69 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.262 -0.426 . . . . 1.95 110.948 -179.885 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 34.9 m-80 -85.88 34.85 0.61 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.151 -0.477 . . . . 2.48 110.806 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -157.41 151.57 24.73 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.165 -0.47 . . . . 2.48 110.757 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 4.1 m120 63.25 10.3 4.57 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.981 -0.554 . . . . 2.0499999999999998 111.404 179.847 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 88.3 m-20 62.74 13.33 6.34 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.336 -0.393 . . . . 1.47 111.845 179.702 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 104.67 38.5 2.55 Favored Glycine 0 C--N 1.33 0.247 0 C-N-CA 120.551 -0.833 . . . . 0.42999999999999999 112.763 179.419 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.664 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 10.1 mm-40 -142.5 155.61 45.06 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.991 0.424 . . . . 0.38 110.886 179.688 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.505 HD11 ' HA ' ' A' ' 29' ' ' THR . 29.0 mt -127.19 154.22 45.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.233 -0.44 . . . . 1.4299999999999999 110.92 -179.805 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ASN . . . . . 0.501 ' OD1' ' HE3' ' A' ' 26' ' ' LYS . 0.3 OUTLIER -114.37 157.33 22.98 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.665 -0.494 . . . . 1.1899999999999999 109.665 179.113 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 90.6 t80 -41.19 -33.88 0.41 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.578 0.228 . . . . 0.40000000000000002 111.361 179.871 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 8.2 m -70.78 -39.84 72.95 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.505 -0.316 . . . . 0.81000000000000005 111.622 -179.766 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.468 ' HG2' HD22 ' A' ' 64' ' ' ASN . 13.6 mm-40 -59.71 -55.75 30.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.126 0.489 . . . . 1.3600000000000001 110.804 179.668 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 25.3 t80 -63.77 -52.26 61.15 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.649 -0.705 . . . . 0.51000000000000001 111.145 -179.646 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.53 ' SG ' HD12 ' A' ' 4' ' ' LEU . 19.4 t -53.87 -40.85 66.92 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-O 121.378 0.609 . . . . 0.75 109.886 179.577 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -53.38 -46.6 64.09 Favored Glycine 0 CA--C 1.503 -0.704 0 CA-C-N 114.909 -1.041 . . . . 0.40999999999999998 111.719 179.523 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.537 ' HA ' ' HG2' ' A' ' 74' ' ' LYS . 44.8 mt -73.42 -45.86 50.89 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.93 0 CA-C-O 120.863 0.364 . . . . 0.51000000000000001 111.44 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' MET . . . . . 0.442 ' HB3' ' HE2' ' A' ' 76' ' ' MET . 0.1 OUTLIER -52.18 -33.45 40.73 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.816 -0.629 . . . . 1.01 110.181 179.235 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.91 -51.07 43.88 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.729 -0.669 . . . . 0.69999999999999996 110.874 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.537 ' HG2' ' HA ' ' A' ' 71' ' ' ILE . 63.6 pttt -69.63 -27.27 64.92 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 120.85 0.357 . . . . 1.3799999999999999 111.622 -179.82 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' GLN . . . . . 0.468 ' NE2' ' HB3' ' A' ' 43' ' ' PRO . 30.8 tt0 -80.63 -55.11 5.07 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.24 -0.436 . . . . 1.98 111.816 -179.141 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 76' ' ' MET . . . . . 0.442 ' HE2' ' HB3' ' A' ' 72' ' ' MET . 31.6 mtm . . . . . 0 N--CA 1.451 -0.42 0 CA-C-N 116.313 -0.403 . . . . 1.2 111.166 -179.514 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.422 ' O ' ' HG3' ' A' ' 85' ' ' MET . 75.4 m . . . . . 0 N--CA 1.461 0.105 0 CA-C-O 120.644 0.259 . . . . 7.29 110.571 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.55 ' HA ' ' SD ' ' A' ' 85' ' ' MET . 44.9 mt-10 -79.78 -16.69 55.07 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 112.534 0.568 . . . . 9.7400000000000002 112.534 -178.713 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -69.18 -55.85 9.38 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.697 0.284 . . . . 12.109999999999999 111.638 -179.402 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -63.42 -15.23 56.99 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.922 0.392 . . . . 10.869999999999999 111.061 -179.798 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' MET . . . . . 0.657 ' SD ' HG13 ' A' ' 142' ' ' VAL . 19.0 mtt -80.18 -53.81 6.33 Favored 'General case' 0 CA--C 1.514 -0.405 0 CA-C-N 116.087 -0.506 . . . . 11.09 110.224 -179.65 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.449 ' O ' ' HG3' ' A' ' 90' ' ' LYS . 38.4 ttt180 -51.56 -41.04 60.84 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.28 -0.873 . . . . 15.52 110.378 179.362 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -72.15 -35.17 69.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.122 -0.49 . . . . 14.85 110.423 179.274 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -69.17 -28.3 66.29 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.123 -0.49 . . . . 14.109999999999999 111.051 179.713 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 86.3 t80 -73.82 -46.21 46.6 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.322 -0.399 . . . . 15.73 110.445 179.904 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' LYS . . . . . 0.449 ' HG3' ' O ' ' A' ' 86' ' ' ARG . 90.5 mttt -58.25 -38.14 76.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.015 -0.539 . . . . 17.66 110.309 179.32 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 86.2 mt -75.69 -38.63 38.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.697 -0.683 . . . . 18.149999999999999 111.314 -179.782 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.4 ' O ' ' NE ' ' A' ' 94' ' ' ARG . 0.2 OUTLIER -66.14 -56.85 9.37 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.494 -0.321 . . . . 18.34 111.108 -179.621 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 93' ' ' ASP . . . . . 0.571 ' HA ' HH21 ' A' ' 94' ' ' ARG . 44.1 t0 -49.11 123.44 7.25 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-O 120.789 0.328 . . . . 19.289999999999999 110.253 -179.884 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.687 ' HE ' ' N ' ' A' ' 94' ' ' ARG . 0.0 OUTLIER -91.84 -7.44 49.41 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.209 -0.45 . . . . 22.25 111.848 -178.513 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -126.55 -176.68 3.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.921 0.391 . . . . 23.34 110.904 179.788 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.45 0.7 55.71 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.916 -0.659 . . . . 22.0 112.229 179.643 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.93 -37.98 89.44 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.758 0.313 . . . . 22.280000000000001 111.239 -179.86 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 95.55 20.53 26.71 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.853 -0.689 . . . . 19.93 112.6 179.899 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' PHE . . . . . 0.42 ' HA ' ' O ' ' A' ' 136' ' ' ILE . 95.7 m-85 -136.32 151.77 49.96 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.702 0.286 . . . . 20.300000000000001 110.803 179.855 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.497 ' HB ' ' HB ' ' A' ' 136' ' ' ILE . 45.7 mt -114.96 133.04 62.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-O 121.096 0.474 . . . . 19.370000000000001 111.66 -179.606 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 75.7 m -114.57 156.06 45.19 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 115.576 -0.738 . . . . 22.489999999999998 110.119 179.2 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_exo -42.45 -47.53 7.38 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.529 2.153 . . . . 23.0 112.699 -179.454 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -59.61 -42.89 93.66 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.199 0.523 . . . . 24.559999999999999 111.045 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -65.51 -55.13 19.49 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.655 -0.702 . . . . 22.23 109.796 -179.947 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.449 ' CD2' ' HB ' ' A' ' 121' ' ' ILE . 40.6 tp -49.26 -34.63 15.6 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.002 -0.999 . . . . 20.359999999999999 110.325 179.443 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.405 ' HD3' HH11 ' A' ' 106' ' ' ARG . 2.4 tmm_? -69.86 -35.99 75.15 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.591 -0.732 . . . . 27.190000000000001 110.873 -179.781 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 68.0 t80 -67.0 -48.53 68.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.064 -0.516 . . . . 25.359999999999999 112.213 -179.389 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.446 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 99.3 t -67.92 -48.79 73.65 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 N-CA-C 112.103 0.408 . . . . 21.059999999999999 112.103 -179.045 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 2.2 mmt -45.23 -33.92 2.57 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 120.839 0.352 . . . . 20.93 110.833 179.987 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 67.2 mt -74.05 -44.38 50.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.105 -0.498 . . . . 25.129999999999999 110.766 179.501 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 81.2 m-20 -59.56 -24.97 64.16 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.947 -0.57 . . . . 23.32 110.699 179.641 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 64.0 mt -75.67 -32.52 60.19 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.94 -0.573 . . . . 21.07 110.626 179.997 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 121.71 -2.77 11.03 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.821 -0.704 . . . . 23.050000000000001 112.847 179.596 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -109.87 122.5 47.67 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.896 0.379 . . . . 22.59 111.379 -179.76 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 63.8 tttm -80.24 142.71 34.37 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.073 -0.512 . . . . 27.960000000000001 110.601 179.65 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 116' ' ' VAL . . . . . 0.468 ' HB ' HG23 ' A' ' 121' ' ' ILE . 1.9 m -150.09 155.51 7.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 121.074 0.464 . . . . 24.75 111.791 -179.697 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 117' ' ' THR . . . . . 0.432 ' O ' HG12 ' A' ' 121' ' ' ILE . 61.5 p -100.03 144.13 29.43 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.706 -0.679 . . . . 27.239999999999998 110.153 179.169 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -51.38 -18.98 1.16 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.265 -0.425 . . . . 26.629999999999999 111.698 -179.449 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -78.23 -54.08 6.63 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.575 -0.284 . . . . 29.140000000000001 111.647 -179.579 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -63.86 -40.34 96.35 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 111.808 0.299 . . . . 24.190000000000001 111.808 -179.146 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.532 HG13 ' N ' ' A' ' 122' ' ' ASP . 11.4 pt -70.64 -41.65 77.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 C-N-CA 121.025 -0.27 . . . . 22.329999999999998 111.588 -179.524 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 122' ' ' ASP . . . . . 0.532 ' N ' HG13 ' A' ' 121' ' ' ILE . 21.4 t70 -58.7 -37.36 75.92 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.975 0.417 . . . . 24.289999999999999 110.161 179.568 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -65.82 -41.87 91.32 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.973 -0.558 . . . . 24.739999999999998 110.067 179.285 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 67.7 ttp -57.97 -36.56 72.76 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.069 -0.514 . . . . 19.710000000000001 110.057 178.969 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.457 HG23 HD11 ' A' ' 136' ' ' ILE . 84.1 mt -63.21 -42.64 97.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.799 -0.637 . . . . 19.949999999999999 109.822 179.203 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 1.8 tmm_? -58.06 -52.0 67.35 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.512 -0.767 . . . . 24.949999999999999 110.335 179.406 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -54.59 -23.57 17.5 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.124 -0.944 . . . . 18.690000000000001 111.78 -179.894 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.644 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -107.53 -10.58 15.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.839 0.352 . . . . 16.469999999999999 111.497 -179.776 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 27.6 t0 -98.36 106.14 18.38 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.218 -0.446 . . . . 20.399999999999999 110.932 -179.529 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 34.5 m-85 -85.41 -48.47 8.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.845 -0.616 . . . . 21.43 111.287 -179.59 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -60.14 -21.9 62.17 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.174 -0.466 . . . . 23.370000000000001 111.38 -179.656 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 60.75 77.01 0.2 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.654 -0.784 . . . . 24.32 112.614 179.929 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 13.1 p-10 -133.82 -15.83 2.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.848 0.356 . . . . 23.879999999999999 110.786 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 93.14 10.43 59.67 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.854 -0.688 . . . . 22.670000000000002 112.391 -179.887 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 38.1 mtp -131.31 154.52 48.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.606 0.241 . . . . 22.91 110.551 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.715 HG23 ' HB2' ' A' ' 140' ' ' GLU . 36.9 mm -114.86 144.23 22.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 121.331 0.586 . . . . 18.41 111.992 -179.256 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 137' ' ' ASN . . . . . 0.425 ' O ' ' N ' ' A' ' 139' ' ' GLU . 48.9 t30 -114.8 157.06 23.77 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.069 -0.969 . . . . 16.82 108.94 178.364 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 7.9 t80 -41.71 -23.14 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 120.663 0.268 . . . . 14.65 111.524 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 139' ' ' GLU . . . . . 0.425 ' N ' ' O ' ' A' ' 137' ' ' ASN . 44.5 mt-10 -80.22 -56.01 4.52 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.684 0.278 . . . . 14.82 110.946 -179.806 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.715 ' HB2' HG23 ' A' ' 136' ' ' ILE . 34.1 mt-10 -59.23 -31.39 69.01 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.155 0.502 . . . . 17.460000000000001 110.23 179.629 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.646 ' HA ' ' HE2' ' A' ' 144' ' ' MET . 89.0 t80 -69.34 -55.48 10.29 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.503 -0.771 . . . . 12.93 110.271 179.568 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.657 HG13 ' SD ' ' A' ' 85' ' ' MET . 2.4 t -44.43 -42.38 2.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.569 -0.741 . . . . 10.699999999999999 112.036 179.075 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 143' ' ' TRP . . . . . 0.511 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 92.6 t90 -69.94 -56.09 7.94 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.329 0.492 . . . . 13.66 112.329 -178.849 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 144' ' ' MET . . . . . 0.646 ' HE2' ' HA ' ' A' ' 141' ' ' PHE . 20.3 ptt? -61.72 -21.17 64.26 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 113.27 0.841 . . . . 14.5 113.27 -177.723 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 145' ' ' ILE . . . . . 0.629 ' HA ' ' HB2' ' A' ' 148' ' ' LYS . 38.0 pt -80.79 -43.9 21.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 C-N-CA 120.619 -0.432 . . . . 11.25 111.813 -179.939 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 146' ' ' SER . . . . . 0.486 ' N ' HG13 ' A' ' 145' ' ' ILE . 31.2 t -63.07 -14.69 51.33 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.297 0.57 . . . . 8.5399999999999991 109.933 179.602 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 147' ' ' GLN . . . . . 0.511 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 0.7 OUTLIER -119.52 2.8 11.25 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.171 -0.922 . . . . 11.869999999999999 110.488 -179.232 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 148' ' ' LYS . . . . . 0.629 ' HB2' ' HA ' ' A' ' 145' ' ' ILE . 26.3 ttpp . . . . . 0 C--O 1.25 1.084 0 CA-C-O 118.249 -0.882 . . . . 13.68 110.987 -179.793 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.411 ' HG ' ' HE2' ' A' ' 12' ' ' PHE . 7.9 mp . . . . . 0 CA--C 1.528 0.134 0 CA-C-O 120.764 0.316 . . . . 1.27 110.896 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 36.9 p -78.63 -173.39 3.38 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.208 -0.451 . . . . 1.1200000000000001 111.538 -179.77 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -63.68 -42.91 97.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.272 -0.422 . . . . 2.2000000000000002 111.515 -179.664 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.408 ' HG3' ' N ' ' A' ' 8' ' ' GLN . 11.1 pt-20 -69.83 -42.44 73.6 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.082 0.467 . . . . 1.3500000000000001 110.51 -179.615 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' GLN . . . . . 0.408 ' N ' ' HG3' ' A' ' 7' ' ' GLU . 79.2 mt-30 -63.84 -41.39 97.83 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.564 -0.744 . . . . 2.2200000000000002 110.671 179.825 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.494 ' HA ' ' CZ ' ' A' ' 12' ' ' PHE . 45.8 mt -60.71 -51.95 67.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.034 -0.53 . . . . 0.54000000000000004 110.57 179.592 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.94 -23.19 66.2 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.022 -0.535 . . . . 0.5 111.376 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -69.8 -56.64 6.6 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 111.903 0.334 . . . . 2.27 111.903 -179.224 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.494 ' CZ ' ' HA ' ' A' ' 9' ' ' ILE . 11.0 p90 -78.83 -26.92 44.2 Favored 'General case' 0 C--N 1.332 -0.187 0 C-N-CA 120.491 -0.484 . . . . 0.37 110.879 -179.78 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 19.4 tptm -63.67 -34.68 78.4 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.208 -0.664 . . . . 1.23 109.208 178.701 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.43 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 18.2 t70 -70.23 -53.34 17.4 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.644 -0.707 . . . . 0.44 109.206 178.384 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.0 -14.29 22.03 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.535 -0.757 . . . . 0.28999999999999998 110.749 179.165 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 41.8 t80 -80.34 -52.84 7.21 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.957 -0.565 . . . . 0.47999999999999998 110.961 -179.746 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 23.3 m -66.97 -17.92 23.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.076 -0.511 . . . . 1.1100000000000001 110.787 -179.595 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.43 ' HG2' ' O ' ' A' ' 14' ' ' ASP . 74.0 mm-40 -65.95 -29.52 69.93 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.81 -0.632 . . . . 1.6000000000000001 111.636 179.857 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 36.4 m-85 -101.24 18.34 20.19 Favored 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 111.818 0.303 . . . . 0.64000000000000001 111.818 -179.665 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -115.23 80.37 1.42 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.966 0.413 . . . . 0.44 110.798 179.424 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 14.1 tppt? -87.82 -29.39 20.99 Favored 'General case' 0 N--CA 1.441 -0.918 0 CA-C-N 115.878 -0.601 . . . . 2.1000000000000001 110.66 -179.872 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -68.07 -16.72 64.14 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.116 -0.493 . . . . 1.8 111.404 -179.473 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.39 9.67 86.82 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.731 -0.747 . . . . 0.46000000000000002 112.937 179.703 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 34.6 p -79.65 8.18 7.04 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.619 0.247 . . . . 0.40000000000000002 111.012 179.932 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 55.43 21.43 27.12 Favored Glycine 0 C--N 1.333 0.379 0 C-N-CA 120.733 -0.746 . . . . 0.33000000000000002 111.707 -179.58 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.688 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 53.9 mtpt -134.88 155.13 51.22 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.577 -0.311 . . . . 1.1000000000000001 110.775 -179.091 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.651 HG13 ' HB2' ' A' ' 63' ' ' LEU . 20.5 pt -115.52 127.7 73.01 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.317 0 CA-C-O 120.921 0.391 . . . . 0.5 111.964 -178.963 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -53.09 139.84 27.32 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.1 -0.5 . . . . 0.29999999999999999 111.427 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.531 ' HA ' HD11 ' A' ' 63' ' ' LEU . 7.3 t -65.72 -20.9 66.45 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.992 -0.549 . . . . 1.03 111.454 -179.749 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.496 ' HD3' ' H ' ' A' ' 30' ' ' ARG . 0.0 OUTLIER -83.6 5.08 25.59 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.881 0.372 . . . . 3.0800000000000001 110.48 179.64 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -120.29 -6.65 9.85 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.845 -0.616 . . . . 2.2599999999999998 111.006 -179.845 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.594 HD13 HD13 ' A' ' 51' ' ' LEU . 10.3 tt -58.46 -51.5 69.57 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 116.482 -0.326 . . . . 1.3700000000000001 110.791 179.751 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.413 ' HA2' HD21 ' A' ' 48' ' ' LEU . . . -52.7 -48.07 57.07 Favored Glycine 0 C--N 1.332 0.331 0 C-N-CA 120.33 -0.938 . . . . 0.32000000000000001 111.335 179.405 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.492 ' HA ' ' HG2' ' A' ' 37' ' ' ARG . 88.6 m -57.94 -36.65 72.81 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.394 0.616 . . . . 0.31 109.54 178.493 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.5 -32.1 73.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.087 -0.961 . . . . 1.24 110.297 179.532 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 23.7 mmt -73.83 -26.72 60.74 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.891 -0.595 . . . . 1.1000000000000001 110.316 179.388 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.492 ' HG2' ' HA ' ' A' ' 34' ' ' THR . 17.9 mmt180 -66.78 -50.86 61.33 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.818 -0.628 . . . . 2.6899999999999999 110.271 179.566 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.437 HG23 ' HG ' ' A' ' 39' ' ' LEU . 7.9 t -65.05 -12.62 52.55 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.772 -0.649 . . . . 1.0600000000000001 111.313 179.833 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.437 ' HG ' HG23 ' A' ' 38' ' ' THR . 64.8 mt -112.77 156.32 23.05 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.205 -0.452 . . . . 1.26 110.614 -179.825 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -67.45 10.68 0.94 Allowed Glycine 0 CA--C 1.521 0.441 0 C-N-CA 121.022 -0.608 . . . . 0.68999999999999995 113.141 -179.74 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.418 ' H ' ' C ' ' A' ' 39' ' ' LEU . 15.8 mm-40 -67.4 -79.03 0.05 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.92 0.39 . . . . 1.97 111.122 179.798 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 56.44 68.7 2.09 Favored Pre-proline 0 C--N 1.331 -0.217 0 CA-C-N 115.923 -0.581 . . . . 2.6600000000000001 111.065 -179.628 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.606 ' HG2' HD23 ' A' ' 48' ' ' LEU . 61.5 Cg_endo -71.9 -171.53 0.69 Allowed 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.687 2.258 . . . . 0.51000000000000001 112.346 179.86 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 38.1 m -94.87 152.42 18.39 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.161 -0.472 . . . . 0.72999999999999998 110.639 179.716 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.415 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 37.4 tt0 -48.85 -53.07 20.91 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.574 -0.285 . . . . 2.7000000000000002 111.28 -179.651 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -46.92 -54.69 9.49 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.298 -0.41 . . . . 0.46000000000000002 111.424 -179.752 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -54.91 -50.29 69.17 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.358 -0.383 . . . . 2.23 110.82 179.876 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.606 HD23 ' HG2' ' A' ' 43' ' ' PRO . 0.1 OUTLIER -55.82 -36.09 67.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.115 -0.493 . . . . 1.3600000000000001 111.032 -179.879 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.415 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 28.5 mm-40 -75.88 -32.16 59.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.256 -0.429 . . . . 1.22 111.247 -179.707 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 64.7 m-20 -70.1 -55.42 9.5 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.464 -0.334 . . . . 0.62 111.09 -179.842 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.594 HD13 HD13 ' A' ' 32' ' ' LEU . 1.9 pp -59.19 -39.44 82.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.314 -0.403 . . . . 0.39000000000000001 111.116 -179.923 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 35.8 mt -64.52 -40.8 90.31 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-O 120.636 0.255 . . . . 0.5 110.594 179.429 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.89 -30.92 71.2 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.383 -0.371 . . . . 0.58999999999999997 111.003 179.901 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -80.46 -47.33 14.49 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.105 -0.498 . . . . 2.54 111.394 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -75.49 -14.86 60.45 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.351 0.5 . . . . 0.53000000000000003 112.351 -179.16 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -69.31 -38.71 78.37 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.705 0.288 . . . . 1.95 111.065 -179.486 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 30.6 m-80 -95.25 28.79 2.71 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.346 -0.388 . . . . 2.48 110.563 179.84 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 7.8 t-20 -148.92 138.43 21.8 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.109 -0.496 . . . . 2.48 110.542 -179.679 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 77.4 m-20 62.68 14.58 7.33 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.181 -0.463 . . . . 2.0499999999999998 111.118 179.909 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 22.3 m-80 58.47 13.62 2.58 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.034 -0.53 . . . . 1.47 111.711 179.469 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 113.78 48.22 0.59 Allowed Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.564 -0.827 . . . . 0.42999999999999999 113.045 179.483 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.688 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 10.8 mm-40 -146.22 153.8 41.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.109 0.48 . . . . 0.38 111.198 179.513 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.651 ' HB2' HG13 ' A' ' 27' ' ' ILE . 16.3 mt -126.6 156.71 40.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.631 -0.713 . . . . 1.4299999999999999 110.549 -179.623 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' ASN . . . . . 0.442 ' OD1' ' HE3' ' A' ' 26' ' ' LYS . 0.1 OUTLIER -112.68 156.6 22.48 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 121.023 -0.271 . . . . 1.1899999999999999 110.447 179.674 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.438 ' O ' ' HB2' ' A' ' 69' ' ' CYS . 83.9 t80 -45.59 -32.51 2.35 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.751 0.31 . . . . 0.40000000000000002 110.998 179.639 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -80.39 -36.86 33.28 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 112.16 0.43 . . . . 0.81000000000000005 112.16 -179.555 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -62.71 -51.54 66.79 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.473 0.654 . . . . 1.3600000000000001 109.802 179.478 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.436 ' O ' ' HG3' ' A' ' 72' ' ' MET . 35.3 t80 -61.66 -48.13 82.23 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.999 -1.0 . . . . 0.51000000000000001 110.578 179.378 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.438 ' HB2' ' O ' ' A' ' 65' ' ' PHE . 7.8 t -57.96 -48.36 80.18 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.156 -0.475 . . . . 0.75 110.528 179.86 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -48.47 -48.6 27.81 Favored Glycine 0 N--CA 1.45 -0.415 0 CA-C-N 115.72 -0.673 . . . . 0.40999999999999998 112.03 179.863 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.573 HG23 ' HE2' ' A' ' 74' ' ' LYS . 15.3 mt -63.49 -43.65 98.46 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.362 0 CA-C-O 121.153 0.502 . . . . 0.51000000000000001 110.504 179.41 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' MET . . . . . 0.436 ' HG3' ' O ' ' A' ' 68' ' ' PHE . 49.6 mtp -58.34 -26.67 63.38 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.637 -0.71 . . . . 1.01 110.076 179.535 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -72.55 -43.66 63.18 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.003 -0.544 . . . . 0.69999999999999996 110.704 179.557 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.573 ' HE2' HG23 ' A' ' 71' ' ' ILE . 48.7 pttt -73.9 -30.29 62.52 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.234 -0.439 . . . . 1.3799999999999999 111.125 -179.877 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -80.45 -47.19 14.7 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.112 0.412 . . . . 1.98 112.112 -179.694 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 48.2 mtp . . . . . 0 N--CA 1.453 -0.279 0 N-CA-C 112.065 0.395 . . . . 1.2 112.065 -179.0 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.406 ' O ' ' HG3' ' A' ' 85' ' ' MET . 5.7 t . . . . . 0 CA--C 1.528 0.099 0 CA-C-O 121.073 0.463 . . . . 7.29 111.042 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.407 ' HB2' ' OH ' ' A' ' 138' ' ' TYR . 10.5 pt-20 -55.87 -17.65 6.91 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.917 -0.583 . . . . 9.7400000000000002 112.232 -179.034 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -68.43 -56.37 8.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.917 0.389 . . . . 12.109999999999999 111.264 -179.583 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -72.99 -15.29 61.54 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.114 0.483 . . . . 10.869999999999999 110.379 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' MET . . . . . 0.701 ' HB3' HG22 ' A' ' 142' ' ' VAL . 15.0 mtt -76.37 -48.4 20.04 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.83 -0.623 . . . . 11.09 110.393 -179.779 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.428 ' O ' ' HG3' ' A' ' 90' ' ' LYS . 19.9 ttt180 -62.82 -41.95 99.52 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.546 -0.539 . . . . 15.52 109.546 179.354 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -55.16 -43.47 74.29 Favored 'General case' 0 C--O 1.233 0.214 0 N-CA-C 109.402 -0.592 . . . . 14.85 109.402 178.525 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.54 -28.37 67.74 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.541 -0.754 . . . . 14.109999999999999 110.667 179.132 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 82.4 t80 -66.84 -39.12 87.53 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 116.231 -0.44 . . . . 15.73 110.472 179.638 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' LYS . . . . . 0.428 ' HG3' ' O ' ' A' ' 86' ' ' ARG . 2.7 mtpm? -64.48 -49.14 72.57 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.27 0.557 . . . . 17.66 110.269 179.327 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 60.6 mt -62.96 -45.13 99.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.255 -0.884 . . . . 18.149999999999999 111.479 -179.228 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' PHE . . . . . 0.514 ' CG ' HG11 ' A' ' 108' ' ' VAL . 0.6 OUTLIER -68.28 -18.65 64.59 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.252 -0.431 . . . . 18.34 111.59 -179.378 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 48.2 t0 -99.01 103.9 15.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.049 0.452 . . . . 19.289999999999999 110.702 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.56 ' NE ' HG22 ' A' ' 108' ' ' VAL . 0.0 OUTLIER -67.68 -11.63 58.72 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.773 -0.649 . . . . 22.25 111.681 -179.461 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.47 ' HB2' ' OD1' ' A' ' 97' ' ' ASP . 28.2 m-20 -116.65 166.98 11.49 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.986 0.422 . . . . 23.34 111.193 -179.789 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.61 5.15 56.81 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.973 -0.632 . . . . 22.0 112.375 179.498 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' ASP . . . . . 0.47 ' OD1' ' HB2' ' A' ' 95' ' ' ASP . 7.6 p-10 -61.68 -38.13 86.67 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.665 0.269 . . . . 22.280000000000001 111.13 -179.691 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 111.34 18.73 7.93 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.738 -0.744 . . . . 19.93 112.749 179.843 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' PHE . . . . . 0.441 ' HA ' ' O ' ' A' ' 136' ' ' ILE . 92.3 m-85 -145.35 153.48 41.28 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 120.622 0.249 . . . . 20.300000000000001 110.854 179.803 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.402 HD13 ' HB3' ' A' ' 92' ' ' PHE . 63.9 mt -114.01 139.76 38.09 Favored 'Isoleucine or valine' 0 C--O 1.231 0.107 0 CA-C-O 121.014 0.435 . . . . 19.370000000000001 111.312 -179.918 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 16.5 m -121.77 156.22 59.25 Favored Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 115.747 -0.66 . . . . 22.489999999999998 110.434 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_exo -43.56 -32.95 4.11 Favored 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.498 2.132 . . . . 23.0 112.508 -179.753 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -62.55 -48.75 78.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.095 0.474 . . . . 24.559999999999999 111.248 179.91 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 104' ' ' GLU . . . . . 0.661 ' O ' HG23 ' A' ' 108' ' ' VAL . 33.5 mt-10 -73.08 -42.15 63.33 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.652 -0.704 . . . . 22.23 110.193 -179.662 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.466 HD12 ' HB ' ' A' ' 121' ' ' ILE . 1.6 tm? -48.89 -54.33 15.82 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.425 -0.807 . . . . 20.359999999999999 109.624 179.794 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.545 ' HB2' HD13 ' A' ' 121' ' ' ILE . 17.1 ttp180 -58.29 -51.11 71.15 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.19 -0.914 . . . . 27.190000000000001 110.844 179.851 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 50.3 t80 -56.23 -26.35 50.91 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.029 -0.532 . . . . 25.359999999999999 112.012 -179.147 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.661 HG23 ' O ' ' A' ' 104' ' ' GLU . 58.8 t -80.55 -55.38 8.67 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.16 0 N-CA-C 112.549 0.574 . . . . 21.059999999999999 112.549 -179.063 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 109' ' ' MET . . . . . 0.591 ' SD ' HG21 ' A' ' 116' ' ' VAL . 0.1 OUTLIER -48.58 -47.42 39.68 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.277 0.561 . . . . 20.93 110.48 -179.347 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.468 HD11 ' HG3' ' A' ' 106' ' ' ARG . 27.7 mt -60.27 -30.79 46.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.257 -0.883 . . . . 25.129999999999999 111.187 -179.806 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 111' ' ' ASN . . . . . 0.474 HD22 HH21 ' A' ' 94' ' ' ARG . 92.6 m-20 -72.9 -28.99 62.81 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.22 -0.445 . . . . 23.32 110.846 179.29 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.454 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 6.5 mt -76.06 -27.64 57.33 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.159 -0.473 . . . . 21.07 110.695 -179.889 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 121.77 12.1 5.64 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.865 -0.683 . . . . 23.050000000000001 112.441 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -117.51 135.21 54.09 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.86 0.362 . . . . 22.59 111.133 -179.843 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -93.54 134.99 35.25 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.114 -0.494 . . . . 27.960000000000001 110.6 179.783 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 116' ' ' VAL . . . . . 0.591 HG21 ' SD ' ' A' ' 109' ' ' MET . 8.6 m -144.58 155.44 14.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 121.116 0.484 . . . . 24.75 111.986 -179.562 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 45.1 p -100.9 150.38 22.91 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.486 -0.779 . . . . 27.239999999999998 109.939 178.865 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -54.65 -19.74 6.72 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.736 0.303 . . . . 26.629999999999999 111.361 -179.66 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -78.73 -54.19 6.35 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.28 -0.418 . . . . 29.140000000000001 111.824 -179.364 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 120' ' ' GLU . . . . . 0.471 ' OE1' HG12 ' A' ' 116' ' ' VAL . 13.5 pt-20 -61.34 -36.52 80.39 Favored 'General case' 0 C--O 1.233 0.237 0 N-CA-C 111.612 0.227 . . . . 24.190000000000001 111.612 -179.171 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.545 HD13 ' HB2' ' A' ' 106' ' ' ARG . 22.0 pt -73.47 -37.61 51.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 C-N-CA 121.041 -0.264 . . . . 22.329999999999998 111.017 179.86 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 122' ' ' ASP . . . . . 0.519 ' N ' HG13 ' A' ' 121' ' ' ILE . 17.4 t70 -59.36 -38.36 80.23 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.991 0.425 . . . . 24.289999999999999 110.179 179.27 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -65.35 -49.97 67.36 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.863 -0.608 . . . . 24.739999999999998 110.474 179.542 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.435 ' SD ' ' HE2' ' A' ' 148' ' ' LYS . 56.3 ttp -52.44 -46.01 66.23 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.375 -0.375 . . . . 19.710000000000001 110.717 179.641 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.547 HG23 HD11 ' A' ' 136' ' ' ILE . 79.2 mt -61.6 -33.48 57.43 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 CA-C-N 116.072 -0.513 . . . . 19.949999999999999 110.742 179.476 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 16.7 tpt85 -65.74 -36.14 82.73 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.261 -0.427 . . . . 24.949999999999999 110.994 -179.613 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -62.48 -43.5 98.67 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.939 -0.573 . . . . 18.690000000000001 111.663 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.657 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -87.75 -18.64 28.97 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.303 -0.408 . . . . 16.469999999999999 111.756 -179.301 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 129' ' ' ASP . . . . . 0.461 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 22.3 t70 -93.75 106.65 18.61 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.027 0.441 . . . . 20.399999999999999 111.124 -179.627 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 79.1 m-85 -91.6 -33.0 15.29 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.824 -0.626 . . . . 21.43 110.669 179.839 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -64.12 -18.74 64.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.12 -0.491 . . . . 23.370000000000001 110.555 179.74 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 64.98 19.1 65.36 Favored Glycine 0 N--CA 1.45 -0.388 0 CA-C-N 115.632 -0.713 . . . . 24.32 112.467 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 7.8 p30 -86.29 3.89 41.35 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.608 0.242 . . . . 23.879999999999999 111.458 -179.749 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 62.09 23.28 63.74 Favored Glycine 0 N--CA 1.453 -0.221 0 C-N-CA 120.653 -0.785 . . . . 22.670000000000002 112.369 -179.854 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 92.8 mmm -130.73 145.54 51.97 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 110.36 -0.237 . . . . 22.91 110.36 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.607 HG23 ' HB2' ' A' ' 140' ' ' GLU . 50.4 mm -115.44 145.36 21.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.325 0.583 . . . . 18.41 112.104 -179.555 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 137' ' ' ASN . . . . . 0.471 ' O ' ' N ' ' A' ' 139' ' ' GLU . 29.1 p-10 -122.99 158.43 30.51 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.157 -0.929 . . . . 16.82 108.753 178.239 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.419 ' O ' HG23 ' A' ' 142' ' ' VAL . 18.0 t80 -38.5 -23.72 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 112.193 0.442 . . . . 14.65 112.193 -179.746 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 139' ' ' GLU . . . . . 0.471 ' N ' ' O ' ' A' ' 137' ' ' ASN . 45.0 mt-10 -80.46 -56.14 4.39 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.678 0.275 . . . . 14.82 111.517 -179.454 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.607 ' HB2' HG23 ' A' ' 136' ' ' ILE . 34.3 mt-10 -63.13 -34.94 78.69 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.077 0.465 . . . . 17.460000000000001 110.506 179.944 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.474 ' CZ ' HG21 ' A' ' 145' ' ' ILE . 88.0 t80 -63.74 -55.51 22.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.746 -0.661 . . . . 12.93 110.51 179.725 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.701 HG22 ' HB3' ' A' ' 85' ' ' MET . 4.6 t -48.28 -42.54 11.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.79 -0.641 . . . . 10.699999999999999 111.732 179.353 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 143' ' ' TRP . . . . . 0.474 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 83.4 t90 -61.76 -55.32 31.36 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.53 0.567 . . . . 13.66 112.53 -178.704 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 144' ' ' MET . . . . . 0.657 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 11.9 ptt? -64.02 -40.04 95.45 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 112.797 0.666 . . . . 14.5 112.797 -177.653 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 145' ' ' ILE . . . . . 0.474 HG21 ' CZ ' ' A' ' 141' ' ' PHE . 37.2 pt -65.42 -29.09 46.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 N-CA-C 111.931 0.345 . . . . 11.25 111.931 -179.268 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 146' ' ' SER . . . . . 0.457 ' HB3' ' NE2' ' A' ' 147' ' ' GLN . 41.7 t -69.09 -32.98 72.8 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.901 0.381 . . . . 8.5399999999999991 110.459 -179.751 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 147' ' ' GLN . . . . . 0.474 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 8.6 mm-40 -95.98 -16.04 21.94 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.912 -0.585 . . . . 11.869999999999999 111.478 -179.895 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 148' ' ' LYS . . . . . 0.451 ' HG3' ' O ' ' A' ' 144' ' ' MET . 68.9 mttt . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.293 -0.861 . . . . 13.68 111.183 179.661 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.439 HD13 ' CZ ' ' A' ' 12' ' ' PHE . 39.3 mt . . . . . 0 CA--C 1.528 0.117 0 CA-C-O 120.918 0.39 . . . . 1.27 110.602 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 66.4 p -66.49 -159.94 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.81 -0.632 . . . . 1.1200000000000001 111.651 -179.635 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -76.78 -45.22 29.77 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.345 -0.389 . . . . 2.2000000000000002 110.948 -179.508 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.79 -39.26 70.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.99 -0.55 . . . . 1.3500000000000001 110.687 -179.782 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 80.3 mt-30 -60.94 -47.33 86.93 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.961 -0.563 . . . . 2.2200000000000002 110.659 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.448 ' HA ' ' CZ ' ' A' ' 12' ' ' PHE . 66.8 mt -59.7 -54.3 36.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.087 -0.506 . . . . 0.54000000000000004 110.897 179.712 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.31 -18.7 51.43 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.253 -0.43 . . . . 0.5 111.682 -179.707 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -74.21 -56.87 4.4 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.617 0.246 . . . . 2.27 111.65 -179.491 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.448 ' CZ ' ' HA ' ' A' ' 9' ' ' ILE . 9.5 p90 -79.4 -20.85 46.6 Favored 'General case' 0 C--N 1.332 -0.158 0 C-N-CA 120.598 -0.441 . . . . 0.37 110.747 -179.9 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.424 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 19.7 tptm -70.28 -39.32 74.98 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.204 -0.665 . . . . 1.23 109.204 178.644 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -64.93 -47.53 77.4 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 108.735 -0.839 . . . . 0.44 108.735 177.911 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.45 -28.88 70.12 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.429 -0.805 . . . . 0.28999999999999998 110.02 178.581 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.424 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 30.1 t80 -67.33 -40.98 85.97 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.546 -0.752 . . . . 0.47999999999999998 110.238 179.364 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -68.83 -28.27 39.11 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.784 0 CA-C-N 115.73 -0.668 . . . . 1.1100000000000001 110.972 -179.82 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 83.7 mm-40 -61.5 -33.11 73.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.597 -0.729 . . . . 1.6000000000000001 111.332 -179.96 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -93.74 -5.83 47.48 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.497 -0.319 . . . . 0.64000000000000001 111.45 -179.617 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -95.14 78.39 3.51 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.901 0.382 . . . . 0.44 110.467 179.301 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 29.7 mmmt -90.94 -33.24 15.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.945 -0.57 . . . . 2.1000000000000001 111.19 -179.636 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -62.43 -23.98 67.16 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.226 -0.443 . . . . 1.8 111.177 -179.782 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 87.09 11.41 69.88 Favored Glycine 0 N--CA 1.453 -0.213 0 C-N-CA 120.758 -0.734 . . . . 0.46000000000000002 112.627 179.774 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 30.3 p -86.1 11.26 12.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.778 0.323 . . . . 0.40000000000000002 111.139 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 55.26 25.11 39.14 Favored Glycine 0 C--N 1.332 0.327 0 C-N-CA 120.813 -0.708 . . . . 0.33000000000000002 112.227 -179.824 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.651 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 42.5 mtpt -134.09 155.8 49.4 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.788 0.327 . . . . 1.1000000000000001 111.032 -179.58 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.52 HG13 ' HB2' ' A' ' 63' ' ' LEU . 30.8 pt -114.96 136.18 52.47 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.325 0 N-CA-C 112.27 0.47 . . . . 0.5 112.27 -178.825 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.92 135.35 57.55 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.262 -0.426 . . . . 0.29999999999999999 111.343 179.734 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.575 ' HA ' HD11 ' A' ' 63' ' ' LEU . 9.9 t -65.75 -23.35 66.72 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.996 -0.547 . . . . 1.03 111.179 -179.894 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 29.9 mtp180 -77.79 -2.57 37.02 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.069 -0.514 . . . . 3.0800000000000001 110.372 179.556 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -111.79 -6.18 14.33 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.759 -0.655 . . . . 2.2599999999999998 110.872 179.995 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -51.78 -50.94 59.73 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.944 -0.571 . . . . 1.3700000000000001 110.46 179.675 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -58.78 -43.02 96.73 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.63 -0.795 . . . . 0.32000000000000001 111.828 179.515 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 31.1 m -59.15 -32.24 69.7 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.989 0.424 . . . . 0.31 110.516 179.428 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.3 mt -67.51 -41.23 84.76 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 115.851 -0.613 . . . . 1.24 110.643 179.771 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' MET . . . . . 0.569 ' HG3' ' HG3' ' A' ' 43' ' ' PRO . 14.6 mmt -66.91 -25.66 66.48 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.013 -0.539 . . . . 1.1000000000000001 110.741 179.894 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -74.85 -47.82 28.27 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.855 -0.611 . . . . 2.6899999999999999 110.954 179.453 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.519 HG23 ' HG ' ' A' ' 39' ' ' LEU . 9.9 t -70.52 -13.69 62.21 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.98 0.419 . . . . 1.0600000000000001 111.033 179.758 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.519 ' HG ' HG23 ' A' ' 38' ' ' THR . 57.4 mt -113.85 156.65 23.53 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.92 -0.582 . . . . 1.26 110.626 -179.798 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -52.92 -11.44 1.36 Allowed Glycine 0 CA--C 1.521 0.45 0 C-N-CA 121.178 -0.534 . . . . 0.68999999999999995 113.269 -179.764 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -58.63 166.03 1.99 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.931 0.396 . . . . 1.97 111.181 179.673 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 46.3 t30 -172.55 73.72 0.44 Allowed Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 115.884 -0.598 . . . . 2.6600000000000001 110.513 179.795 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.569 ' HG3' ' HG3' ' A' ' 36' ' ' MET . 83.1 Cg_endo -80.18 158.34 23.33 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.741 2.294 . . . . 0.51000000000000001 112.712 -179.779 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.0 p -67.83 146.32 53.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.98 -0.555 . . . . 0.72999999999999998 110.932 179.55 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.1 tt0 -48.38 -49.23 35.51 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.86 0.362 . . . . 2.7000000000000002 110.791 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.22 -44.81 88.37 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.998 -0.546 . . . . 0.46000000000000002 111.127 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -54.28 -46.42 72.7 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.248 -0.433 . . . . 2.23 110.935 -179.939 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 37.8 mt -60.84 -45.16 95.59 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.337 -0.392 . . . . 1.3600000000000001 110.826 179.702 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 81.7 mm-40 -64.67 -27.51 68.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.455 -0.339 . . . . 1.22 111.161 -179.674 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 43.5 m-20 -74.8 -55.07 6.21 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.477 -0.328 . . . . 0.62 111.633 -179.652 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 2.4 pp -67.38 -41.12 85.55 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.468 -0.333 . . . . 0.39000000000000001 111.701 -179.316 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 76.9 mt -62.77 -45.88 97.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 120.637 0.256 . . . . 0.5 110.853 -179.94 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.89 -33.68 75.19 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.886 0.374 . . . . 0.58999999999999997 110.516 179.53 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -63.6 -44.31 94.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.985 -0.552 . . . . 2.54 110.004 179.302 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -79.7 -16.89 54.85 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.915 -0.584 . . . . 0.53000000000000003 110.871 179.253 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -73.55 -43.0 60.95 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.122 -0.49 . . . . 1.95 111.035 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -102.87 47.83 0.88 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.143 -0.48 . . . . 2.48 111.118 -179.826 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -167.55 -55.17 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.2 -0.454 . . . . 2.48 110.927 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 18.3 m120 -97.4 24.85 6.12 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.171 -0.468 . . . . 2.0499999999999998 110.751 179.846 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 37.1 m-20 64.81 -80.08 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 115.89 -0.595 . . . . 1.47 111.239 179.904 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -165.88 18.97 0.1 OUTLIER Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.804 -0.712 . . . . 0.42999999999999999 112.418 179.943 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.651 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 10.0 mm-40 -128.31 155.49 44.55 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.96 0.409 . . . . 0.38 111.373 -179.837 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.575 HD11 ' HA ' ' A' ' 29' ' ' THR . 14.8 mt -126.09 155.46 41.56 Favored 'General case' 0 C--O 1.222 -0.361 0 CA-C-N 115.834 -0.621 . . . . 1.4299999999999999 110.7 -179.631 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' ASN . . . . . 0.477 ' HB2' ' HG3' ' A' ' 67' ' ' GLU . 1.4 m-20 -111.68 156.51 21.75 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.652 -0.249 . . . . 1.1899999999999999 110.552 -179.607 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 90.0 t80 -43.86 -39.53 3.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.427 -0.351 . . . . 0.40000000000000002 111.399 -179.524 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -70.48 -39.07 74.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.528 -0.306 . . . . 0.81000000000000005 111.67 -179.878 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.477 ' HG3' ' HB2' ' A' ' 64' ' ' ASN . 14.0 mt-10 -62.06 -53.64 52.66 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.426 0.631 . . . . 1.3600000000000001 109.695 179.523 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.444 ' O ' ' HG2' ' A' ' 72' ' ' MET . 31.3 t80 -59.69 -54.98 40.05 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.934 -1.03 . . . . 0.51000000000000001 110.497 179.309 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 36.2 t -51.02 -53.97 28.81 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-N 116.169 -0.469 . . . . 0.75 110.458 179.506 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -41.82 -54.71 4.22 Favored Glycine 0 N--CA 1.451 -0.305 0 CA-C-N 115.281 -0.872 . . . . 0.40999999999999998 112.462 179.702 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.737 HG23 ' HE2' ' A' ' 74' ' ' LYS . 14.0 mt -64.84 -48.91 82.41 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.26 0 CA-C-O 121.037 0.446 . . . . 0.51000000000000001 110.946 179.692 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' MET . . . . . 0.444 ' HG2' ' O ' ' A' ' 68' ' ' PHE . 81.2 mmm -47.79 -36.82 12.32 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.833 -0.622 . . . . 1.01 110.042 179.289 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -63.73 -55.34 23.99 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.415 -0.812 . . . . 0.69999999999999996 110.974 179.407 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.737 ' HE2' HG23 ' A' ' 71' ' ' ILE . 61.1 pttt -60.17 -33.32 72.03 Favored 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 112.017 0.377 . . . . 1.3799999999999999 112.017 -179.199 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 65.1 mt-30 -78.82 -51.96 9.0 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 111.77 0.285 . . . . 1.98 111.77 -179.873 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 2.2 mmm . . . . . 0 N--CA 1.45 -0.467 0 CA-C-N 116.336 -0.393 . . . . 1.2 111.68 -179.431 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.624 ' O ' ' HG3' ' A' ' 85' ' ' MET . 13.5 m . . . . . 0 N--CA 1.455 -0.194 0 CA-C-O 120.799 0.333 . . . . 7.29 110.692 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.447 ' CD ' ' H ' ' A' ' 82' ' ' GLU . 1.9 mp0 -39.54 -49.51 2.14 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 115.381 -0.827 . . . . 9.7400000000000002 112.973 -178.589 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -56.7 -43.62 80.71 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.86 0.362 . . . . 12.109999999999999 111.199 -179.463 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -75.25 -14.53 60.53 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.058 -0.519 . . . . 10.869999999999999 111.248 -179.596 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' MET . . . . . 0.624 ' HG3' ' O ' ' A' ' 81' ' ' THR . 4.5 mtt -80.55 -30.69 37.06 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 121.181 0.515 . . . . 11.09 110.081 -179.889 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 20.9 ttt180 -78.81 -45.44 20.91 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.383 -0.826 . . . . 15.52 110.6 -179.697 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -66.14 -42.58 88.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.125 -0.489 . . . . 14.85 110.872 179.63 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.1 -39.26 86.7 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.24 -0.436 . . . . 14.109999999999999 111.257 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -59.2 -42.24 90.44 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.043 0.449 . . . . 15.73 110.61 179.86 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 5.5 mtpm? -63.32 -43.15 98.62 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.707 -0.679 . . . . 17.66 111.274 179.798 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 83.4 mt -62.67 -50.58 79.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.188 -0.46 . . . . 18.149999999999999 111.624 -179.531 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -64.67 -38.74 92.03 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.559 -0.291 . . . . 18.34 111.332 -179.504 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 29.3 t0 -66.27 91.97 0.18 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.046 0.45 . . . . 19.289999999999999 110.27 179.597 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 2.7 mmp_? -62.05 -2.31 0.89 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.692 -0.686 . . . . 22.25 112.156 -179.316 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 40.8 m-20 -124.78 177.95 5.73 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.942 0.401 . . . . 23.34 110.968 179.66 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.55 -4.41 54.81 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.947 -0.644 . . . . 22.0 111.947 179.29 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.88 -39.25 87.44 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.76 0.314 . . . . 22.280000000000001 111.324 -179.919 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 104.2 40.72 2.21 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.741 -0.742 . . . . 19.93 112.312 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' PHE . . . . . 0.449 ' HA ' ' O ' ' A' ' 136' ' ' ILE . 95.6 m-85 -143.62 142.04 30.87 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.675 0.274 . . . . 20.300000000000001 110.86 -179.96 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.509 ' HB ' ' HB ' ' A' ' 136' ' ' ILE . 56.6 mt -114.22 120.94 65.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.196 0 CA-C-O 121.069 0.462 . . . . 19.370000000000001 111.1 -179.937 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 31.8 p -114.38 156.18 44.81 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 115.799 -0.637 . . . . 22.489999999999998 110.564 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -40.58 -36.06 1.69 Allowed 'Trans proline' 0 C--N 1.349 0.589 0 C-N-CA 122.592 2.195 . . . . 23.0 112.66 -179.6 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.458 ' O ' ' HG3' ' A' ' 106' ' ' ARG . . . -68.04 -55.41 12.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.078 0.466 . . . . 24.559999999999999 111.172 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -62.49 -31.1 71.79 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.924 -0.58 . . . . 22.23 110.956 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.619 HD23 ' HB ' ' A' ' 121' ' ' ILE . 37.2 tp -68.42 -55.28 12.44 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.715 -0.675 . . . . 20.359999999999999 112.004 -178.45 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.459 ' HB3' HD13 ' A' ' 121' ' ' ILE . 0.3 OUTLIER -57.07 -40.22 76.46 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.758 0.313 . . . . 27.190000000000001 111.485 -179.003 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 21.1 t80 -58.02 -54.17 49.93 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.361 -0.381 . . . . 25.359999999999999 111.255 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.412 ' O ' HD12 ' A' ' 112' ' ' LEU . 48.3 t -67.9 -40.73 83.98 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.197 0 CA-C-N 116.725 -0.216 . . . . 21.059999999999999 111.332 -179.764 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -50.8 -38.6 49.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.846 0.355 . . . . 20.93 110.791 179.972 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.685 ' HA ' ' HA ' ' A' ' 114' ' ' GLU . 88.0 mt -67.27 -24.12 31.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.044 -0.525 . . . . 25.129999999999999 111.244 179.648 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -72.56 -21.27 61.18 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.069 -0.514 . . . . 23.32 110.354 179.167 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.412 HD12 ' O ' ' A' ' 108' ' ' VAL . 6.2 mp -93.76 -84.8 0.3 Allowed 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.168 -0.469 . . . . 21.07 111.415 -179.966 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 113' ' ' GLY . . . . . 0.484 ' O ' ' HG2' ' A' ' 114' ' ' GLU . . . -117.49 -1.64 17.88 Favored Glycine 0 C--N 1.334 0.435 0 C-N-CA 120.702 -0.761 . . . . 23.050000000000001 112.696 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 114' ' ' GLU . . . . . 0.685 ' HA ' ' HA ' ' A' ' 110' ' ' ILE . 9.1 pt-20 42.62 -170.12 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 114.284 1.216 . . . . 22.59 114.284 179.137 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.609 ' HG2' ' HG3' ' A' ' 114' ' ' GLU . 3.4 mmmp? 66.11 54.64 0.96 Allowed 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 114.535 -1.212 . . . . 27.960000000000001 111.548 -179.81 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 116' ' ' VAL . . . . . 0.543 ' HB ' HG23 ' A' ' 121' ' ' ILE . 1.5 m -130.11 115.38 32.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.998 -0.546 . . . . 24.75 110.991 178.837 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 72.9 p -69.32 146.69 51.99 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.186 -0.461 . . . . 27.239999999999998 110.257 179.713 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 118' ' ' ASP . . . . . 0.478 ' HA ' HD11 ' A' ' 121' ' ' ILE . 9.2 m-20 -53.63 -17.46 2.19 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.244 -0.434 . . . . 26.629999999999999 111.102 -179.897 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 0.402 ' O ' ' HG2' ' A' ' 123' ' ' GLU . 46.9 mt-10 -79.77 -55.48 4.97 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.299 -0.41 . . . . 29.140000000000001 111.81 -179.559 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 120' ' ' GLU . . . . . 0.472 ' OE1' HG12 ' A' ' 116' ' ' VAL . 13.5 pt-20 -58.07 -43.69 87.1 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 120.551 0.215 . . . . 24.190000000000001 111.395 -179.311 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.619 ' HB ' HD23 ' A' ' 105' ' ' LEU . 1.8 pt -68.68 -40.17 81.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 C-N-CA 121.037 -0.265 . . . . 22.329999999999998 111.127 179.795 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -61.41 -42.05 98.12 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.753 0.311 . . . . 24.289999999999999 110.5 179.583 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 123' ' ' GLU . . . . . 0.402 ' HG2' ' O ' ' A' ' 119' ' ' GLU . 20.3 mm-40 -57.71 -45.09 86.19 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.24 -0.436 . . . . 24.739999999999998 110.264 179.419 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 58.6 ttp -57.57 -37.15 72.66 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.068 -0.515 . . . . 19.710000000000001 110.292 179.1 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.544 HG23 HD11 ' A' ' 136' ' ' ILE . 64.4 mt -66.66 -42.3 89.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 115.858 -0.61 . . . . 19.949999999999999 110.414 179.386 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 66.0 ttt180 -59.6 -37.29 78.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.794 -0.639 . . . . 24.949999999999999 110.931 179.739 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -63.99 -33.16 75.11 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.054 -0.521 . . . . 18.690000000000001 111.344 -179.762 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.681 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -95.86 -17.55 21.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.474 -0.33 . . . . 16.469999999999999 111.305 -179.824 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 129' ' ' ASP . . . . . 0.427 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 14.4 t0 -94.31 100.51 12.54 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.211 -0.449 . . . . 20.399999999999999 110.761 -179.852 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 88.1 m-85 -85.34 -43.07 14.01 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.899 -0.591 . . . . 21.43 111.462 -179.446 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -60.05 -24.19 64.35 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.413 -0.358 . . . . 23.370000000000001 110.798 -179.714 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 66.17 78.02 0.25 Allowed Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.91 -0.662 . . . . 24.32 112.855 179.655 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -135.29 -27.1 1.23 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.769 0.318 . . . . 23.879999999999999 110.935 179.715 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 102.9 13.47 29.37 Favored Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.82 -0.705 . . . . 22.670000000000002 112.681 179.875 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 70.2 mtp -133.05 153.63 51.32 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.677 0.275 . . . . 22.91 110.586 179.805 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.59 HG23 ' HB2' ' A' ' 140' ' ' GLU . 42.3 mm -114.95 145.65 20.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 121.282 0.563 . . . . 18.41 111.987 -179.579 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 137' ' ' ASN . . . . . 0.43 ' OD1' ' HB2' ' A' ' 139' ' ' GLU . 1.0 OUTLIER -119.93 157.19 29.29 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.171 -0.922 . . . . 16.82 108.965 178.136 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 79.9 t80 -39.99 -23.96 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 112.06 0.393 . . . . 14.65 112.06 -179.6 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 139' ' ' GLU . . . . . 0.43 ' HB2' ' OD1' ' A' ' 137' ' ' ASN . 38.5 mt-10 -80.76 -56.13 4.35 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 120.697 0.284 . . . . 14.82 111.18 -179.223 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.59 ' HB2' HG23 ' A' ' 136' ' ' ILE . 59.8 mt-10 -60.46 -34.8 74.53 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.341 -0.391 . . . . 17.460000000000001 110.353 -179.927 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.451 ' CZ ' HG21 ' A' ' 145' ' ' ILE . 85.3 t80 -63.96 -55.0 25.67 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.0 -0.545 . . . . 12.93 110.125 179.174 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 142' ' ' VAL . . . . . 0.582 HG13 ' SD ' ' A' ' 85' ' ' MET . 2.6 t -47.91 -36.82 5.89 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-N 115.464 -0.789 . . . . 10.699999999999999 111.79 179.306 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 143' ' ' TRP . . . . . 0.546 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 91.5 t90 -69.79 -55.96 8.43 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.824 0.675 . . . . 13.66 112.824 -178.737 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 144' ' ' MET . . . . . 0.681 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 18.7 ptt? -63.91 -23.57 67.4 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 113.175 0.805 . . . . 14.5 113.175 -177.521 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 145' ' ' ILE . . . . . 0.537 HG13 ' N ' ' A' ' 146' ' ' SER . 49.2 pt -80.49 -40.7 19.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 N-CA-C 112.399 0.518 . . . . 11.25 112.399 -179.28 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 146' ' ' SER . . . . . 0.537 ' N ' HG13 ' A' ' 145' ' ' ILE . 78.7 p -61.21 -13.79 20.88 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.181 0.515 . . . . 8.5399999999999991 110.55 -179.71 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 147' ' ' GLN . . . . . 0.546 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 3.1 mm100 -98.49 -19.11 17.84 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.377 -0.828 . . . . 11.869999999999999 111.289 -179.16 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 148' ' ' LYS . . . . . 0.406 ' HG3' ' O ' ' A' ' 144' ' ' MET . 99.1 mttt . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.234 -0.889 . . . . 13.68 110.959 179.749 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.403 ' HB2' ' CD2' ' A' ' 4' ' ' LEU . 97.7 p . . . . . 0 N--CA 1.485 1.313 0 CA-C-O 120.559 0.218 . . . . 4.8899999999999997 110.79 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -159.29 51.58 0.36 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.92 0.391 . . . . 3.2599999999999998 111.806 -179.665 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.502 ' H ' HD22 ' A' ' 4' ' ' LEU . 0.6 OUTLIER -90.21 138.39 31.57 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.172 -0.467 . . . . 1.27 110.35 179.237 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 74.0 p -70.01 -177.63 1.39 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.42 -0.355 . . . . 1.1200000000000001 111.341 -179.766 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -63.41 -48.02 79.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.435 -0.348 . . . . 2.2000000000000002 111.492 -179.616 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -67.14 -41.54 85.91 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.976 0.417 . . . . 1.3500000000000001 110.906 -179.425 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 21.6 mm-40 -64.28 -45.63 87.2 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.822 -0.627 . . . . 2.2200000000000002 111.037 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.532 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 56.5 mt -58.1 -51.16 74.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.432 -0.349 . . . . 0.54000000000000004 110.543 179.526 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.87 -19.26 65.7 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.149 -0.478 . . . . 0.5 111.189 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -72.44 -56.57 5.21 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.275 -0.42 . . . . 2.27 111.777 -179.275 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.532 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 28.1 p90 -79.03 -24.41 43.67 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 120.532 -0.467 . . . . 0.37 110.625 -179.739 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 19.7 tptm -66.62 -37.13 84.23 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 109.174 -0.676 . . . . 1.23 109.174 178.525 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.519 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 27.4 t70 -66.97 -50.7 61.48 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 109.121 -0.696 . . . . 0.44 109.121 178.332 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.81 -14.51 59.43 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.679 -0.692 . . . . 0.28999999999999998 110.612 179.042 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 75.5 t80 -80.08 -47.76 14.31 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.845 -0.616 . . . . 0.47999999999999998 110.647 -179.677 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 26.8 m -69.65 -20.49 23.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.142 -0.481 . . . . 1.1100000000000001 110.302 179.525 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.519 ' HG3' ' O ' ' A' ' 14' ' ' ASP . 74.5 mt-30 -58.97 -35.5 73.3 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.729 -0.669 . . . . 1.6000000000000001 111.02 179.434 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 88.1 m-85 -105.91 44.16 1.07 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.276 -0.42 . . . . 0.64000000000000001 111.509 -179.499 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -135.27 70.4 1.44 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.017 0.437 . . . . 0.44 110.72 179.463 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.438 ' N ' ' HD2' ' A' ' 21' ' ' LYS . 0.9 OUTLIER -78.24 -25.95 47.09 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.92 -0.582 . . . . 2.1000000000000001 110.89 179.983 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -70.3 -11.75 61.12 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.011 -0.54 . . . . 1.8 111.213 -179.625 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.46 17.22 66.27 Favored Glycine 0 C--N 1.33 0.208 0 C-N-CA 120.857 -0.687 . . . . 0.46000000000000002 112.898 179.655 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 60.0 p -90.39 8.24 34.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.751 0.31 . . . . 0.40000000000000002 111.181 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 57.93 19.59 37.8 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.854 -0.688 . . . . 0.33000000000000002 112.126 -179.702 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.513 ' HD3' ' OD1' ' A' ' 64' ' ' ASN . 20.7 mtmm -128.23 154.54 45.74 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.928 0.394 . . . . 1.1000000000000001 111.205 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.43 HG13 ' O ' ' A' ' 27' ' ' ILE . 45.7 pt -120.64 129.27 75.79 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.111 -0.495 . . . . 0.5 110.823 179.567 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -53.24 134.88 39.17 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.803 0.335 . . . . 0.29999999999999999 110.882 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 5.9 t -61.2 -17.19 51.89 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.096 -0.502 . . . . 1.03 110.869 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 59.1 mtt180 -78.79 -19.12 52.91 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.885 -0.598 . . . . 3.0800000000000001 110.488 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 33.3 mm-40 -97.28 -2.05 43.42 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.656 -0.702 . . . . 2.2599999999999998 110.9 179.813 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.556 HD23 HD22 ' A' ' 63' ' ' LEU . 0.4 OUTLIER -55.64 -54.79 39.84 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.908 -0.587 . . . . 1.3700000000000001 110.956 -179.956 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -56.14 -39.4 80.57 Favored Glycine 0 C--N 1.331 0.274 0 C-N-CA 120.654 -0.784 . . . . 0.32000000000000001 112.152 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 32.1 m -65.4 -35.96 82.51 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.995 0.426 . . . . 0.31 110.645 179.584 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 24.4 tp -68.52 -36.62 79.11 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.896 -0.593 . . . . 1.24 110.677 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.539 ' HG3' ' HG3' ' A' ' 43' ' ' PRO . 23.2 mmt -62.27 -42.0 98.96 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.273 -0.421 . . . . 1.1000000000000001 109.925 179.098 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -63.92 -33.39 75.59 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.771 -0.65 . . . . 2.6899999999999999 109.691 179.033 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.4 m -72.57 -16.92 61.75 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.315 -0.857 . . . . 1.0600000000000001 110.385 179.352 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 95.1 mt -114.0 157.24 22.73 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.663 -0.698 . . . . 1.26 110.641 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -52.98 -9.88 0.93 Allowed Glycine 0 CA--C 1.521 0.434 0 C-N-CA 120.997 -0.62 . . . . 0.68999999999999995 113.245 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 73.6 mm-40 -66.29 174.45 2.64 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.941 0.401 . . . . 1.97 111.314 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -173.01 67.91 0.37 Allowed Pre-proline 0 C--N 1.331 -0.231 0 CA-C-N 115.805 -0.634 . . . . 2.6600000000000001 110.336 179.688 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.539 ' HG3' ' HG3' ' A' ' 36' ' ' MET . 47.0 Cg_endo -67.87 148.09 75.97 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.595 2.197 . . . . 0.51000000000000001 112.332 -179.8 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 12.4 m -64.68 154.26 37.13 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.09 -0.505 . . . . 0.72999999999999998 110.543 179.811 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.401 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 7.1 tp10 -49.62 -55.07 14.96 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.681 0.276 . . . . 2.7000000000000002 111.22 -179.404 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.63 -46.03 70.34 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.227 -0.442 . . . . 0.46000000000000002 111.507 -179.726 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -51.38 -54.52 25.71 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.335 -0.393 . . . . 2.23 111.146 -179.8 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 47.3 mt -56.9 -40.91 77.17 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.731 0.3 . . . . 1.3600000000000001 111.019 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.401 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 79.5 mm-40 -66.16 -27.56 68.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.885 0.374 . . . . 1.22 111.0 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 30.2 m-20 -76.73 -52.8 8.93 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.106 -0.497 . . . . 0.62 111.85 -179.397 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.4 pp -69.37 -35.45 75.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.481 -0.327 . . . . 0.39000000000000001 111.879 -179.033 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 72.8 mt -69.36 -48.59 66.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.64 0.257 . . . . 0.5 111.138 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.99 -37.37 82.25 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.882 0.372 . . . . 0.58999999999999997 110.757 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -66.58 -51.65 54.09 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.081 -0.509 . . . . 2.54 110.52 179.616 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -67.25 -14.9 63.34 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.01 -0.541 . . . . 0.53000000000000003 111.055 179.891 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -74.34 -27.29 60.62 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.283 -0.417 . . . . 1.95 110.932 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -118.28 7.83 12.13 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.173 -0.467 . . . . 2.48 110.813 179.836 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 57.3 t30 -122.97 -12.68 7.95 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.196 -0.456 . . . . 2.48 110.977 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -140.46 27.18 2.1 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.218 -0.446 . . . . 2.0499999999999998 110.886 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 4.0 m-20 62.01 -85.18 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.917 -0.583 . . . . 1.47 111.118 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -151.85 -3.05 0.19 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.755 -0.736 . . . . 0.42999999999999999 112.409 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.427 HE22 ' N ' ' A' ' 27' ' ' ILE . 0.0 OUTLIER -115.05 154.9 28.01 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.07 0.462 . . . . 0.38 111.071 179.966 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.587 ' HG ' ' HB2' ' A' ' 67' ' ' GLU . 0.8 OUTLIER -119.6 156.17 30.89 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.691 -0.686 . . . . 1.4299999999999999 109.96 -179.795 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ASN . . . . . 0.588 ' HB2' ' HG2' ' A' ' 67' ' ' GLU . 52.7 m-80 -111.26 156.4 21.55 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 121.098 0.475 . . . . 1.1899999999999999 111.719 -178.674 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 84.0 t80 -48.11 -41.64 26.98 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.348 -0.842 . . . . 0.40000000000000002 109.96 178.757 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.68 -36.22 82.01 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.483 -0.781 . . . . 0.81000000000000005 111.337 179.421 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.588 ' HG2' ' HB2' ' A' ' 64' ' ' ASN . 8.8 mm-40 -64.69 -55.04 22.51 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.192 -0.458 . . . . 1.3600000000000001 110.004 179.524 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.436 ' HD1' HD21 ' A' ' 32' ' ' LEU . 43.4 t80 -59.2 -54.18 49.89 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.829 -0.623 . . . . 0.51000000000000001 110.541 179.378 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 35.2 t -52.77 -49.31 65.81 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 116.119 -0.491 . . . . 0.75 110.276 179.526 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -43.84 -50.72 7.23 Favored Glycine 0 N--CA 1.451 -0.342 0 CA-C-N 115.613 -0.721 . . . . 0.40999999999999998 112.23 179.225 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.87 HG23 ' HE2' ' A' ' 74' ' ' LYS . 13.5 mt -66.81 -51.4 55.98 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.261 0 CA-C-O 120.912 0.386 . . . . 0.51000000000000001 110.78 179.41 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' MET . . . . . 0.454 ' O ' ' HG3' ' A' ' 76' ' ' MET . 83.8 mmm -45.91 -36.47 5.45 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.932 -0.576 . . . . 1.01 109.766 179.192 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -63.21 -55.03 28.4 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.253 -0.885 . . . . 0.69999999999999996 110.622 179.312 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.87 ' HE2' HG23 ' A' ' 71' ' ' ILE . 58.6 pttt -61.0 -28.62 69.17 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.296 -0.411 . . . . 1.3799999999999999 110.84 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 91.2 mt-30 -77.68 -42.17 35.49 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.233 -0.439 . . . . 1.98 111.266 179.438 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' MET . . . . . 0.502 ' SD ' HD12 ' A' ' 4' ' ' LEU . 2.8 mtt -62.12 -22.82 66.14 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 116.258 -0.428 . . . . 1.2 110.919 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.422 HH11 ' HD2' ' A' ' 77' ' ' ARG . 13.4 mmm180 -51.44 -14.96 0.34 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.049 -0.523 . . . . 4.6900000000000004 111.782 179.887 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -56.01 -16.67 5.24 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.772 0.32 . . . . 4.0099999999999998 110.814 179.49 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 19.8 m -108.09 113.75 27.14 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.037 -0.529 . . . . 5.2800000000000002 110.799 179.847 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -93.0 38.03 1.03 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.43 -0.35 . . . . 5.5999999999999996 111.599 -179.505 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.575 ' O ' ' HG2' ' A' ' 85' ' ' MET . 9.7 t -63.52 135.12 56.63 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.57 -0.287 . . . . 7.29 110.503 179.699 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -66.55 -23.43 66.22 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 112.558 0.577 . . . . 9.7400000000000002 112.558 -178.741 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -64.45 -56.05 16.79 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-O 121.102 0.477 . . . . 12.109999999999999 111.809 -179.137 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -59.21 -19.31 44.42 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.865 -0.607 . . . . 10.869999999999999 111.118 -179.458 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' MET . . . . . 0.616 ' CB ' HG22 ' A' ' 142' ' ' VAL . 2.0 mmt -74.71 -49.85 19.66 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.137 -0.483 . . . . 11.09 110.609 -179.574 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 46.5 ttt180 -54.85 -43.17 72.81 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.036 -0.529 . . . . 15.52 110.075 179.775 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 25.3 mm-40 -60.37 -42.42 95.79 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.139 0.495 . . . . 14.85 109.973 178.829 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -69.85 -23.08 63.23 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.749 -0.66 . . . . 14.109999999999999 111.075 179.586 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 88.5 t80 -68.98 -41.56 77.75 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.389 -0.369 . . . . 15.73 110.419 179.784 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 50.0 mtmt -68.7 -39.13 80.64 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.92 -0.582 . . . . 17.66 110.646 179.552 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 81.7 mt -68.23 -44.48 84.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.038 -0.528 . . . . 18.149999999999999 111.441 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -67.69 -55.66 12.33 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.526 -0.306 . . . . 18.34 111.366 -179.646 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 41.8 t0 -55.32 99.08 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.823 0.344 . . . . 19.289999999999999 110.409 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.535 ' HG2' ' HB3' ' A' ' 104' ' ' GLU . 21.9 mmm180 -55.86 -33.08 64.21 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.125 -0.488 . . . . 22.25 110.955 -179.399 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.439 ' HB2' ' OD1' ' A' ' 97' ' ' ASP . 6.2 m-20 -101.71 170.13 8.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.189 -0.46 . . . . 23.34 110.929 -179.793 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.45 5.38 57.15 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.794 -0.717 . . . . 22.0 112.384 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.439 ' OD1' ' HB2' ' A' ' 95' ' ' ASP . 5.0 p-10 -58.7 -39.06 79.66 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.706 0.289 . . . . 22.280000000000001 111.307 -179.755 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 114.06 17.12 7.45 Favored Glycine 0 C--N 1.331 0.279 0 C-N-CA 120.698 -0.763 . . . . 19.93 112.91 179.66 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 99.2 m-85 -145.12 152.56 40.26 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 120.74 0.305 . . . . 20.300000000000001 110.829 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 61.2 mt -114.33 138.22 45.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 116.299 -0.41 . . . . 19.370000000000001 111.069 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 41.7 m -114.61 156.13 45.15 Favored Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 115.988 -0.551 . . . . 22.489999999999998 110.939 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_exo -41.76 -39.56 5.13 Favored 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 122.49 2.127 . . . . 23.0 112.281 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.71 -50.2 73.38 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.971 -0.559 . . . . 24.559999999999999 110.613 179.465 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.535 ' HB3' ' HG2' ' A' ' 94' ' ' ARG . 44.3 mt-10 -64.53 -28.37 69.6 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.442 -0.799 . . . . 22.23 111.188 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.536 HD23 ' HB ' ' A' ' 121' ' ' ILE . 38.0 tp -64.97 -55.5 18.7 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.285 -0.416 . . . . 20.359999999999999 111.429 -179.076 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.615 ' HB3' HD13 ' A' ' 121' ' ' ILE . 14.6 ptt180 -64.32 -38.76 92.2 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.852 0.358 . . . . 27.190000000000001 110.531 179.893 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 107' ' ' PHE . . . . . 0.452 ' N ' ' HG3' ' A' ' 106' ' ' ARG . 1.7 t80 -54.55 -39.37 67.64 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.957 -0.565 . . . . 25.359999999999999 111.022 -179.544 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.474 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 76.8 t -80.15 -49.65 18.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.521 -0.308 . . . . 21.059999999999999 111.37 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -50.03 -35.54 25.29 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.389 -0.369 . . . . 20.93 111.08 -179.835 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 78.1 mt -75.92 -31.22 21.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.333 -0.394 . . . . 25.129999999999999 110.565 179.505 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 95.2 m-20 -67.8 -43.34 79.9 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.07 -0.514 . . . . 23.32 110.812 179.507 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.474 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 6.2 mt -66.25 -45.33 80.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.069 -0.514 . . . . 21.07 110.826 -179.841 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 137.95 -0.15 2.61 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.922 -0.656 . . . . 23.050000000000001 112.278 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -88.61 104.63 17.02 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.734 0.302 . . . . 22.59 111.201 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -74.04 113.71 11.54 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.298 -0.41 . . . . 27.960000000000001 110.506 179.526 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' VAL . . . . . 0.413 HG12 ' OE1' ' A' ' 120' ' ' GLU . 5.3 m -138.35 155.2 28.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 121.004 0.431 . . . . 24.75 111.789 -179.574 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 117' ' ' THR . . . . . 0.417 ' O ' HG12 ' A' ' 121' ' ' ILE . 64.0 p -99.18 156.76 16.8 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.702 -0.681 . . . . 27.239999999999998 110.448 179.24 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -58.68 -21.4 54.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.41 -0.359 . . . . 26.629999999999999 111.507 -179.658 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -76.31 -55.38 5.61 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 111.874 0.324 . . . . 29.140000000000001 111.874 -179.269 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.413 ' OE1' HG12 ' A' ' 116' ' ' VAL . 15.2 pt-20 -61.71 -39.44 91.5 Favored 'General case' 0 C--O 1.234 0.237 0 N-CA-C 111.679 0.251 . . . . 24.190000000000001 111.679 -179.33 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.615 HD13 ' HB3' ' A' ' 106' ' ' ARG . 18.7 pt -71.19 -34.88 56.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 C-N-CA 120.959 -0.297 . . . . 22.329999999999998 111.251 -179.709 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.498 ' N ' HG13 ' A' ' 121' ' ' ILE . 15.0 t70 -59.01 -43.84 91.61 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.953 0.406 . . . . 24.289999999999999 110.292 179.583 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -63.85 -42.24 97.61 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.89 -0.596 . . . . 24.739999999999998 110.413 179.44 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.436 ' CE ' HD21 ' A' ' 105' ' ' LEU . 65.1 ttp -56.59 -34.04 66.79 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.15 -0.477 . . . . 19.710000000000001 110.825 179.663 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.574 HG23 HD11 ' A' ' 136' ' ' ILE . 87.0 mt -68.92 -46.09 79.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.237 -0.438 . . . . 19.949999999999999 110.371 179.592 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 27.9 tpt180 -59.57 -31.46 69.46 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.99 -0.55 . . . . 24.949999999999999 111.04 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -66.96 -40.58 87.52 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.17 -0.468 . . . . 18.690000000000001 111.302 -179.817 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.522 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -91.19 -13.59 32.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.376 -0.374 . . . . 16.469999999999999 111.094 -179.865 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 129' ' ' ASP . . . . . 0.447 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 8.7 t70 -95.99 106.72 18.92 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.151 -0.477 . . . . 20.399999999999999 111.054 -179.697 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 87.3 m-85 -98.93 -32.91 11.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.033 -0.53 . . . . 21.43 111.533 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -69.3 -15.5 63.36 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.719 0.295 . . . . 23.370000000000001 110.981 -179.734 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 132' ' ' GLY . . . . . 0.419 ' HA2' ' OD2' ' A' ' 129' ' ' ASP . . . 58.45 84.95 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.835 -0.697 . . . . 24.32 112.874 179.615 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 12.3 p-10 -147.66 -9.64 0.41 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.768 0.318 . . . . 23.879999999999999 111.004 179.745 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 80.14 18.2 72.51 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.835 -0.698 . . . . 22.670000000000002 112.43 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 40.4 mtp -137.52 155.3 49.42 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.576 0.227 . . . . 22.91 110.454 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.72 HG23 ' HB2' ' A' ' 140' ' ' GLU . 48.8 mm -114.79 142.8 26.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 121.404 0.621 . . . . 18.41 112.233 -179.242 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 137' ' ' ASN . . . . . 0.423 ' OD1' ' HB2' ' A' ' 139' ' ' GLU . 1.6 p30 -115.45 157.76 23.51 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.006 -0.997 . . . . 16.82 109.108 178.129 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.624 ' O ' HG23 ' A' ' 142' ' ' VAL . 29.0 t80 -39.12 -25.45 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 112.432 0.53 . . . . 14.65 112.432 -179.239 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.423 ' HB2' ' OD1' ' A' ' 137' ' ' ASN . 43.5 mt-10 -80.18 -55.75 4.7 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.692 0.282 . . . . 14.82 111.529 -179.149 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.72 ' HB2' HG23 ' A' ' 136' ' ' ILE . 53.3 mt-10 -61.12 -31.33 71.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.941 0.401 . . . . 17.460000000000001 110.519 -179.825 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.604 ' CE2' HD13 ' A' ' 145' ' ' ILE . 88.9 t80 -67.67 -55.7 12.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.839 -0.619 . . . . 12.93 110.606 179.726 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.624 HG23 ' O ' ' A' ' 138' ' ' TYR . 34.4 t -47.23 -43.39 7.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 115.833 -0.622 . . . . 10.699999999999999 111.964 179.523 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 82.8 t90 -65.29 -55.21 19.61 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.697 0.629 . . . . 13.66 112.697 -178.448 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 144' ' ' MET . . . . . 0.522 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 11.1 ptt? -61.78 -32.39 72.66 Favored 'General case' 0 N--CA 1.464 0.237 0 N-CA-C 112.55 0.574 . . . . 14.5 112.55 -177.996 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 145' ' ' ILE . . . . . 0.604 HD13 ' CE2' ' A' ' 141' ' ' PHE . 25.3 pt -80.71 -20.87 11.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 C-N-CA 120.779 -0.368 . . . . 11.25 111.423 179.835 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 33.2 t -67.66 -32.8 73.73 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.104 0.478 . . . . 8.5399999999999991 110.175 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 5.2 mm100 -84.6 -23.65 29.49 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.595 -0.729 . . . . 11.869999999999999 111.1 180.0 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 63.9 mttm . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.289 -0.863 . . . . 13.68 110.989 179.503 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 149' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 151' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.411 ' N ' ' HA ' ' A' ' 77' ' ' ARG . 68.1 m . . . . . 0 N--CA 1.486 1.343 0 CA-C-O 120.829 0.347 . . . . 4.8899999999999997 110.932 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -59.7 153.38 20.38 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.0 -0.545 . . . . 3.2599999999999998 110.881 179.801 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 21.4 mt -67.75 89.77 0.27 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.253 -0.43 . . . . 1.27 110.919 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.554 HG22 ' H ' ' A' ' 6' ' ' GLU . 0.2 OUTLIER -73.44 -171.23 0.94 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.178 -0.465 . . . . 1.1200000000000001 110.869 179.969 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.554 ' H ' HG22 ' A' ' 5' ' ' THR . 9.9 tp10 -69.94 -46.25 65.72 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.134 0.492 . . . . 2.2000000000000002 110.442 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -72.03 -41.9 66.96 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.578 -0.737 . . . . 1.3500000000000001 110.664 179.854 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 -60.55 -45.84 92.41 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.1 -0.5 . . . . 2.2200000000000002 110.603 179.768 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.532 ' HA ' ' CZ ' ' A' ' 12' ' ' PHE . 40.7 mt -57.92 -52.27 60.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.16 -0.473 . . . . 0.54000000000000004 110.879 179.733 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.2 -21.4 65.09 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.068 -0.515 . . . . 0.5 111.716 -179.607 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -72.72 -56.78 4.76 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 111.991 0.367 . . . . 2.27 111.991 -178.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.532 ' CZ ' ' HA ' ' A' ' 9' ' ' ILE . 7.5 p90 -77.92 -26.18 48.83 Favored 'General case' 0 C--N 1.332 -0.178 0 C-N-CA 120.674 -0.41 . . . . 0.37 110.789 -179.764 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.436 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 26.7 tptp -65.01 -38.47 91.04 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 109.383 -0.599 . . . . 1.23 109.383 178.971 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.485 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 20.1 t70 -66.65 -48.62 68.83 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 108.945 -0.761 . . . . 0.44 108.945 178.186 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.78 -14.59 59.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.411 -0.813 . . . . 0.28999999999999998 110.723 179.184 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.436 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 88.3 t80 -77.14 -49.89 14.21 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.029 -0.532 . . . . 0.47999999999999998 110.436 -179.579 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 16.5 m -67.32 -22.6 29.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.215 -0.448 . . . . 1.1100000000000001 110.26 179.67 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.485 ' HG2' ' O ' ' A' ' 14' ' ' ASP . 14.5 mm100 -63.85 -20.82 66.1 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.829 -0.623 . . . . 1.6000000000000001 111.379 179.444 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 45.2 m-85 -114.83 24.21 11.96 Favored 'General case' 0 C--N 1.332 -0.156 0 N-CA-C 111.903 0.335 . . . . 0.64000000000000001 111.903 -179.36 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -112.26 81.45 1.47 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.965 0.412 . . . . 0.44 110.504 179.335 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -92.44 -25.52 18.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.832 -0.622 . . . . 2.1000000000000001 111.286 -179.63 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -70.49 -15.33 62.79 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.102 -0.499 . . . . 1.8 111.355 -179.497 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.16 -0.08 68.84 Favored Glycine 0 CA--C 1.518 0.24 0 C-N-CA 120.749 -0.739 . . . . 0.46000000000000002 112.708 179.718 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 40.4 p -82.48 11.9 5.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.632 0.253 . . . . 0.40000000000000002 111.222 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 57.86 24.47 53.92 Favored Glycine 0 C--N 1.33 0.245 0 C-N-CA 120.676 -0.773 . . . . 0.33000000000000002 111.724 -179.489 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.653 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 47.7 mtpt -129.61 155.49 45.75 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.725 0.298 . . . . 1.1000000000000001 110.678 -179.516 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.431 ' N ' HE22 ' A' ' 62' ' ' GLN . 36.3 pt -118.47 130.85 72.73 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.411 -0.359 . . . . 0.5 111.29 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -50.07 129.38 20.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.372 -0.376 . . . . 0.29999999999999999 111.274 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.418 HG22 HD13 ' A' ' 63' ' ' LEU . 79.7 p -61.55 -21.37 64.22 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.118 -0.492 . . . . 1.03 110.722 179.819 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 51.8 mtp180 -80.91 4.08 20.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.742 -0.663 . . . . 3.0800000000000001 110.201 179.492 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -119.05 -6.63 10.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.547 -0.751 . . . . 2.2599999999999998 110.55 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.49 HD22 HD11 ' A' ' 51' ' ' LEU . 10.2 tt -55.2 -51.18 67.37 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.242 -0.436 . . . . 1.3700000000000001 110.18 179.534 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -52.27 -48.88 52.77 Favored Glycine 0 C--N 1.331 0.288 0 C-N-CA 120.531 -0.842 . . . . 0.32000000000000001 111.496 179.209 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 90.7 m -59.36 -34.44 72.39 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 121.319 0.58 . . . . 0.31 109.848 178.832 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 47.2 tp -70.36 -28.66 65.3 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.296 -0.865 . . . . 1.24 110.26 179.651 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.481 ' HG2' ' O ' ' A' ' 32' ' ' LEU . 23.9 mmm -76.12 -21.42 56.66 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.06 -0.518 . . . . 1.1000000000000001 109.768 179.057 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -75.41 -44.74 42.98 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.651 -0.704 . . . . 2.6899999999999999 110.326 179.071 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.442 HG23 ' HG ' ' A' ' 39' ' ' LEU . 7.9 t -71.51 -13.28 61.76 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.031 -0.531 . . . . 1.0600000000000001 110.416 179.13 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.442 ' HG ' HG23 ' A' ' 38' ' ' THR . 76.7 mt -112.83 157.4 21.43 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.727 -0.67 . . . . 1.26 110.187 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -71.84 34.85 0.61 Allowed Glycine 0 CA--C 1.521 0.449 0 C-N-CA 120.762 -0.733 . . . . 0.68999999999999995 113.34 -179.879 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.735 HE21 ' HA ' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -93.58 -80.68 0.38 Allowed 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.791 0.329 . . . . 1.97 111.087 179.569 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 32.5 m-80 56.81 74.89 0.62 Allowed Pre-proline 0 C--N 1.332 -0.184 0 CA-C-N 115.943 -0.571 . . . . 2.6600000000000001 111.05 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.402 ' HD3' ' HB3' ' A' ' 36' ' ' MET . 92.1 Cg_endo -79.18 173.88 12.78 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.654 2.236 . . . . 0.51000000000000001 112.446 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 19.9 m -69.07 152.71 44.86 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.172 -0.467 . . . . 0.72999999999999998 110.778 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -55.09 -55.21 33.65 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.733 0.302 . . . . 2.7000000000000002 111.128 -179.648 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -54.43 -47.92 72.26 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.092 -0.504 . . . . 0.46000000000000002 111.804 -179.565 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.433 ' HG2' HD23 ' A' ' 51' ' ' LEU . 39.5 tt0 -57.99 -48.24 80.61 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.87 0.367 . . . . 2.23 110.456 -179.629 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.43 ' HA ' HD21 ' A' ' 51' ' ' LEU . 31.8 tp -57.07 -38.61 73.54 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.78 -0.645 . . . . 1.3600000000000001 110.977 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 83.3 mm-40 -72.82 -31.04 64.52 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.303 -0.408 . . . . 1.22 111.551 -179.682 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 28.1 m-20 -73.78 -54.99 6.79 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.547 -0.297 . . . . 0.62 111.8 -179.44 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.49 HD11 HD22 ' A' ' 32' ' ' LEU . 2.2 pp -60.75 -38.57 85.64 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.611 -0.268 . . . . 0.39000000000000001 111.516 -179.226 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 82.4 mt -68.81 -36.75 75.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.934 0.397 . . . . 0.5 110.744 179.595 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.96 -50.76 61.29 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.096 -0.502 . . . . 0.58999999999999997 111.073 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -62.08 -38.53 89.17 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.283 -0.417 . . . . 2.54 110.603 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -73.58 -18.21 61.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.285 -0.416 . . . . 0.53000000000000003 111.04 179.747 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -70.8 -55.02 9.48 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.272 -0.422 . . . . 1.95 110.612 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 3.1 p-10 -89.65 43.68 1.16 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.183 -0.462 . . . . 2.48 110.988 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 67.7 m-20 -155.16 -15.66 0.11 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.705 -0.68 . . . . 2.48 110.61 179.801 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -144.21 21.39 1.73 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.911 -0.586 . . . . 2.0499999999999998 110.613 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 50.3 m-20 64.49 -83.24 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.126 0 CA-C-N 115.861 -0.609 . . . . 1.47 111.314 179.801 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -154.69 19.54 0.59 Allowed Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.793 -0.718 . . . . 0.42999999999999999 112.336 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.653 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -128.49 155.31 45.03 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.981 0.419 . . . . 0.38 111.156 -179.847 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.552 ' HG ' ' HB2' ' A' ' 67' ' ' GLU . 9.5 tp -124.45 154.09 41.0 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.901 -0.59 . . . . 1.4299999999999999 110.482 -179.604 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ASN . . . . . 0.419 ' CG ' ' HE3' ' A' ' 26' ' ' LYS . 7.6 m-80 -113.41 157.63 21.67 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-O 121.111 0.481 . . . . 1.1899999999999999 111.548 -179.708 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 88.1 t80 -46.88 -43.52 18.85 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.281 -0.872 . . . . 0.40000000000000002 111.02 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -67.62 -34.43 76.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 0.81000000000000005 111.877 -179.82 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.552 ' HB2' ' HG ' ' A' ' 63' ' ' LEU . 22.4 mm-40 -64.39 -53.41 48.95 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.958 0.409 . . . . 1.3600000000000001 110.245 179.682 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.461 ' O ' ' HG3' ' A' ' 72' ' ' MET . 28.0 t80 -59.91 -51.11 71.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.825 -0.625 . . . . 0.51000000000000001 110.336 179.261 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 1.5 m -55.25 -49.67 71.45 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.821 -0.627 . . . . 0.75 111.085 179.727 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -47.51 -49.73 20.14 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.982 -0.627 . . . . 0.40999999999999998 112.212 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.634 HG23 ' HE3' ' A' ' 74' ' ' LYS . 12.7 mt -64.19 -45.56 95.98 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.308 0 CA-C-O 121.015 0.436 . . . . 0.51000000000000001 110.743 179.541 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' MET . . . . . 0.461 ' HG3' ' O ' ' A' ' 68' ' ' PHE . 38.0 mtp -54.84 -25.01 25.68 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.9 -0.591 . . . . 1.01 110.135 179.556 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.495 ' O ' ' HB3' ' A' ' 77' ' ' ARG . . . -76.04 -49.27 18.01 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.36 -0.382 . . . . 0.69999999999999996 110.748 179.69 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.634 ' HE3' HG23 ' A' ' 71' ' ' ILE . 19.2 pttp -65.35 -35.4 80.86 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.516 -0.311 . . . . 1.3799999999999999 111.081 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -81.41 -55.67 4.55 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.728 0.64 . . . . 1.98 112.728 -179.033 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 24.7 mtm -74.17 -56.28 5.09 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 113.066 0.765 . . . . 1.2 113.066 -178.321 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.495 ' HB3' ' O ' ' A' ' 73' ' ' ALA . 29.5 ttt180 -67.99 -55.93 10.85 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 112.13 0.419 . . . . 4.6900000000000004 112.13 -178.331 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 60.22 -80.7 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 O-C-N 123.093 0.246 . . . . 4.0099999999999998 110.669 -179.12 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.416 ' N ' ' O ' ' A' ' 77' ' ' ARG . 19.0 p -147.25 40.53 1.04 Allowed 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.45 -0.341 . . . . 5.2800000000000002 111.366 179.446 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -85.91 14.18 6.43 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 121.034 0.445 . . . . 5.5999999999999996 110.801 -179.775 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.431 HG23 ' O ' ' A' ' 81' ' ' THR . 3.9 t -70.41 90.89 0.73 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.857 -0.61 . . . . 7.29 111.605 -179.876 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.429 ' HB2' ' OH ' ' A' ' 138' ' ' TYR . 11.2 pt-20 -50.25 -20.77 1.13 Allowed 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 112.793 0.664 . . . . 9.7400000000000002 112.793 -178.876 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 25.9 mm-40 -68.78 -57.01 6.21 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.758 0.313 . . . . 12.109999999999999 111.644 -179.312 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -71.86 -27.34 62.81 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.106 0.479 . . . . 10.869999999999999 110.513 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' MET . . . . . 0.563 ' HB3' HD11 ' A' ' 145' ' ' ILE . 27.7 mtp -70.88 -36.09 72.63 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.629 -0.714 . . . . 11.09 110.47 -179.73 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 70.0 ttt180 -68.22 -43.56 77.72 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.973 -0.558 . . . . 15.52 110.2 179.575 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -55.21 -42.91 73.94 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.74 -0.467 . . . . 14.85 109.74 178.847 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' ALA . . . . . 0.428 ' HA ' HD12 ' A' ' 91' ' ' ILE . . . -61.1 -38.44 86.29 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.776 -0.647 . . . . 14.109999999999999 110.688 179.509 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -58.17 -40.89 82.63 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.237 -0.438 . . . . 15.73 110.554 179.624 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 26.3 mtpp -63.96 -37.9 89.11 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.829 -0.623 . . . . 17.66 110.584 179.611 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.428 HD12 ' HA ' ' A' ' 88' ' ' ALA . 66.0 mt -62.32 -44.03 98.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.875 -0.602 . . . . 18.149999999999999 111.598 -179.917 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.507 ' HA ' HG21 ' A' ' 108' ' ' VAL . 18.5 m-85 -80.31 -20.52 44.14 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 111.791 0.293 . . . . 18.34 111.791 -179.614 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -96.88 108.65 21.39 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.892 0.377 . . . . 19.289999999999999 111.047 -179.906 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.82 -58.9 3.33 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.941 -0.572 . . . . 22.25 111.295 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -74.82 158.86 32.72 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.151 -0.477 . . . . 23.34 111.347 -179.466 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -80.88 5.19 66.52 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.796 -0.716 . . . . 22.0 111.429 178.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 27.8 p-10 -55.52 -35.06 65.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.904 0.383 . . . . 22.280000000000001 111.384 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 89.86 30.95 11.78 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.867 -0.682 . . . . 19.93 112.167 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -146.78 146.79 30.39 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.639 0.257 . . . . 20.300000000000001 110.902 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.43 HD13 ' HB3' ' A' ' 92' ' ' PHE . 40.4 mt -114.17 125.3 71.44 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-O 120.846 0.355 . . . . 19.370000000000001 111.097 179.773 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 101' ' ' SER . . . . . 0.489 ' OG ' ' HD2' ' A' ' 102' ' ' PRO . 47.3 t -114.61 152.67 46.46 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.055 -0.52 . . . . 22.489999999999998 110.421 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' PRO . . . . . 0.489 ' HD2' ' OG ' ' A' ' 101' ' ' SER . 55.6 Cg_exo -40.05 -34.71 1.01 Allowed 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.564 2.176 . . . . 23.0 112.848 179.669 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.86 -46.57 81.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.292 -0.413 . . . . 24.559999999999999 111.132 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.44 ' O ' HG23 ' A' ' 108' ' ' VAL . 43.5 mt-10 -74.37 -39.2 62.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.936 -0.574 . . . . 22.23 110.75 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.875 HD23 ' HB ' ' A' ' 121' ' ' ILE . 8.7 tp -54.86 -49.68 70.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.93 -0.577 . . . . 20.359999999999999 110.407 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 10.4 ttt180 -63.89 -47.85 78.96 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.899 -0.591 . . . . 27.190000000000001 110.582 179.424 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 68.4 t80 -49.91 -43.43 49.63 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.881 -0.6 . . . . 25.359999999999999 111.492 -179.387 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.508 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 53.9 t -72.16 -49.94 40.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.585 -0.28 . . . . 21.059999999999999 111.268 -179.785 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 18.6 mmt -49.13 -49.54 41.69 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.302 -0.408 . . . . 20.93 111.352 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 63.4 mt -59.84 -28.13 40.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.232 -0.44 . . . . 25.129999999999999 110.937 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -77.9 -29.49 50.18 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.122 -0.49 . . . . 23.32 110.937 179.674 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.508 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 14.8 mt -74.47 -41.35 60.92 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.387 -0.37 . . . . 21.07 110.836 -179.892 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 131.28 -0.04 5.12 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.879 -0.677 . . . . 23.050000000000001 112.422 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -101.55 109.27 21.05 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.882 0.372 . . . . 22.59 111.021 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -74.77 113.68 12.33 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.128 -0.487 . . . . 27.960000000000001 111.013 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' VAL . . . . . 0.481 HG12 ' OE1' ' A' ' 120' ' ' GLU . 4.9 m -131.21 146.39 33.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 121.006 0.432 . . . . 24.75 111.437 179.634 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 55.3 p -92.88 152.39 19.43 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.883 -0.599 . . . . 27.239999999999998 110.128 179.306 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -55.79 -19.05 9.97 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.328 -0.396 . . . . 26.629999999999999 111.118 -179.69 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -76.11 -55.48 5.55 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.356 -0.384 . . . . 29.140000000000001 111.709 -179.519 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.481 ' OE1' HG12 ' A' ' 116' ' ' VAL . 14.5 pt-20 -62.59 -40.82 98.13 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 111.873 0.323 . . . . 24.190000000000001 111.873 -179.152 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.875 ' HB ' HD23 ' A' ' 105' ' ' LEU . 43.9 pt -70.09 -35.14 62.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 C-N-CA 120.853 -0.339 . . . . 22.329999999999998 111.242 -179.671 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.401 ' N ' HG13 ' A' ' 121' ' ' ILE . 13.3 t70 -61.14 -38.83 87.8 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.833 0.349 . . . . 24.289999999999999 110.305 179.437 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -64.52 -46.35 83.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.055 -0.521 . . . . 24.739999999999998 110.446 179.461 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.419 ' CE ' HD21 ' A' ' 105' ' ' LEU . 53.0 ttp -56.58 -39.04 72.82 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 116.09 -0.505 . . . . 19.710000000000001 110.537 179.457 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.607 HD11 HD22 ' A' ' 105' ' ' LEU . 82.1 mt -65.36 -41.3 90.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.914 -0.585 . . . . 19.949999999999999 110.513 179.488 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 69.1 ttt180 -60.52 -32.17 71.2 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.664 -0.698 . . . . 24.949999999999999 110.821 179.666 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -67.79 -36.19 79.99 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.125 -0.489 . . . . 18.690000000000001 111.062 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.75 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -90.93 -15.48 29.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.262 -0.426 . . . . 16.469999999999999 110.964 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 129' ' ' ASP . . . . . 0.44 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 19.1 t70 -98.39 106.67 18.98 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.978 -0.556 . . . . 20.399999999999999 110.902 -179.662 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -94.19 -33.34 13.33 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.805 -0.634 . . . . 21.43 111.448 -179.644 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -67.81 -15.97 63.88 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.87 0.367 . . . . 23.370000000000001 110.649 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 60.41 85.63 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.962 -0.637 . . . . 24.32 112.85 179.713 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -143.05 -35.4 0.4 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.753 0.311 . . . . 23.879999999999999 110.851 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 110.91 6.06 26.66 Favored Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.832 -0.699 . . . . 22.670000000000002 112.729 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 78.3 mtp -131.43 155.26 47.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.631 0.253 . . . . 22.91 110.627 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.662 HG23 ' HB2' ' A' ' 140' ' ' GLU . 48.1 mm -117.33 144.79 24.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 121.203 0.525 . . . . 18.41 111.851 -179.477 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 137' ' ' ASN . . . . . 0.451 ' O ' ' N ' ' A' ' 139' ' ' GLU . 29.8 p-10 -116.92 158.13 24.56 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.354 -0.839 . . . . 16.82 109.194 178.44 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.429 ' OH ' ' HB2' ' A' ' 82' ' ' GLU . 26.8 t80 -39.21 -23.72 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.368 0.507 . . . . 14.65 112.368 -179.534 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.451 ' N ' ' O ' ' A' ' 137' ' ' ASN . 45.4 mt-10 -80.45 -56.01 4.48 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 120.744 0.307 . . . . 14.82 111.401 -179.486 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.662 ' HB2' HG23 ' A' ' 136' ' ' ILE . 34.7 mt-10 -62.82 -31.02 71.93 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.908 0.385 . . . . 17.460000000000001 110.38 -179.961 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.56 ' HA ' ' HE2' ' A' ' 144' ' ' MET . 78.0 t80 -66.89 -54.51 21.44 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.976 -0.556 . . . . 12.93 109.689 178.892 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.449 ' HA ' HD11 ' A' ' 145' ' ' ILE . 1.7 t -47.84 -35.44 4.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.306 -0.861 . . . . 10.699999999999999 111.286 179.101 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 143' ' ' TRP . . . . . 0.404 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 79.8 t90 -69.71 -55.32 10.26 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.278 0.473 . . . . 13.66 112.278 -179.42 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 144' ' ' MET . . . . . 0.75 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 21.4 ptt? -65.32 -21.71 66.74 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 113.323 0.861 . . . . 14.5 113.323 -177.627 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 145' ' ' ILE . . . . . 0.635 ' HA ' ' HB2' ' A' ' 148' ' ' LYS . 44.0 pt -80.61 -43.77 21.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 C-N-CA 120.806 -0.357 . . . . 11.25 111.861 -179.821 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 146' ' ' SER . . . . . 0.535 ' N ' HG13 ' A' ' 145' ' ' ILE . 46.9 t -63.67 -13.89 46.98 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 121.472 0.653 . . . . 8.5399999999999991 109.473 179.574 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 147' ' ' GLN . . . . . 0.404 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 6.2 mm-40 -126.19 21.73 7.32 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 114.781 -1.099 . . . . 11.869999999999999 110.025 -179.272 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 148' ' ' LYS . . . . . 0.635 ' HB2' ' HA ' ' A' ' 145' ' ' ILE . 27.2 ttpp . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.203 -0.904 . . . . 13.68 110.931 -179.492 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 149' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 151' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 77.9 p . . . . . 0 N--CA 1.485 1.309 0 CA-C-O 120.836 0.351 . . . . 4.8899999999999997 110.887 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -93.94 -58.27 2.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.153 -0.476 . . . . 3.2599999999999998 111.094 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 11.0 mp 45.8 64.53 1.42 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.639 -0.71 . . . . 1.27 111.014 -179.476 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.523 HG22 ' H ' ' A' ' 6' ' ' GLU . 0.2 OUTLIER -59.1 177.32 0.17 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.917 -0.583 . . . . 1.1200000000000001 111.181 -179.857 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.523 ' H ' HG22 ' A' ' 5' ' ' THR . 37.7 tt0 -62.88 -42.87 99.93 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.294 0.568 . . . . 2.2000000000000002 109.909 179.691 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -71.27 -39.0 71.83 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.309 -0.859 . . . . 1.3500000000000001 110.521 179.488 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 18.3 mm-40 -62.9 -43.12 99.67 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.894 -0.593 . . . . 2.2200000000000002 110.47 179.623 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.553 ' HA ' ' CZ ' ' A' ' 12' ' ' PHE . 83.6 mt -58.66 -54.35 34.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.139 -0.482 . . . . 0.54000000000000004 110.362 179.572 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.26 -22.38 65.94 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.042 -0.527 . . . . 0.5 111.074 179.741 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -73.38 -56.31 5.22 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.228 -0.442 . . . . 2.27 112.186 -178.91 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.553 ' CZ ' ' HA ' ' A' ' 9' ' ' ILE . 4.7 p90 -78.69 -26.51 44.92 Favored 'General case' 0 C--N 1.332 -0.157 0 C-N-CA 120.542 -0.463 . . . . 0.37 111.255 -179.374 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.431 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 27.8 tptp -67.03 -38.38 85.79 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.649 -0.5 . . . . 1.23 109.649 179.116 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.44 ' O ' HG22 ' A' ' 17' ' ' VAL . 16.8 t70 -66.62 -52.42 45.35 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 109.246 -0.65 . . . . 0.44 109.246 178.34 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.44 -13.66 52.71 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.603 -0.726 . . . . 0.28999999999999998 110.726 179.198 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.431 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 83.0 t80 -76.96 -48.51 17.89 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.083 -0.508 . . . . 0.47999999999999998 110.443 -179.741 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.44 HG22 ' O ' ' A' ' 14' ' ' ASP . 30.8 m -68.73 -22.7 26.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.205 -0.452 . . . . 1.1100000000000001 110.353 179.54 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.435 ' HG2' ' O ' ' A' ' 14' ' ' ASP . 26.3 mm-40 -59.48 -48.28 82.26 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.844 -0.616 . . . . 1.6000000000000001 111.461 179.444 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -88.14 37.34 0.81 Allowed 'General case' 0 N--CA 1.462 0.14 0 CA-C-O 120.771 0.32 . . . . 0.64000000000000001 111.622 -179.541 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -125.11 74.66 1.39 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.065 0.459 . . . . 0.44 110.397 179.328 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -84.72 -21.91 29.92 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.727 -0.67 . . . . 2.1000000000000001 111.309 -179.653 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -75.97 -22.25 56.09 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.978 -0.555 . . . . 1.8 111.398 -179.404 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 82.12 4.53 90.21 Favored Glycine 0 C--N 1.33 0.229 0 C-N-CA 120.678 -0.773 . . . . 0.46000000000000002 112.418 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 60.6 p -82.12 14.74 2.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.652 0.263 . . . . 0.40000000000000002 111.177 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 53.92 22.86 20.91 Favored Glycine 0 C--N 1.332 0.339 0 C-N-CA 120.714 -0.755 . . . . 0.33000000000000002 111.895 -179.498 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.639 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 46.2 mtpt -129.98 155.11 46.63 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.681 -0.259 . . . . 1.1000000000000001 110.692 -179.374 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.682 HG13 ' HB2' ' A' ' 63' ' ' LEU . 15.4 pt -114.89 122.12 68.36 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.203 0 CA-C-O 120.915 0.388 . . . . 0.5 112.021 -179.43 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -52.81 134.71 36.71 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.087 -0.506 . . . . 0.29999999999999999 111.114 179.693 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.0 t -65.53 -13.19 58.38 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.016 -0.538 . . . . 1.03 111.152 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 32.1 mtt180 -80.94 -10.09 59.76 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.012 -0.54 . . . . 3.0800000000000001 110.632 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -116.61 1.12 12.82 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.819 -0.628 . . . . 2.2599999999999998 110.619 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.713 HD11 ' CD1' ' A' ' 68' ' ' PHE . 16.0 tp -64.13 -47.75 78.75 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.382 -0.372 . . . . 1.3700000000000001 110.685 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.421 ' O ' ' HG3' ' A' ' 37' ' ' ARG . . . -51.86 -41.41 51.46 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.246 -0.978 . . . . 0.32000000000000001 110.927 179.115 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.437 ' O ' HG22 ' A' ' 38' ' ' THR . 95.2 m -68.14 -30.63 69.81 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.985 0.421 . . . . 0.31 110.359 179.112 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 60.6 tp -71.73 -41.52 68.39 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.761 -0.654 . . . . 1.24 111.246 -179.816 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.419 ' SD ' ' HG3' ' A' ' 43' ' ' PRO . 48.2 mtp -72.31 -23.9 61.24 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.301 -0.409 . . . . 1.1000000000000001 110.849 179.807 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.421 ' HG3' ' O ' ' A' ' 33' ' ' GLY . 81.9 mtt180 -72.62 -46.14 55.59 Favored 'General case' 0 N--CA 1.461 0.125 0 CA-C-O 120.958 0.408 . . . . 2.6899999999999999 110.297 179.179 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.591 HG23 HD13 ' A' ' 39' ' ' LEU . 1.8 t -68.16 -11.16 58.73 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.958 -0.564 . . . . 1.0600000000000001 110.412 179.023 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.591 HD13 HG23 ' A' ' 38' ' ' THR . 8.4 mp -111.47 156.82 21.09 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.603 -0.726 . . . . 1.26 110.304 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -45.79 -24.42 1.26 Allowed Glycine 0 CA--C 1.519 0.323 0 C-N-CA 121.224 -0.512 . . . . 0.68999999999999995 113.439 -179.652 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.433 ' OE1' ' HB3' ' A' ' 39' ' ' LEU . 19.7 mp0 -57.07 152.94 12.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.893 0.377 . . . . 1.97 111.174 179.811 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 -155.28 71.87 5.61 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.067 -0.515 . . . . 2.6600000000000001 110.952 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.419 ' HG3' ' SD ' ' A' ' 36' ' ' MET . 60.0 Cg_endo -69.24 152.5 72.01 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.789 2.326 . . . . 0.51000000000000001 112.35 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 27.2 m -76.13 151.21 37.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.174 -0.466 . . . . 0.72999999999999998 110.321 179.397 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.445 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 1.3 mp0 -44.55 -55.08 5.43 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.678 0.275 . . . . 2.7000000000000002 111.191 -179.714 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -54.5 -45.01 73.17 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.234 -0.439 . . . . 0.46000000000000002 111.392 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -56.2 -49.83 72.96 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.234 -0.439 . . . . 2.23 111.216 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 17.5 mt -59.74 -41.78 91.73 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.683 0.278 . . . . 1.3600000000000001 110.934 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.445 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 78.0 mm-40 -66.64 -30.28 70.52 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.523 -0.308 . . . . 1.22 111.274 -179.702 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 -75.83 -54.99 6.06 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.424 -0.353 . . . . 0.62 111.431 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 3.1 pp -64.09 -38.14 89.99 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.437 -0.347 . . . . 0.39000000000000001 111.361 -179.469 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 44.9 mt -65.79 -43.92 93.19 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 C-N-CA 121.066 -0.253 . . . . 0.5 110.741 179.68 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.8 -29.55 70.8 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.929 0.395 . . . . 0.58999999999999997 110.739 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -74.59 -52.96 10.34 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.963 -0.562 . . . . 2.54 110.075 179.625 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -69.86 -14.44 62.75 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.014 -0.539 . . . . 0.53000000000000003 111.508 179.786 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -73.6 -37.04 65.56 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.851 0.358 . . . . 1.95 110.965 -179.647 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 38.7 m-80 -89.6 16.67 7.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.235 -0.439 . . . . 2.48 110.656 179.683 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 56.7 t30 -142.39 151.55 41.97 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.905 -0.589 . . . . 2.48 110.627 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 2.5 m120 62.86 9.92 3.98 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.221 -0.445 . . . . 2.0499999999999998 111.17 179.704 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 89.7 m-20 63.03 11.52 5.22 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.329 -0.396 . . . . 1.47 111.827 179.796 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 110.44 44.03 1.02 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.61 -0.805 . . . . 0.42999999999999999 112.822 179.496 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.639 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -147.62 154.83 41.14 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.066 0.46 . . . . 0.38 111.11 179.856 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.682 ' HB2' HG13 ' A' ' 27' ' ' ILE . 66.4 mt -124.47 155.88 38.18 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.809 -0.632 . . . . 1.4299999999999999 109.982 179.531 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ASN . . . . . 0.475 ' OD1' ' HE3' ' A' ' 26' ' ' LYS . 0.6 OUTLIER -113.15 156.74 22.66 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.924 -0.31 . . . . 1.1899999999999999 110.505 -179.66 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -43.06 -50.23 6.07 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.117 -0.492 . . . . 0.40000000000000002 110.913 179.804 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.7 -29.59 69.62 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.285 -0.416 . . . . 0.81000000000000005 111.35 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.422 ' HG2' ' HB2' ' A' ' 64' ' ' ASN . 14.3 mm-40 -65.1 -55.45 18.7 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.831 0.348 . . . . 1.3600000000000001 110.203 179.317 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.713 ' CD1' HD11 ' A' ' 32' ' ' LEU . 32.8 t80 -63.98 -45.98 86.65 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.077 -0.511 . . . . 0.51000000000000001 109.993 179.255 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 62.7 m -57.34 -35.46 69.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.809 -0.632 . . . . 0.75 110.251 179.477 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -59.51 -54.4 38.07 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.788 -0.72 . . . . 0.40999999999999998 111.431 179.436 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.599 HG23 ' HE2' ' A' ' 74' ' ' LYS . 12.6 mt -60.16 -43.38 92.96 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.347 0 CA-C-O 121.108 0.48 . . . . 0.51000000000000001 110.173 179.099 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' MET . . . . . 0.409 ' HG3' ' O ' ' A' ' 68' ' ' PHE . 40.1 mtp -53.76 -32.52 52.64 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.859 -0.61 . . . . 1.01 110.051 179.317 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -67.17 -47.71 70.15 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.186 -0.461 . . . . 0.69999999999999996 110.853 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.599 ' HE2' HG23 ' A' ' 71' ' ' ILE . 65.7 pttt -70.44 -28.9 65.39 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.412 -0.358 . . . . 1.3799999999999999 111.747 -179.591 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' GLN . . . . . 0.454 ' HG3' HG22 ' A' ' 71' ' ' ILE . 7.7 mm-40 -82.1 -35.06 28.98 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.186 0.517 . . . . 1.98 111.155 -179.383 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 50.7 mtp -79.6 -19.2 49.87 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.525 -0.762 . . . . 1.2 111.969 -179.024 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 51.1 mtp180 -61.48 -17.53 54.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.663 -0.244 . . . . 4.6900000000000004 111.361 -179.814 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -142.12 78.41 1.62 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.453 -0.34 . . . . 4.0099999999999998 111.081 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.428 ' H ' ' H ' ' A' ' 80' ' ' ASP . 14.7 t -173.39 -1.36 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 120.764 -0.375 . . . . 5.2800000000000002 111.342 179.797 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ASP . . . . . 0.428 ' H ' ' H ' ' A' ' 79' ' ' THR . 5.3 p-10 -107.68 -54.6 2.47 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.389 -0.368 . . . . 5.5999999999999996 111.445 -179.499 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.558 ' O ' ' HG2' ' A' ' 85' ' ' MET . 6.6 t 36.11 57.06 1.02 Allowed 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 120.98 0.419 . . . . 7.29 111.836 -179.697 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -42.71 -30.91 0.41 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 115.57 -0.741 . . . . 9.7400000000000002 112.977 -179.152 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -60.56 -55.94 27.37 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 120.879 0.371 . . . . 12.109999999999999 111.52 -179.332 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -63.99 -21.93 66.71 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.169 -0.468 . . . . 10.869999999999999 111.167 -179.582 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' MET . . . . . 0.558 ' HG2' ' O ' ' A' ' 81' ' ' THR . 11.3 mmm -74.41 -41.13 61.42 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.895 0.379 . . . . 11.09 110.578 -179.558 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 50.8 ttp180 -62.46 -46.57 87.92 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.969 -0.559 . . . . 15.52 110.404 179.729 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.439 ' O ' HG12 ' A' ' 91' ' ' ILE . 40.7 tt0 -55.73 -47.05 77.56 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.029 0.442 . . . . 14.85 109.867 179.015 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.84 -32.89 74.79 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.796 -0.638 . . . . 14.109999999999999 111.034 179.616 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 81.7 t80 -61.5 -37.12 82.52 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-O 120.978 0.418 . . . . 15.73 110.494 179.777 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 89.0 mttt -69.21 -40.1 78.21 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.871 -0.604 . . . . 17.66 110.501 179.621 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.439 HG12 ' O ' ' A' ' 87' ' ' GLU . 37.4 mm -60.51 -50.5 80.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.897 -0.592 . . . . 18.149999999999999 111.567 -179.799 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.448 ' HB3' HD13 ' A' ' 100' ' ' ILE . 8.2 m-85 -66.79 -48.08 70.11 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.306 -0.406 . . . . 18.34 111.635 -179.347 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 53.6 t0 -60.83 93.82 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.984 0.421 . . . . 19.289999999999999 110.557 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.717 ' HE ' ' HG2' ' A' ' 104' ' ' GLU . 34.8 mtm180 -63.01 -11.55 19.83 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.9 -0.591 . . . . 22.25 111.49 -179.497 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.436 ' HB2' ' OD1' ' A' ' 97' ' ' ASP . 8.9 m-20 -119.82 170.23 9.42 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.965 0.412 . . . . 23.34 111.09 -179.78 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.49 5.21 57.02 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.925 -0.655 . . . . 22.0 112.256 179.602 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.436 ' OD1' ' HB2' ' A' ' 95' ' ' ASP . 5.0 p-10 -60.0 -38.6 83.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.66 0.267 . . . . 22.280000000000001 111.119 -179.657 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 113.05 15.04 9.42 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.804 -0.712 . . . . 19.93 112.955 179.648 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -142.34 154.13 44.41 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.613 0.244 . . . . 20.300000000000001 110.758 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.448 HD13 ' HB3' ' A' ' 92' ' ' PHE . 76.8 mt -114.11 140.7 33.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 121.023 0.44 . . . . 19.370000000000001 111.337 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' SER . . . . . 0.438 ' OG ' ' HD2' ' A' ' 102' ' ' PRO . 31.1 t -114.51 154.22 46.6 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 115.589 -0.732 . . . . 22.489999999999998 109.956 179.785 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' PRO . . . . . 0.438 ' HD2' ' OG ' ' A' ' 101' ' ' SER . 57.7 Cg_exo -50.53 -36.19 48.55 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 121.941 1.76 . . . . 23.0 111.442 -179.892 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.73 -48.84 79.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.765 -0.652 . . . . 24.559999999999999 109.911 178.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.717 ' HG2' ' HE ' ' A' ' 94' ' ' ARG . 45.4 mt-10 -59.47 -45.62 91.12 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.303 -0.862 . . . . 22.23 110.332 179.245 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.573 HD22 ' HB ' ' A' ' 121' ' ' ILE . 2.6 tt -63.29 -29.7 70.97 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.585 -0.734 . . . . 20.359999999999999 110.615 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.462 ' CZ ' HD11 ' A' ' 110' ' ' ILE . 12.1 tpt180 -72.81 -40.41 65.88 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.709 -0.678 . . . . 27.190000000000001 111.5 -179.645 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 53.3 t80 -76.87 -35.18 57.63 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 111.98 0.363 . . . . 25.359999999999999 111.98 -178.904 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.447 HG21 ' HA ' ' A' ' 92' ' ' PHE . 90.4 t -72.34 -47.45 52.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 111.692 0.256 . . . . 21.059999999999999 111.692 -179.455 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 12.9 mmt -50.98 -36.32 38.44 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.712 0.291 . . . . 20.93 111.283 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.462 HD11 ' CZ ' ' A' ' 106' ' ' ARG . 72.4 mt -67.94 -35.58 72.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.894 0.378 . . . . 25.129999999999999 110.636 179.801 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 -66.06 -37.94 87.08 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.025 -0.534 . . . . 23.32 110.744 179.594 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 14.6 mt -67.59 -28.89 68.14 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.999 -0.546 . . . . 21.07 110.954 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 116.28 0.14 20.65 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.9 -0.667 . . . . 23.050000000000001 112.305 -179.836 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -103.42 110.06 21.93 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.768 0.318 . . . . 22.59 110.978 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 17.6 tppt? -80.58 116.2 20.49 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.2 -0.455 . . . . 27.960000000000001 110.743 179.708 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 3.7 m -125.33 154.59 33.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.035 0.445 . . . . 24.75 111.569 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 80.6 p -95.68 146.27 24.63 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.735 -0.666 . . . . 27.239999999999998 110.085 179.173 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -53.55 -18.94 3.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.279 -0.418 . . . . 26.629999999999999 111.367 -179.597 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -79.22 -52.13 8.56 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.38 -0.373 . . . . 29.140000000000001 111.697 -179.49 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -63.09 -37.12 85.92 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.627 -0.261 . . . . 24.190000000000001 111.567 -179.269 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.573 ' HB ' HD22 ' A' ' 105' ' ' LEU . 48.3 pt -74.67 -35.46 37.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 C-N-CA 120.995 -0.282 . . . . 22.329999999999998 111.031 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -61.2 -38.59 87.1 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.961 0.41 . . . . 24.289999999999999 110.309 179.185 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -67.81 -43.48 79.54 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.897 -0.592 . . . . 24.739999999999998 110.52 179.488 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 50.2 ttp -58.11 -39.5 78.83 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.044 -0.525 . . . . 19.710000000000001 110.573 179.62 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.431 HG23 HD11 ' A' ' 136' ' ' ILE . 76.2 mt -66.94 -36.4 77.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.16 -0.473 . . . . 19.949999999999999 110.608 179.585 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 37.6 ttm180 -66.04 -29.92 70.35 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.173 -0.467 . . . . 24.949999999999999 110.806 179.764 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -75.88 -26.89 57.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.14 -0.482 . . . . 18.690000000000001 111.239 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.683 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -97.81 -16.23 19.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.245 -0.434 . . . . 16.469999999999999 111.173 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 129' ' ' ASP . . . . . 0.4 ' HA ' ' OE1' ' A' ' 140' ' ' GLU . 31.4 t70 -94.57 105.19 17.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.135 -0.484 . . . . 20.399999999999999 111.009 -179.564 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -100.33 -33.34 10.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.865 -0.607 . . . . 21.43 111.294 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -64.06 -27.95 69.45 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.375 -0.375 . . . . 23.370000000000001 110.715 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 75.98 81.88 0.52 Allowed Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.921 -0.657 . . . . 24.32 112.952 179.51 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 16.5 p-10 -155.66 6.66 0.22 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.745 0.307 . . . . 23.879999999999999 110.919 179.605 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 59.94 25.64 62.04 Favored Glycine 0 C--N 1.331 0.251 0 C-N-CA 120.891 -0.671 . . . . 22.670000000000002 112.551 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 96.8 mmm -135.96 152.5 51.02 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.596 0.236 . . . . 22.91 110.43 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.731 HG23 ' HB2' ' A' ' 140' ' ' GLU . 41.4 mm -115.86 138.71 45.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 121.341 0.591 . . . . 18.41 112.126 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 137' ' ' ASN . . . . . 0.454 ' O ' ' N ' ' A' ' 139' ' ' GLU . 26.4 p30 -115.38 158.85 21.87 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.267 -0.879 . . . . 16.82 109.036 178.035 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.65 ' O ' HG23 ' A' ' 142' ' ' VAL . 28.6 t80 -38.49 -24.21 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 112.589 0.589 . . . . 14.65 112.589 -179.029 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.454 ' N ' ' O ' ' A' ' 137' ' ' ASN . 44.4 mt-10 -80.25 -55.78 4.67 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.822 0.344 . . . . 14.82 111.213 -179.437 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.731 ' HB2' HG23 ' A' ' 136' ' ' ILE . 24.8 mt-10 -60.22 -27.17 66.98 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.174 -0.466 . . . . 17.460000000000001 110.266 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.725 ' HA ' ' HE2' ' A' ' 144' ' ' MET . 69.0 t80 -71.14 -56.34 6.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.877 -0.601 . . . . 12.93 110.415 179.54 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.65 HG23 ' O ' ' A' ' 138' ' ' TYR . 43.1 t -44.73 -48.05 2.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.774 -0.648 . . . . 10.699999999999999 111.794 179.432 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 78.8 t90 -64.65 -55.43 20.25 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.513 0.56 . . . . 13.66 112.513 -178.797 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 144' ' ' MET . . . . . 0.725 ' HE2' ' HA ' ' A' ' 141' ' ' PHE . 16.7 ptt? -60.37 -35.41 75.64 Favored 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 112.451 0.538 . . . . 14.5 112.451 -178.004 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 145' ' ' ILE . . . . . 0.635 HG21 ' CZ ' ' A' ' 141' ' ' PHE . 3.2 pt -80.93 -17.27 12.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 C-N-CA 120.591 -0.444 . . . . 11.25 111.275 -179.883 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 42.2 t -69.25 -36.46 77.17 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.399 -0.593 . . . . 8.5399999999999991 109.399 179.231 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 31.8 mm-40 -93.56 -16.48 24.36 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.138 -0.937 . . . . 11.869999999999999 110.229 179.382 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 148' ' ' LYS . . . . . 0.438 ' CB ' ' HA ' ' A' ' 145' ' ' ILE . 37.6 ttpt . . . . . 0 C--O 1.25 1.112 0 CA-C-O 118.231 -0.89 . . . . 13.68 110.961 179.474 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 149' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 151' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 79.0 p . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 120.746 0.308 . . . . 4.8899999999999997 110.827 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -134.46 -19.34 1.9 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.169 -0.469 . . . . 3.2599999999999998 110.995 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 9.8 mp 41.23 65.13 0.87 Allowed 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.218 -0.446 . . . . 1.27 111.491 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -62.88 167.0 5.02 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.422 -0.354 . . . . 1.1200000000000001 110.68 179.616 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -49.37 -39.8 33.51 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.707 0.289 . . . . 2.2000000000000002 111.436 179.597 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.95 -33.72 59.83 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.432 -0.349 . . . . 1.3500000000000001 110.699 -179.593 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 -67.02 -44.73 79.5 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.001 -0.545 . . . . 2.2200000000000002 110.583 179.782 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.531 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 80.4 mt -61.29 -51.77 69.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.992 -0.549 . . . . 0.54000000000000004 110.755 179.804 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.48 -21.0 66.53 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.044 -0.526 . . . . 0.5 111.193 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -72.09 -56.42 5.64 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 116.405 -0.361 . . . . 2.27 111.696 -179.405 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.531 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 8.6 p90 -77.85 -24.67 48.52 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.703 -0.399 . . . . 0.37 110.823 -179.636 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.426 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 20.1 tptm -66.81 -36.93 83.51 Favored 'General case' 0 C--O 1.233 0.201 0 N-CA-C 109.355 -0.609 . . . . 1.23 109.355 178.738 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.447 ' O ' HG22 ' A' ' 17' ' ' VAL . 23.5 t70 -68.05 -48.18 66.32 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 109.224 -0.658 . . . . 0.44 109.224 178.347 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.72 -14.31 61.04 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.666 -0.697 . . . . 0.28999999999999998 110.528 178.909 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.426 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 81.2 t80 -77.48 -49.94 13.7 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-N 115.929 -0.578 . . . . 0.47999999999999998 110.18 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.447 HG22 ' O ' ' A' ' 14' ' ' ASP . 34.0 m -66.91 -21.4 28.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.075 -0.511 . . . . 1.1100000000000001 110.141 179.395 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.435 ' HG3' ' O ' ' A' ' 14' ' ' ASP . 70.5 mt-30 -59.99 -46.17 90.34 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.625 -0.716 . . . . 1.6000000000000001 111.212 179.2 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 25.8 m-85 -84.36 22.33 1.27 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.304 -0.407 . . . . 0.64000000000000001 111.565 -179.471 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -120.45 66.15 0.84 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.146 0.498 . . . . 0.44 110.441 179.385 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 11.2 mmmm -73.32 -26.19 60.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.77 -0.65 . . . . 2.1000000000000001 111.269 -179.661 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -68.89 -42.64 76.66 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.111 -0.495 . . . . 1.8 111.306 -179.629 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 107.73 11.77 24.09 Favored Glycine 0 C--N 1.331 0.272 0 C-N-CA 120.723 -0.751 . . . . 0.46000000000000002 112.791 179.683 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 38.5 p -86.18 10.35 14.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.71 0.29 . . . . 0.40000000000000002 111.199 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 55.68 20.12 23.35 Favored Glycine 0 C--N 1.332 0.333 0 C-N-CA 120.803 -0.713 . . . . 0.33000000000000002 112.126 -179.703 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.504 ' C ' HE22 ' A' ' 62' ' ' GLN . 32.5 mtpt -130.35 155.93 45.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.727 0.299 . . . . 1.1000000000000001 111.081 -179.669 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.464 ' N ' HE22 ' A' ' 62' ' ' GLN . 39.5 pt -115.5 133.7 61.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.408 -0.36 . . . . 0.5 111.494 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -48.8 143.21 5.51 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.116 -0.493 . . . . 0.29999999999999999 111.696 -179.672 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.485 ' HA ' HD11 ' A' ' 63' ' ' LEU . 58.5 p -68.86 -29.87 68.27 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.662 -0.699 . . . . 1.03 111.724 -179.704 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.545 ' HD3' ' H ' ' A' ' 30' ' ' ARG . 0.2 OUTLIER -86.11 0.47 53.43 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.392 -0.367 . . . . 3.0800000000000001 111.109 -179.536 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -109.29 -3.57 17.08 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.105 -0.498 . . . . 2.2599999999999998 110.845 179.824 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.494 HD23 HD13 ' A' ' 63' ' ' LEU . 1.4 tm? -61.03 -52.33 65.43 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.232 -0.44 . . . . 1.3700000000000001 110.616 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.447 ' HA2' HD21 ' A' ' 48' ' ' LEU . . . -52.41 -41.25 55.12 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.638 -0.791 . . . . 0.32000000000000001 111.633 179.441 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 89.4 m -64.5 -34.67 78.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.018 0.437 . . . . 0.31 110.218 179.103 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 28.9 tp -66.82 -23.72 66.08 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.711 -0.677 . . . . 1.24 110.525 179.731 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.42 ' HG3' ' HG3' ' A' ' 43' ' ' PRO . 23.3 mmt -78.92 -39.23 35.34 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.221 -0.445 . . . . 1.1000000000000001 110.039 178.846 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 70.3 mtt180 -59.19 -43.12 92.2 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.691 -0.686 . . . . 2.6899999999999999 111.068 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.488 HG23 HD13 ' A' ' 39' ' ' LEU . 2.0 t -70.4 -13.29 62.07 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.38 -0.373 . . . . 1.0600000000000001 111.42 179.886 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.488 HD13 HG23 ' A' ' 38' ' ' THR . 10.6 mp -113.14 157.14 22.03 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.193 -0.458 . . . . 1.26 110.59 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -48.29 -19.23 1.07 Allowed Glycine 0 CA--C 1.519 0.314 0 CA-C-N 116.013 -0.54 . . . . 0.68999999999999995 113.441 -179.651 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 61.9 mm-40 -59.03 168.57 1.28 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.885 0.374 . . . . 1.97 110.894 179.764 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 6.0 t30 -170.27 64.35 0.47 Allowed Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.068 -0.515 . . . . 2.6600000000000001 110.777 179.605 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.534 ' HB3' ' NE2' ' A' ' 75' ' ' GLN . 32.1 Cg_endo -64.8 154.96 70.07 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.633 2.222 . . . . 0.51000000000000001 112.449 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.403 HG22 ' N ' ' A' ' 45' ' ' GLU . 20.8 m -80.43 157.01 26.37 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.027 -0.533 . . . . 0.72999999999999998 110.69 179.765 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.403 ' N ' HG22 ' A' ' 44' ' ' THR . 39.2 tt0 -46.77 -49.05 20.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.549 -0.296 . . . . 2.7000000000000002 111.343 -179.701 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.09 -55.27 25.2 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.199 -0.455 . . . . 0.46000000000000002 111.516 -179.664 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -50.7 -50.84 54.09 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.289 -0.414 . . . . 2.23 111.045 -179.91 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.502 HD13 HD11 ' A' ' 51' ' ' LEU . 0.2 OUTLIER -58.25 -40.66 82.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.295 -0.411 . . . . 1.3600000000000001 110.866 -179.844 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 85.0 mm-40 -67.42 -29.64 69.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.421 -0.354 . . . . 1.22 110.976 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -70.68 -49.37 47.94 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.22 -0.446 . . . . 0.62 111.529 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.502 HD11 HD13 ' A' ' 48' ' ' LEU . 0.9 OUTLIER -72.78 -28.32 62.52 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.49 -0.323 . . . . 0.39000000000000001 111.614 -179.375 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.493 HD11 HD12 ' A' ' 48' ' ' LEU . 28.2 mt -70.21 -46.03 73.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 120.771 0.319 . . . . 0.5 110.389 179.467 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.94 -25.53 62.78 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.079 -0.51 . . . . 0.58999999999999997 111.083 -179.884 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -77.98 -46.57 20.73 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.194 -0.457 . . . . 2.54 110.731 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -74.39 -27.13 60.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.188 -0.46 . . . . 0.53000000000000003 111.378 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -64.76 -34.38 78.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.796 0.331 . . . . 1.95 110.985 -179.772 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 79.1 m-20 -111.53 59.64 0.62 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.229 -0.441 . . . . 2.48 111.079 -179.878 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -170.81 -55.17 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.051 -0.522 . . . . 2.48 110.684 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 1.5 p30 -110.96 27.16 9.95 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.867 -0.606 . . . . 2.0499999999999998 110.818 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 62.66 -81.75 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.945 -0.57 . . . . 1.47 111.331 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -158.49 34.83 0.51 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.752 -0.737 . . . . 0.42999999999999999 112.546 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.504 HE22 ' C ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -140.47 150.22 43.52 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.031 0.443 . . . . 0.38 111.379 179.893 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.494 HD13 HD23 ' A' ' 32' ' ' LEU . 13.5 mt -121.99 155.48 35.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.804 -0.634 . . . . 1.4299999999999999 110.566 -179.905 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -113.4 157.03 22.42 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.482 -0.326 . . . . 1.1899999999999999 110.847 -179.657 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 59.7 t80 -43.16 -35.16 1.27 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.427 -0.351 . . . . 0.40000000000000002 111.228 179.571 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.35 -38.8 59.89 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.143 0.423 . . . . 0.81000000000000005 112.143 -179.579 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -63.99 -53.19 54.01 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.216 0.531 . . . . 1.3600000000000001 110.28 179.636 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.48 ' HD1' HD21 ' A' ' 32' ' ' LEU . 18.4 t80 -59.22 -52.41 65.82 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.495 -0.775 . . . . 0.51000000000000001 110.789 179.459 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 35.8 t -56.54 -49.0 76.09 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 116.28 -0.418 . . . . 0.75 110.51 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -43.67 -50.94 6.96 Favored Glycine 0 N--CA 1.45 -0.391 0 CA-C-N 115.503 -0.771 . . . . 0.40999999999999998 112.313 179.616 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.537 HG23 ' HE3' ' A' ' 74' ' ' LYS . 11.0 mt -67.1 -42.69 88.62 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.373 0 CA-C-O 120.823 0.344 . . . . 0.51000000000000001 111.064 179.752 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' MET . . . . . 0.403 ' HG2' ' O ' ' A' ' 68' ' ' PHE . 87.8 mmm -53.26 -41.05 65.1 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.28 0.562 . . . . 1.01 110.003 179.344 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.8 -53.24 60.28 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.297 -0.865 . . . . 0.69999999999999996 111.087 179.481 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.537 ' HE3' HG23 ' A' ' 71' ' ' ILE . 18.8 pttp -67.94 -27.09 66.32 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 120.858 0.361 . . . . 1.3799999999999999 111.327 -179.81 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' GLN . . . . . 0.534 ' NE2' ' HB3' ' A' ' 43' ' ' PRO . 35.2 tt0 -80.35 -28.05 38.13 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.104 -0.498 . . . . 1.98 111.826 -179.352 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 38.6 mtt -75.46 -41.92 54.48 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 116.448 -0.342 . . . . 1.2 111.541 -179.483 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 34.0 ptt180 -67.28 -21.91 65.68 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.4 -0.364 . . . . 4.6900000000000004 111.73 -179.368 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -94.29 -34.96 12.64 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.664 0.268 . . . . 4.0099999999999998 111.267 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 55.1 m -66.42 129.21 39.08 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.379 -0.373 . . . . 5.2800000000000002 111.006 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -157.39 29.41 0.29 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.999 -0.546 . . . . 5.5999999999999996 110.152 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.471 ' O ' ' HG3' ' A' ' 85' ' ' MET . 2.7 t -38.26 117.21 0.6 Allowed 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.823 -0.626 . . . . 7.29 111.289 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -79.86 -28.73 39.98 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 112.776 0.658 . . . . 9.7400000000000002 112.776 -178.3 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -59.91 -49.14 78.84 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.907 -0.317 . . . . 12.109999999999999 111.461 -179.393 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -69.72 -21.94 63.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.982 0.42 . . . . 10.869999999999999 110.628 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' MET . . . . . 0.604 ' SD ' HG13 ' A' ' 142' ' ' VAL . 23.9 mtt -72.75 -47.75 44.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.827 -0.624 . . . . 11.09 111.103 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.404 ' O ' ' HB3' ' A' ' 89' ' ' PHE . 64.7 ttt180 -62.17 -38.21 88.17 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.396 -0.365 . . . . 15.52 110.195 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -59.01 -45.11 91.49 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.165 -0.68 . . . . 14.85 109.165 178.731 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -69.15 -27.92 65.97 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.476 -0.784 . . . . 14.109999999999999 110.557 179.259 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.404 ' HB3' ' O ' ' A' ' 86' ' ' ARG . 62.0 t80 -63.4 -41.93 98.76 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.158 -0.474 . . . . 15.73 110.27 179.437 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 53.8 mttp -66.74 -41.82 87.2 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.765 -0.652 . . . . 17.66 110.435 179.481 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 78.3 mt -64.49 -39.61 86.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.102 -0.499 . . . . 18.149999999999999 111.076 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.535 ' HD1' HG11 ' A' ' 108' ' ' VAL . 1.7 m-85 -73.79 -33.75 64.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.345 -0.389 . . . . 18.34 111.103 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 51.1 t0 -81.27 114.87 20.36 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.364 -0.38 . . . . 19.289999999999999 110.507 179.768 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.525 ' HG2' ' HB3' ' A' ' 104' ' ' GLU . 22.0 mmm180 -65.47 -57.48 8.17 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.004 -0.544 . . . . 22.25 110.992 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.99 160.3 22.04 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.093 -0.503 . . . . 23.34 110.975 -179.693 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -84.18 5.49 79.88 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.857 -0.687 . . . . 22.0 112.175 179.641 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 16.8 p-10 -57.81 -33.36 68.5 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.747 0.308 . . . . 22.280000000000001 111.185 -179.893 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 96.04 26.97 10.63 Favored Glycine 0 C--N 1.331 0.274 0 C-N-CA 120.833 -0.699 . . . . 19.93 112.619 179.813 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 68.0 m-85 -142.57 142.69 32.21 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.599 0.238 . . . . 20.300000000000001 110.853 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.407 ' HB ' ' HB ' ' A' ' 136' ' ' ILE . 65.5 mt -114.38 127.27 71.92 Favored 'Isoleucine or valine' 0 C--O 1.231 0.126 0 CA-C-O 121.0 0.429 . . . . 19.370000000000001 111.17 179.882 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 75.6 m -114.44 156.5 44.44 Favored Pre-proline 0 C--N 1.332 -0.182 0 CA-C-N 115.879 -0.6 . . . . 22.489999999999998 110.783 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_exo -44.13 -35.86 8.16 Favored 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 122.41 2.073 . . . . 23.0 112.284 -179.813 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.436 ' O ' ' HG3' ' A' ' 106' ' ' ARG . . . -63.83 -48.11 78.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.169 -0.468 . . . . 24.559999999999999 110.734 179.709 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.525 ' HB3' ' HG2' ' A' ' 94' ' ' ARG . 45.4 mt-10 -72.9 -19.89 61.19 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.837 -0.619 . . . . 22.23 110.842 179.703 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.841 HD23 ' HB ' ' A' ' 121' ' ' ILE . 14.7 tp -80.16 -39.98 28.26 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.062 -0.517 . . . . 20.359999999999999 111.691 -179.22 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.489 ' HB3' HD13 ' A' ' 121' ' ' ILE . 7.4 ppt_? -73.76 -35.79 65.04 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.852 0.358 . . . . 27.190000000000001 110.517 -179.834 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 60.4 t80 -69.41 -44.7 70.85 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.963 -0.562 . . . . 25.359999999999999 111.306 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.535 HG11 ' HD1' ' A' ' 92' ' ' PHE . 7.3 p -63.75 -43.74 98.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.529 -0.305 . . . . 21.059999999999999 111.571 -179.536 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.464 ' N ' HG13 ' A' ' 108' ' ' VAL . 20.6 mmt -55.43 -45.63 76.75 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.519 -0.309 . . . . 20.93 111.29 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 81.2 mt -59.35 -25.05 29.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.963 0.411 . . . . 25.129999999999999 110.619 179.788 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 80.1 m-20 -77.67 -39.41 44.96 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.963 -0.562 . . . . 23.32 110.533 179.623 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.431 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 10.5 mt -69.68 -28.68 66.07 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.93 -0.577 . . . . 21.07 110.668 179.859 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 113.18 17.08 7.94 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.921 -0.657 . . . . 23.050000000000001 112.523 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -113.88 108.8 17.55 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.804 0.335 . . . . 22.59 111.087 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -77.04 113.83 15.18 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.163 -0.471 . . . . 27.960000000000001 110.989 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' VAL . . . . . 0.488 ' HB ' HG23 ' A' ' 121' ' ' ILE . 1.2 m -127.39 155.01 38.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.026 0.441 . . . . 24.75 111.6 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 117' ' ' THR . . . . . 0.44 ' O ' HG12 ' A' ' 121' ' ' ILE . 72.2 p -99.34 144.26 28.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.793 -0.639 . . . . 27.239999999999998 110.227 179.275 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -51.77 -20.94 2.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.274 -0.421 . . . . 26.629999999999999 111.551 -179.506 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 12.9 mm-40 -77.43 -55.33 5.48 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.502 -0.317 . . . . 29.140000000000001 111.694 -179.618 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -61.63 -40.92 96.59 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 111.825 0.306 . . . . 24.190000000000001 111.825 -179.204 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.841 ' HB ' HD23 ' A' ' 105' ' ' LEU . 4.9 pt -68.59 -42.67 83.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 C-N-CA 121.062 -0.255 . . . . 22.329999999999998 111.584 -179.442 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.523 ' N ' HG13 ' A' ' 121' ' ' ILE . 24.0 t70 -59.76 -33.16 71.32 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.825 0.345 . . . . 24.289999999999999 110.649 179.842 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 -66.06 -49.19 68.5 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.034 -0.53 . . . . 24.739999999999998 110.434 179.562 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.409 ' CE ' HD21 ' A' ' 105' ' ' LEU . 3.1 tmm? -56.96 -37.94 72.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.032 -0.531 . . . . 19.710000000000001 111.054 179.547 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.602 HD11 HD22 ' A' ' 105' ' ' LEU . 66.4 mt -65.55 -43.52 94.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.291 -0.413 . . . . 19.949999999999999 110.516 179.793 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 23.9 ttm180 -57.43 -35.43 70.08 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.892 -0.595 . . . . 24.949999999999999 110.984 179.824 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -69.47 -43.5 73.11 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.166 -0.47 . . . . 18.690000000000001 110.969 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.611 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -80.4 -12.22 59.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.217 -0.447 . . . . 16.469999999999999 111.283 -179.911 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -101.31 106.14 17.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.161 -0.472 . . . . 20.399999999999999 110.942 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 82.1 m-85 -98.16 -33.64 11.05 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.911 -0.586 . . . . 21.43 111.032 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -65.1 -16.41 63.44 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.213 -0.449 . . . . 23.370000000000001 110.772 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 61.16 82.75 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.871 -0.68 . . . . 24.32 112.55 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -151.68 -6.68 0.24 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.65 0.262 . . . . 23.879999999999999 111.393 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 74.66 20.47 79.51 Favored Glycine 0 C--N 1.331 0.253 0 C-N-CA 120.785 -0.721 . . . . 22.670000000000002 112.815 179.647 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 47.9 mtp -136.01 155.64 49.93 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.623 0.249 . . . . 22.91 110.385 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.706 HG23 ' HB2' ' A' ' 140' ' ' GLU . 48.6 mm -114.84 140.17 37.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 121.309 0.576 . . . . 18.41 112.092 -179.416 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 137' ' ' ASN . . . . . 0.449 ' O ' ' N ' ' A' ' 139' ' ' GLU . 1.9 m-20 -115.07 157.84 22.96 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.919 -1.037 . . . . 16.82 108.996 178.594 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 31.2 t80 -40.0 -23.84 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 120.762 0.315 . . . . 14.65 111.605 179.795 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.449 ' N ' ' O ' ' A' ' 137' ' ' ASN . 19.4 mm-40 -80.53 -55.77 4.63 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-O 120.958 0.408 . . . . 14.82 110.871 -179.586 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.706 ' HB2' HG23 ' A' ' 136' ' ' ILE . 25.8 mt-10 -61.27 -33.42 73.52 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.958 -0.565 . . . . 17.460000000000001 110.693 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.594 ' CZ ' HG21 ' A' ' 145' ' ' ILE . 76.9 t80 -66.91 -56.06 11.93 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.914 -0.585 . . . . 12.93 110.194 179.796 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.604 HG13 ' SD ' ' A' ' 85' ' ' MET . 2.5 t -45.75 -44.86 4.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.554 -0.748 . . . . 10.699999999999999 112.138 179.83 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 79.8 t90 -65.13 -55.58 17.89 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.439 0.533 . . . . 13.66 112.439 -178.69 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 144' ' ' MET . . . . . 0.611 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 17.3 ptt? -60.28 -36.71 78.48 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 112.099 0.407 . . . . 14.5 112.099 -178.185 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 145' ' ' ILE . . . . . 0.594 HG21 ' CZ ' ' A' ' 141' ' ' PHE . 2.8 pt -80.73 -15.39 12.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 C-N-CA 120.803 -0.359 . . . . 11.25 111.327 179.817 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 45.0 t -69.42 -38.9 78.09 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.385 -0.598 . . . . 8.5399999999999991 109.385 179.589 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 5.2 mm100 -87.03 -21.07 26.33 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.313 -0.858 . . . . 11.869999999999999 109.945 178.91 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 24.5 ttpp . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.258 -0.877 . . . . 13.68 111.11 179.7 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 149' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 151' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 55.8 m . . . . . 0 N--CA 1.485 1.286 0 CA-C-O 120.793 0.33 . . . . 4.8899999999999997 110.997 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -168.69 69.79 0.08 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.179 -0.464 . . . . 3.2599999999999998 110.92 -179.876 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.497 HD13 ' SG ' ' A' ' 69' ' ' CYS . 78.7 mt 47.05 81.17 0.04 OUTLIER 'General case' 0 C--O 1.232 0.178 0 CA-C-N 115.981 -0.554 . . . . 1.27 111.165 -179.865 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 50.5 p -73.19 -176.37 2.15 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.434 -0.348 . . . . 1.1200000000000001 111.525 -179.799 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -64.7 -38.08 89.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.475 -0.329 . . . . 2.2000000000000002 111.518 -179.586 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -75.06 -44.26 48.67 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.963 0.411 . . . . 1.3500000000000001 111.009 -179.549 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -61.92 -46.2 90.4 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.892 -0.595 . . . . 2.2200000000000002 110.885 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.542 ' HA ' ' CZ ' ' A' ' 12' ' ' PHE . 62.9 mt -58.56 -52.64 57.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.135 -0.484 . . . . 0.54000000000000004 111.006 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.85 -20.8 65.44 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.417 -0.356 . . . . 0.5 111.584 -179.722 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -70.82 -56.82 5.47 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 111.78 0.289 . . . . 2.27 111.78 -179.273 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.542 ' CZ ' ' HA ' ' A' ' 9' ' ' ILE . 19.3 p90 -79.57 -26.9 41.22 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 120.591 -0.444 . . . . 0.37 110.922 -179.692 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.428 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 45.8 tptt -65.51 -34.2 77.72 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 109.387 -0.598 . . . . 1.23 109.387 178.889 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.548 ' O ' HG22 ' A' ' 17' ' ' VAL . 14.4 t70 -69.98 -50.09 45.13 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 108.998 -0.742 . . . . 0.44 108.998 178.187 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.89 -14.8 50.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.663 -0.699 . . . . 0.28999999999999998 110.277 178.771 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.428 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 44.9 t80 -80.32 -45.47 17.78 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.636 -0.711 . . . . 0.47999999999999998 110.733 -179.616 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.548 HG22 ' O ' ' A' ' 14' ' ' ASP . 24.6 m -69.62 -20.46 23.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 121.003 0.43 . . . . 1.1100000000000001 110.288 179.749 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.469 ' HG3' ' O ' ' A' ' 14' ' ' ASP . 78.3 mt-30 -60.38 -29.43 68.94 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.784 -0.643 . . . . 1.6000000000000001 111.175 179.471 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 56.8 m-85 -104.34 13.64 31.69 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.558 -0.292 . . . . 0.64000000000000001 111.7 -179.409 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -114.12 81.96 1.62 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.981 0.419 . . . . 0.44 110.921 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 43.8 mmtm -85.42 -34.59 21.67 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.969 -0.56 . . . . 2.1000000000000001 111.291 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -62.26 -28.53 69.77 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.127 -0.488 . . . . 1.8 111.296 -179.6 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 89.69 7.25 69.1 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.697 -0.763 . . . . 0.46000000000000002 112.72 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 21.9 p -76.76 7.87 4.25 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.583 0.23 . . . . 0.40000000000000002 111.231 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 55.88 27.23 49.9 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.609 -0.805 . . . . 0.33000000000000002 111.745 -179.436 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.676 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 37.8 mtpt -136.68 155.56 49.71 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.858 0.361 . . . . 1.1000000000000001 111.095 -179.402 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.431 ' N ' HE22 ' A' ' 62' ' ' GLN . 46.5 pt -125.51 143.51 38.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.11 -0.496 . . . . 0.5 111.252 -179.735 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -56.92 124.98 20.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.365 -0.38 . . . . 0.29999999999999999 111.04 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.1 t -62.03 -13.36 25.31 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.116 -0.493 . . . . 1.03 111.268 -179.8 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 68.1 mtp180 -79.75 -29.07 40.41 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.125 -0.488 . . . . 3.0800000000000001 110.565 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -93.54 3.89 54.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.959 -0.564 . . . . 2.2599999999999998 110.341 179.678 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.442 HD23 HD22 ' A' ' 63' ' ' LEU . 0.8 OUTLIER -56.91 -55.29 36.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.794 -0.639 . . . . 1.3700000000000001 110.636 -179.932 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.478 ' HA3' HD21 ' A' ' 48' ' ' LEU . . . -53.91 -42.63 70.39 Favored Glycine 0 C--N 1.331 0.282 0 C-N-CA 120.556 -0.831 . . . . 0.32000000000000001 111.892 179.551 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 57.8 m -62.69 -36.35 82.64 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.094 0.473 . . . . 0.31 110.573 179.278 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 62.9 tp -65.28 -31.65 72.91 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.799 -0.637 . . . . 1.24 110.822 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.437 ' HG3' ' O ' ' A' ' 32' ' ' LEU . 19.3 mtp -80.48 -28.59 37.51 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.129 -0.487 . . . . 1.1000000000000001 110.851 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 24.9 mtp180 -65.23 -44.12 89.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.49 -0.323 . . . . 2.6899999999999999 110.731 179.738 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.452 HG23 ' CD1' ' A' ' 39' ' ' LEU . 1.3 t -65.59 -13.67 59.53 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.956 0.408 . . . . 1.0600000000000001 110.991 179.579 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.452 ' CD1' HG23 ' A' ' 38' ' ' THR . 8.8 mp -113.86 156.87 23.16 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.996 -0.547 . . . . 1.26 110.65 179.584 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -46.51 -27.95 3.22 Favored Glycine 0 CA--C 1.52 0.372 0 C-N-CA 120.886 -0.673 . . . . 0.68999999999999995 113.161 -179.834 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -60.66 154.64 20.87 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.712 0.292 . . . . 1.97 111.157 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 48.5 t-20 -172.13 82.61 0.46 Allowed Pre-proline 0 C--N 1.33 -0.242 0 CA-C-N 116.222 -0.444 . . . . 2.6600000000000001 110.747 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.401 ' HB3' ' NE2' ' A' ' 75' ' ' GLN . 56.1 Cg_endo -70.27 159.26 53.63 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.512 2.141 . . . . 0.51000000000000001 112.367 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 37.7 m -65.17 146.83 54.46 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.107 -0.497 . . . . 0.72999999999999998 110.584 179.685 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.499 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 16.8 mm-40 -48.38 -55.68 10.14 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.843 -0.162 . . . . 2.7000000000000002 111.377 -179.47 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -49.15 -42.66 40.32 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.784 0.326 . . . . 0.46000000000000002 111.248 -179.697 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.522 ' HG3' HD23 ' A' ' 51' ' ' LEU . 7.9 tp10 -64.52 -50.76 66.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.16 -0.473 . . . . 2.23 110.288 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.478 HD21 ' HA3' ' A' ' 33' ' ' GLY . 33.0 tp -57.32 -33.83 68.11 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.957 -0.565 . . . . 1.3600000000000001 110.9 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.499 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 77.4 mm-40 -73.55 -34.67 65.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.314 -0.403 . . . . 1.22 110.511 179.71 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 56.4 m-20 -72.26 -55.27 7.46 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.099 -0.501 . . . . 0.62 111.649 -179.71 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.522 HD23 ' HG3' ' A' ' 47' ' ' GLU . 1.9 pp -61.2 -34.64 75.41 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 111.823 0.305 . . . . 0.39000000000000001 111.823 -179.207 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 49.4 mt -72.01 -53.62 19.45 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 120.692 0.282 . . . . 0.5 110.857 179.61 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.85 -26.23 65.66 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.341 -0.39 . . . . 0.58999999999999997 111.036 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -77.33 -51.86 10.14 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.191 -0.459 . . . . 2.54 110.697 179.885 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -69.53 -16.6 63.46 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.197 -0.456 . . . . 0.53000000000000003 111.294 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -80.08 -36.66 35.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.361 -0.382 . . . . 1.95 110.964 -179.805 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -98.5 36.57 1.61 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.201 -0.454 . . . . 2.48 110.991 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -159.54 -27.39 0.07 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.172 -0.467 . . . . 2.48 110.937 179.894 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 10.4 m120 -120.19 20.44 12.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.273 -0.421 . . . . 2.0499999999999998 110.825 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 24.5 m-80 64.13 -81.34 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 115.901 -0.591 . . . . 1.47 111.453 179.694 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -154.84 5.21 0.26 Allowed Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.547 -0.835 . . . . 0.42999999999999999 113.001 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.676 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -117.23 153.91 32.08 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.984 0.421 . . . . 0.38 111.619 -179.945 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.525 ' HG ' ' HB2' ' A' ' 67' ' ' GLU . 1.7 tp -128.62 153.62 47.07 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.699 -0.682 . . . . 1.4299999999999999 110.201 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 10.9 m-80 -110.61 157.0 20.16 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-O 121.343 0.592 . . . . 1.1899999999999999 111.472 -179.363 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.443 ' O ' ' HB2' ' A' ' 69' ' ' CYS . 88.1 t80 -46.39 -38.91 9.58 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.91 -1.041 . . . . 0.40000000000000002 111.736 -179.439 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -67.49 -37.54 83.01 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.606 0.595 . . . . 0.81000000000000005 112.606 -179.087 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.525 ' HB2' ' HG ' ' A' ' 63' ' ' LEU . 7.7 mt-10 -63.92 -52.91 57.65 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.126 0.489 . . . . 1.3600000000000001 109.842 179.611 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.447 ' O ' ' HG3' ' A' ' 72' ' ' MET . 28.2 t80 -59.53 -54.39 47.14 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.551 -0.75 . . . . 0.51000000000000001 110.608 179.175 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.497 ' SG ' HD13 ' A' ' 4' ' ' LEU . 0.5 OUTLIER -53.78 -46.63 71.08 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.2 -0.455 . . . . 0.75 110.729 -179.986 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -48.28 -54.27 13.19 Favored Glycine 0 C--N 1.331 0.291 0 CA-C-N 115.857 -0.61 . . . . 0.40999999999999998 112.564 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.466 HG23 ' CE ' ' A' ' 74' ' ' LYS . 11.5 mt -61.79 -43.09 96.77 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.297 0 CA-C-O 120.861 0.363 . . . . 0.51000000000000001 110.751 179.755 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' MET . . . . . 0.447 ' HG3' ' O ' ' A' ' 68' ' ' PHE . 61.8 mtp -54.9 -28.93 54.39 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.965 -0.561 . . . . 1.01 110.05 179.582 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.89 -50.3 36.49 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.964 -0.562 . . . . 0.69999999999999996 110.754 179.63 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.466 ' CE ' HG23 ' A' ' 71' ' ' ILE . 63.8 pttt -68.84 -28.49 66.77 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.357 -0.383 . . . . 1.3799999999999999 111.655 -179.616 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' GLN . . . . . 0.401 ' NE2' ' HB3' ' A' ' 43' ' ' PRO . 7.5 tt0 -81.0 -55.05 5.04 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.123 0.416 . . . . 1.98 112.123 -179.319 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 71.3 mtp -59.49 -37.01 77.16 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 112.282 0.475 . . . . 1.2 112.282 -178.883 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.478 ' NE ' ' HA ' ' A' ' 77' ' ' ARG . 16.0 mmp_? -71.34 -41.05 70.28 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.523 0.201 . . . . 4.6900000000000004 111.263 -179.627 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 62.76 -84.89 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.231 -0.441 . . . . 4.0099999999999998 111.136 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 46.0 m -103.45 101.33 11.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.378 -0.374 . . . . 5.2800000000000002 110.735 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ASP . . . . . 0.419 ' O ' ' N ' ' A' ' 82' ' ' GLU . 0.1 OUTLIER -106.61 -34.13 7.44 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.381 -0.372 . . . . 5.5999999999999996 111.612 -179.533 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.602 ' O ' ' HG3' ' A' ' 85' ' ' MET . 65.7 m -47.23 90.15 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.035 -0.53 . . . . 7.29 111.707 -179.36 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.43 ' HB3' ' OH ' ' A' ' 138' ' ' TYR . 44.9 mt-10 -55.55 -16.34 3.83 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 112.873 0.694 . . . . 9.7400000000000002 112.873 -178.772 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -61.38 -55.99 25.38 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.863 0.364 . . . . 12.109999999999999 111.693 -179.329 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -71.59 -21.76 61.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.338 -0.392 . . . . 10.869999999999999 111.148 -179.522 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' MET . . . . . 0.646 ' HB3' HD11 ' A' ' 145' ' ' ILE . 10.8 mtp -74.38 -39.58 62.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.353 -0.385 . . . . 11.09 110.908 -179.473 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 61.4 ttt180 -69.76 -41.41 75.24 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.064 -0.517 . . . . 15.52 110.327 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -59.35 -40.93 87.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.219 0.533 . . . . 14.85 109.596 178.857 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -69.62 -29.51 67.02 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.652 -0.704 . . . . 14.109999999999999 110.425 179.277 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 64.0 t80 -66.91 -41.18 87.51 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.053 -0.521 . . . . 15.73 110.483 179.466 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 49.0 mttm -64.07 -42.93 96.82 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.882 -0.599 . . . . 17.66 110.789 179.616 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 84.0 mt -64.8 -46.95 90.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.892 -0.595 . . . . 18.149999999999999 111.066 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.493 ' CD1' HG11 ' A' ' 108' ' ' VAL . 2.2 m-85 -60.02 -48.03 83.41 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.256 -0.429 . . . . 18.34 110.867 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 42.9 t0 -64.68 109.49 2.04 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.074 -0.512 . . . . 19.289999999999999 110.608 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.477 ' HG2' ' HB3' ' A' ' 104' ' ' GLU . 19.1 mmm180 -64.84 -42.2 95.1 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.114 -0.494 . . . . 22.25 111.141 -179.441 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -94.39 178.46 5.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.277 -0.42 . . . . 23.34 110.969 -179.644 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.14 5.24 57.57 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.962 -0.637 . . . . 22.0 112.033 179.562 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 18.5 p-10 -63.54 -31.66 72.89 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.783 0.325 . . . . 22.280000000000001 111.079 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 93.41 27.28 13.5 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.784 -0.722 . . . . 19.93 112.606 179.704 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 67.9 m-85 -138.88 143.52 38.78 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.594 0.235 . . . . 20.300000000000001 110.879 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.498 ' HB ' ' HB ' ' A' ' 136' ' ' ILE . 56.1 mt -114.33 128.74 71.22 Favored 'Isoleucine or valine' 0 C--O 1.232 0.144 0 CA-C-O 120.94 0.4 . . . . 19.370000000000001 111.061 179.638 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 49.5 m -114.84 156.65 44.74 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 115.818 -0.628 . . . . 22.489999999999998 110.506 -179.868 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_exo -44.29 -35.11 7.84 Favored 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 122.174 1.916 . . . . 23.0 112.012 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.479 ' O ' ' HG3' ' A' ' 106' ' ' ARG . . . -65.35 -49.59 68.78 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.099 -0.501 . . . . 24.559999999999999 110.509 179.377 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.477 ' HB3' ' HG2' ' A' ' 94' ' ' ARG . 45.5 mt-10 -69.71 -20.37 63.54 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.862 -0.608 . . . . 22.23 110.641 179.506 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.635 HD23 ' HB ' ' A' ' 121' ' ' ILE . 42.1 tp -80.29 -39.55 28.59 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.061 -0.518 . . . . 20.359999999999999 111.51 -179.346 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.479 ' HG3' ' O ' ' A' ' 103' ' ' ALA . 3.3 ppt_? -72.03 -32.16 66.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.186 0.517 . . . . 27.190000000000001 110.39 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 81.0 t80 -73.49 -43.33 60.38 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.581 -0.736 . . . . 25.359999999999999 111.482 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.52 HG13 ' N ' ' A' ' 109' ' ' MET . 7.5 p -66.86 -48.17 80.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 N-CA-C 111.879 0.325 . . . . 21.059999999999999 111.879 -179.184 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.52 ' N ' HG13 ' A' ' 108' ' ' VAL . 22.7 mmt -50.84 -41.89 58.1 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 111.625 0.232 . . . . 20.93 111.625 -179.174 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 79.7 mt -61.78 -30.44 48.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 120.951 0.405 . . . . 25.129999999999999 110.528 179.401 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -70.77 -35.85 72.79 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.007 -0.542 . . . . 23.32 110.427 179.619 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 9.0 mp -72.84 -42.14 64.08 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.946 -0.57 . . . . 21.07 110.634 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 115.53 41.11 0.82 Allowed Glycine 0 N--CA 1.452 -0.272 0 CA-C-N 115.875 -0.602 . . . . 23.050000000000001 112.392 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -110.03 -31.75 7.26 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 111.577 0.214 . . . . 22.59 111.577 -179.558 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 36.6 mtmm 52.7 90.0 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.966 0.413 . . . . 27.960000000000001 110.606 -179.596 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 2.4 m -123.38 155.78 29.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.906 -0.588 . . . . 24.75 112.12 -178.93 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' THR . . . . . 0.408 ' O ' HG12 ' A' ' 121' ' ' ILE . 70.5 p -92.23 145.06 24.79 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.57 -0.741 . . . . 27.239999999999998 110.216 179.187 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 118' ' ' ASP . . . . . 0.479 ' HA ' HD11 ' A' ' 121' ' ' ILE . 8.8 m-20 -51.62 -18.38 1.14 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.041 -0.527 . . . . 26.629999999999999 111.98 -179.361 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -77.51 -55.62 5.22 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.078 0.399 . . . . 29.140000000000001 112.078 -179.008 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -61.87 -40.57 95.83 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 111.967 0.358 . . . . 24.190000000000001 111.967 -179.044 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.635 ' HB ' HD23 ' A' ' 105' ' ' LEU . 5.1 pt -69.63 -40.15 79.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 C-N-CA 120.897 -0.321 . . . . 22.329999999999998 111.522 -179.568 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.429 ' N ' HG13 ' A' ' 121' ' ' ILE . 15.4 t70 -56.49 -41.52 76.78 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.858 0.361 . . . . 24.289999999999999 110.42 179.552 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -62.83 -45.37 92.91 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.059 -0.519 . . . . 24.739999999999998 110.475 179.52 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 59.9 ttp -56.98 -38.2 72.69 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.034 -0.53 . . . . 19.710000000000001 110.868 179.49 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.615 HG23 HD11 ' A' ' 136' ' ' ILE . 58.6 mt -64.43 -38.39 82.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.147 -0.479 . . . . 19.949999999999999 110.525 179.691 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.407 ' HD2' HH11 ' A' ' 126' ' ' ARG . 6.7 ttp85 -62.21 -42.7 99.53 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.957 -0.565 . . . . 24.949999999999999 110.632 179.74 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -65.6 -26.46 67.85 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.876 -0.602 . . . . 18.690000000000001 110.962 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.623 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -95.65 -13.07 24.6 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.104 -0.498 . . . . 16.469999999999999 111.21 179.912 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -100.16 105.79 17.43 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.094 -0.503 . . . . 20.399999999999999 110.837 -179.77 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 91.2 m-85 -97.4 -30.91 12.65 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.878 -0.601 . . . . 21.43 111.387 -179.498 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -69.72 -15.04 63.08 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.301 -0.409 . . . . 23.370000000000001 110.715 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 60.5 87.4 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.977 -0.63 . . . . 24.32 113.059 179.581 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -155.7 -23.84 0.11 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.755 0.312 . . . . 23.879999999999999 111.099 179.511 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 93.87 23.51 22.85 Favored Glycine 0 C--N 1.331 0.293 0 C-N-CA 120.817 -0.706 . . . . 22.670000000000002 112.617 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 82.1 mmm -135.8 155.22 50.68 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 110.423 -0.214 . . . . 22.91 110.423 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.652 HG23 ' HB2' ' A' ' 140' ' ' GLU . 46.9 mm -114.57 139.53 40.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 121.306 0.574 . . . . 18.41 111.599 179.759 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 137' ' ' ASN . . . . . 0.451 ' O ' ' N ' ' A' ' 139' ' ' GLU . 16.2 m-20 -115.09 157.4 23.61 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.095 -0.957 . . . . 16.82 108.887 178.662 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.43 ' OH ' ' HB3' ' A' ' 82' ' ' GLU . 19.5 t80 -41.13 -22.86 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 120.893 0.378 . . . . 14.65 111.024 179.483 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.451 ' N ' ' O ' ' A' ' 137' ' ' ASN . 9.6 mm-40 -81.16 -55.25 4.87 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.24 -0.436 . . . . 14.82 111.019 -179.662 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.652 ' HB2' HG23 ' A' ' 136' ' ' ILE . 31.9 mt-10 -60.11 -34.1 73.04 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.195 -0.457 . . . . 17.460000000000001 110.74 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.482 ' CZ ' HG21 ' A' ' 145' ' ' ILE . 82.2 t80 -68.29 -55.28 12.68 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.034 -0.53 . . . . 12.93 110.326 179.503 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 2.3 t -47.04 -39.67 4.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.485 -0.78 . . . . 10.699999999999999 111.684 179.427 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 143' ' ' TRP . . . . . 0.466 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 84.8 t90 -71.06 -55.43 8.26 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.182 0.438 . . . . 13.66 112.182 -178.856 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 144' ' ' MET . . . . . 0.623 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 17.3 ptt? -61.3 -23.79 65.95 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 113.156 0.799 . . . . 14.5 113.156 -177.801 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 145' ' ' ILE . . . . . 0.646 HD11 ' HB3' ' A' ' 85' ' ' MET . 48.5 pt -80.7 -46.15 21.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 N-CA-C 112.488 0.551 . . . . 11.25 112.488 -179.287 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 146' ' ' SER . . . . . 0.573 ' N ' HG13 ' A' ' 145' ' ' ILE . 12.6 p -63.29 -13.94 44.09 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-O 121.201 0.524 . . . . 8.5399999999999991 110.469 -179.839 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 147' ' ' GLN . . . . . 0.466 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 17.0 mm-40 -117.57 13.77 14.39 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.35 -0.841 . . . . 11.869999999999999 111.326 -178.563 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 148' ' ' LYS . . . . . 0.544 ' HG3' ' O ' ' A' ' 144' ' ' MET . 35.5 mttm . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.19 -0.91 . . . . 13.68 110.84 179.548 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 149' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 151' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 40.2 t . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 120.846 0.355 . . . . 4.8899999999999997 110.833 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -146.46 133.86 20.75 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.137 -0.483 . . . . 3.2599999999999998 110.622 179.91 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.461 HD13 ' SG ' ' A' ' 69' ' ' CYS . 49.3 mt -67.12 89.84 0.19 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.955 0.407 . . . . 1.27 110.71 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.428 HG22 ' H ' ' A' ' 6' ' ' GLU . 0.2 OUTLIER -73.41 169.32 17.41 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.875 -0.602 . . . . 1.1200000000000001 111.073 -179.833 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.428 ' H ' HG22 ' A' ' 5' ' ' THR . 32.9 tt0 -52.05 -46.64 65.18 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.407 -0.36 . . . . 2.2000000000000002 111.501 179.668 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -70.82 -46.13 63.33 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.216 -0.447 . . . . 1.3500000000000001 111.08 -179.27 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -58.16 -42.99 87.14 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.975 -0.557 . . . . 2.2200000000000002 110.872 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.506 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 72.5 mt -59.47 -51.04 77.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.302 -0.408 . . . . 0.54000000000000004 110.376 179.596 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.08 -22.54 66.97 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.024 -0.535 . . . . 0.5 111.315 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -70.05 -56.87 5.81 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 116.34 -0.391 . . . . 2.27 111.835 -179.111 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.518 ' HB2' ' HE2' ' A' ' 68' ' ' PHE . 13.3 p90 -78.91 -24.85 43.85 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.733 -0.387 . . . . 0.37 110.692 -179.684 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.41 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 24.0 tptp -64.01 -35.58 81.17 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 108.923 -0.769 . . . . 1.23 108.923 178.382 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.443 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 20.4 t70 -70.14 -49.78 47.18 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 115.621 -0.718 . . . . 0.44 109.302 178.37 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.43 -14.62 42.81 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.769 -0.65 . . . . 0.28999999999999998 110.506 178.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.41 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 36.3 t80 -79.93 -50.58 10.24 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.742 -0.663 . . . . 0.47999999999999998 110.686 -179.708 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 31.2 m -65.93 -19.31 25.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 121.01 0.433 . . . . 1.1100000000000001 110.336 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.443 ' HG2' ' O ' ' A' ' 14' ' ' ASP . 75.3 mm-40 -58.64 -37.18 75.39 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.656 -0.702 . . . . 1.6000000000000001 111.331 179.294 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 62.0 m-85 -91.26 9.87 29.57 Favored 'General case' 0 N--CA 1.464 0.248 0 N-CA-C 111.767 0.284 . . . . 0.64000000000000001 111.767 -179.684 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -106.85 83.94 1.92 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.886 0.374 . . . . 0.44 110.808 179.602 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 29.9 mmmt -92.77 -10.61 36.34 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.061 -0.518 . . . . 2.1000000000000001 111.242 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -84.95 -14.32 47.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.147 -0.479 . . . . 1.8 111.281 -179.488 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.14 6.73 88.79 Favored Glycine 0 N--CA 1.453 -0.21 0 C-N-CA 120.688 -0.768 . . . . 0.46000000000000002 112.605 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 40.2 p -82.4 8.09 12.39 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.688 0.28 . . . . 0.40000000000000002 111.071 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 56.94 18.01 24.49 Favored Glycine 0 C--N 1.332 0.34 0 C-N-CA 120.824 -0.703 . . . . 0.33000000000000002 112.165 -179.683 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.475 ' C ' HE22 ' A' ' 62' ' ' GLN . 32.6 mtpt -129.31 155.69 45.21 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.773 0.32 . . . . 1.1000000000000001 111.161 -179.406 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.46 ' N ' HE22 ' A' ' 62' ' ' GLN . 39.8 pt -118.19 133.02 66.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 120.895 0.379 . . . . 0.5 111.455 -179.791 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -52.52 138.77 27.03 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.079 -0.509 . . . . 0.29999999999999999 111.247 -179.816 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.555 ' HA ' HD11 ' A' ' 63' ' ' LEU . 8.9 t -71.27 -2.51 16.41 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.194 -0.457 . . . . 1.03 111.323 -179.771 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.436 ' HD2' ' N ' ' A' ' 30' ' ' ARG . 0.9 OUTLIER -98.48 2.49 47.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.029 0.443 . . . . 3.0800000000000001 110.25 179.592 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -124.43 -5.41 7.7 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.782 -0.645 . . . . 2.2599999999999998 110.886 -179.745 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.468 ' O ' ' HG2' ' A' ' 36' ' ' MET . 2.1 tm? -55.57 -51.28 67.64 Favored 'General case' 0 C--O 1.233 0.198 0 N-CA-C 109.954 -0.387 . . . . 1.3700000000000001 109.954 179.694 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.42 ' HA2' HD11 ' A' ' 48' ' ' LEU . . . -53.71 -37.31 56.72 Favored Glycine 0 C--N 1.333 0.366 0 C-N-CA 120.629 -0.796 . . . . 0.32000000000000001 111.4 179.122 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 59.7 m -67.49 -31.48 71.65 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.279 0.561 . . . . 0.31 110.112 178.974 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 56.3 tp -72.83 -19.72 61.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.544 -0.753 . . . . 1.24 110.369 179.554 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.468 ' HG2' ' O ' ' A' ' 32' ' ' LEU . 75.8 mmm -80.02 -47.11 15.43 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.062 -0.517 . . . . 1.1000000000000001 110.786 179.593 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 13.4 ptm180 -61.85 -39.87 93.38 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.365 -0.38 . . . . 2.6899999999999999 111.399 -179.763 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.491 HG23 HD12 ' A' ' 39' ' ' LEU . 5.3 t -62.84 -14.42 45.64 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 121.179 0.514 . . . . 1.0600000000000001 110.413 179.491 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.491 HD12 HG23 ' A' ' 38' ' ' THR . 6.8 mp -114.46 157.21 23.23 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.464 -0.789 . . . . 1.26 109.31 178.385 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -74.02 34.54 0.91 Allowed Glycine 0 CA--C 1.521 0.43 0 C-N-CA 120.612 -0.804 . . . . 0.68999999999999995 113.298 -179.74 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.471 ' OE1' ' HB3' ' A' ' 39' ' ' LEU . 3.5 mm100 -91.65 -68.12 0.81 Allowed 'General case' 0 C--O 1.232 0.14 0 CA-C-O 120.829 0.347 . . . . 1.97 110.547 179.517 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 31.0 m-80 54.42 78.32 0.39 Allowed Pre-proline 0 CA--C 1.53 0.183 0 CA-C-N 115.961 -0.563 . . . . 2.6600000000000001 111.16 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.429 ' HD3' ' HB3' ' A' ' 36' ' ' MET . 74.4 Cg_endo -75.04 175.51 11.15 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.456 2.104 . . . . 0.51000000000000001 112.319 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 34.4 m -74.16 149.01 41.19 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.173 -0.467 . . . . 0.72999999999999998 110.734 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.479 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 38.1 mt-10 -53.6 -55.84 22.31 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.546 -0.297 . . . . 2.7000000000000002 111.484 -179.664 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.85 -47.08 71.32 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.339 -0.391 . . . . 0.46000000000000002 111.698 -179.405 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -57.9 -49.95 74.99 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.926 0.393 . . . . 2.23 110.582 -179.689 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.42 HD11 ' HA2' ' A' ' 33' ' ' GLY . 21.4 tp -57.48 -37.13 72.42 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.832 -0.622 . . . . 1.3600000000000001 111.068 -179.772 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.479 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 78.4 mm-40 -75.2 -28.01 59.82 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.42 -0.355 . . . . 1.22 111.264 -179.818 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 45.7 m-20 -75.35 -46.05 35.6 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.402 -0.363 . . . . 0.62 111.681 -179.588 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.414 HD21 ' HA ' ' A' ' 48' ' ' LEU . 1.9 pp -71.92 -40.12 69.01 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.552 -0.295 . . . . 0.39000000000000001 111.66 -179.314 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 71.8 mt -64.97 -45.02 95.94 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-O 120.746 0.308 . . . . 0.5 110.736 179.795 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -69.08 -35.12 76.15 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.308 -0.405 . . . . 0.58999999999999997 110.667 179.767 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -64.93 -46.63 80.83 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.18 -0.464 . . . . 2.54 109.87 179.384 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -70.92 -21.5 62.35 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.844 -0.616 . . . . 0.53000000000000003 110.909 179.295 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -65.65 -54.39 28.17 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.344 -0.389 . . . . 1.95 110.865 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 87.1 m-20 -93.81 52.76 1.71 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.279 -0.419 . . . . 2.48 110.932 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -162.33 -63.24 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.188 -0.46 . . . . 2.48 110.628 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 29.4 m-80 -93.0 27.1 2.54 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.204 -0.453 . . . . 2.0499999999999998 110.869 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 57.5 m-20 65.21 -78.98 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 115.998 -0.546 . . . . 1.47 111.172 179.876 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -163.79 22.06 0.16 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.901 -0.666 . . . . 0.42999999999999999 112.297 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.475 HE22 ' C ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -131.92 153.1 50.61 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.976 0.417 . . . . 0.38 111.38 -179.782 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.555 HD11 ' HA ' ' A' ' 29' ' ' THR . 33.6 mt -120.63 151.9 38.86 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.768 -0.651 . . . . 1.4299999999999999 110.276 179.818 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 19.9 m-80 -113.18 157.69 21.37 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.765 0.317 . . . . 1.1899999999999999 110.879 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -42.61 -39.75 2.46 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.751 -0.659 . . . . 0.40000000000000002 111.415 -179.499 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -68.98 -35.63 76.94 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.105 0.409 . . . . 0.81000000000000005 112.105 -179.575 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -61.1 -52.87 63.08 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.01 0.433 . . . . 1.3600000000000001 110.457 179.739 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.518 ' HE2' ' HB2' ' A' ' 12' ' ' PHE . 36.6 t80 -65.63 -46.24 80.01 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.698 -0.683 . . . . 0.51000000000000001 111.02 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.461 ' SG ' HD13 ' A' ' 4' ' ' LEU . 2.7 t -58.38 -46.99 85.28 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.233 -0.44 . . . . 0.75 110.723 -179.932 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -53.32 -50.27 53.12 Favored Glycine 0 N--CA 1.451 -0.347 0 CA-C-N 115.837 -0.619 . . . . 0.40999999999999998 112.136 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.604 HG23 ' HE2' ' A' ' 74' ' ' LYS . 12.6 mt -62.57 -38.04 80.46 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.386 0 CA-C-O 120.924 0.392 . . . . 0.51000000000000001 110.787 179.695 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -58.6 -28.57 65.71 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.899 -0.591 . . . . 1.01 110.26 179.421 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -73.09 -49.45 28.4 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.06 -0.518 . . . . 0.69999999999999996 110.778 179.632 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.604 ' HE2' HG23 ' A' ' 71' ' ' ILE . 61.9 pttt -69.56 -26.7 64.62 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.245 -0.434 . . . . 1.3799999999999999 110.838 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 58.2 tt0 -78.69 -50.06 12.07 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.074 -0.512 . . . . 1.98 110.99 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 34.8 mtt -55.53 -36.65 66.98 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 116.175 -0.466 . . . . 1.2 110.908 179.779 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 13.9 tpt180 -61.36 -27.58 68.62 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.782 -0.645 . . . . 4.6900000000000004 110.827 179.836 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -77.69 -45.58 24.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.029 -0.532 . . . . 4.0099999999999998 110.817 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 72.6 p -88.0 70.38 9.41 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.049 -0.523 . . . . 5.2800000000000002 111.646 -179.362 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -77.36 92.18 3.91 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.029 -0.532 . . . . 5.5999999999999996 110.315 179.267 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.505 ' O ' ' HG2' ' A' ' 85' ' ' MET . 6.1 t 35.52 58.69 0.84 Allowed 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.079 0.466 . . . . 7.29 111.388 -179.558 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.44 ' HA ' ' HG2' ' A' ' 85' ' ' MET . 13.1 pt-20 -46.08 -32.38 2.84 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 113.064 0.764 . . . . 9.7400000000000002 113.064 -178.479 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -53.74 -56.06 20.77 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.002 0.43 . . . . 12.109999999999999 111.733 -179.152 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -65.99 -17.51 64.72 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.227 -0.442 . . . . 10.869999999999999 110.85 -179.935 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' MET . . . . . 0.603 ' CB ' HG22 ' A' ' 142' ' ' VAL . 0.8 OUTLIER -83.0 -25.02 32.63 Favored 'General case' 0 CA--C 1.509 -0.63 0 CA-C-O 121.912 0.863 . . . . 11.09 109.081 -179.089 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 31.1 tpt180 -71.04 -45.23 64.22 Favored 'General case' 0 N--CA 1.442 -0.835 0 CA-C-N 113.902 -1.499 . . . . 15.52 110.151 179.693 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -69.26 -37.26 77.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.844 -0.616 . . . . 14.85 110.06 178.839 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -69.69 -39.58 76.86 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.008 -0.542 . . . . 14.109999999999999 111.046 179.635 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -64.25 -34.84 79.04 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.995 0.426 . . . . 15.73 110.276 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 59.8 mttt -62.45 -55.23 29.65 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.726 -0.67 . . . . 17.66 110.882 179.493 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 55.1 mt -64.15 -29.68 48.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.655 -0.702 . . . . 18.149999999999999 111.652 -179.409 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -79.6 -29.97 41.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.584 -0.28 . . . . 18.34 111.657 -179.403 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 24.1 t0 -83.84 101.83 11.91 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.009 0.433 . . . . 19.289999999999999 110.617 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.86 -14.17 58.65 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.874 -0.603 . . . . 22.25 111.719 -179.567 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.467 ' HB2' ' OD1' ' A' ' 97' ' ' ASP . 4.7 m-20 -125.66 160.07 30.62 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.932 0.396 . . . . 23.34 111.148 -179.876 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -87.68 5.34 85.11 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.899 -0.667 . . . . 22.0 112.051 179.64 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.467 ' OD1' ' HB2' ' A' ' 95' ' ' ASP . 10.4 p-10 -61.54 -33.12 73.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.784 0.326 . . . . 22.280000000000001 110.962 -179.844 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 99.84 17.85 24.43 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.758 -0.734 . . . . 19.93 112.845 179.691 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' PHE . . . . . 0.421 ' HB2' ' OD2' ' A' ' 97' ' ' ASP . 98.0 m-85 -141.09 147.1 38.01 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.815 0.34 . . . . 20.300000000000001 111.313 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 71.3 mt -114.96 136.2 52.41 Favored 'Isoleucine or valine' 0 C--O 1.232 0.157 0 CA-C-N 116.141 -0.482 . . . . 19.370000000000001 110.828 179.368 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 70.8 m -114.64 156.13 45.18 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 116.076 -0.511 . . . . 22.489999999999998 110.647 -179.819 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -40.1 -36.14 1.39 Allowed 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 122.458 2.105 . . . . 23.0 112.524 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.83 -51.66 60.89 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.105 -0.498 . . . . 24.559999999999999 110.839 179.58 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.402 ' O ' HG23 ' A' ' 108' ' ' VAL . 45.8 mt-10 -63.42 -45.03 92.87 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.808 -0.633 . . . . 22.23 110.739 179.768 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.769 HD23 ' HB ' ' A' ' 121' ' ' ILE . 21.7 tp -52.27 -42.71 63.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.862 -0.608 . . . . 20.359999999999999 110.999 -179.665 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.547 HH21 ' HA ' ' A' ' 117' ' ' THR . 4.4 ttm180 -72.13 -45.24 61.33 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.896 -0.593 . . . . 27.190000000000001 111.14 -179.907 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -53.14 -34.2 55.76 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.272 -0.422 . . . . 25.359999999999999 111.42 -179.468 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.466 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 43.3 t -80.17 -51.15 16.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.636 -0.256 . . . . 21.059999999999999 111.292 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 18.1 mmt -49.61 -46.18 49.01 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.372 -0.376 . . . . 20.93 111.406 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 68.4 mt -62.31 -30.16 48.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.92 0.39 . . . . 25.129999999999999 110.589 179.74 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 -74.94 -28.02 60.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.029 -0.532 . . . . 23.32 110.913 179.494 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 27.8 mt -77.16 -41.79 40.31 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.108 -0.496 . . . . 21.07 110.732 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 131.18 -5.2 5.65 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.996 -0.621 . . . . 23.050000000000001 111.965 -179.611 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -91.13 97.69 11.3 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.696 0.284 . . . . 22.59 110.875 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -68.71 102.1 1.45 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.291 -0.413 . . . . 27.960000000000001 110.82 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' VAL . . . . . 0.442 ' HB ' HG23 ' A' ' 121' ' ' ILE . 2.3 m -115.86 154.74 17.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.212 -0.449 . . . . 24.75 111.428 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 117' ' ' THR . . . . . 0.547 ' HA ' HH21 ' A' ' 106' ' ' ARG . 81.5 p -98.88 145.77 26.65 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.854 -0.612 . . . . 27.239999999999998 110.53 179.487 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -51.88 -20.84 2.49 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.227 -0.442 . . . . 26.629999999999999 111.612 -179.549 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -78.26 -53.2 7.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.427 -0.351 . . . . 29.140000000000001 111.676 -179.527 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -63.83 -37.91 89.13 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.04 0.385 . . . . 24.190000000000001 112.04 -179.115 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.769 ' HB ' HD23 ' A' ' 105' ' ' LEU . 38.7 pt -72.83 -42.19 61.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 C-N-CA 120.83 -0.348 . . . . 22.329999999999998 111.702 -179.518 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.478 ' N ' HG13 ' A' ' 121' ' ' ILE . 18.1 t70 -58.74 -44.77 90.59 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.842 0.353 . . . . 24.289999999999999 110.671 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -60.08 -44.99 94.38 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.082 -0.508 . . . . 24.739999999999998 110.457 179.475 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 43.2 ttp -57.46 -33.66 68.19 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.905 -0.588 . . . . 19.710000000000001 110.63 179.386 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 66.5 mt -65.82 -43.96 93.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.048 -0.524 . . . . 19.949999999999999 110.554 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 33.8 ttm180 -58.23 -40.66 82.28 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.924 -0.58 . . . . 24.949999999999999 111.048 179.802 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -56.45 -43.65 79.7 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.254 -0.43 . . . . 18.690000000000001 111.08 -179.892 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.628 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -87.39 -14.25 41.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.148 -0.478 . . . . 16.469999999999999 111.28 -179.776 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 129' ' ' ASP . . . . . 0.432 ' HA ' ' OE1' ' A' ' 140' ' ' GLU . 27.5 t70 -93.61 99.23 11.71 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.015 0.436 . . . . 20.399999999999999 110.728 -179.739 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -89.74 -37.1 14.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.8 -0.636 . . . . 21.43 111.278 -179.679 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -63.7 -18.04 63.59 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.324 -0.398 . . . . 23.370000000000001 110.583 -179.828 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 60.74 83.45 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.977 -0.63 . . . . 24.32 112.831 179.665 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 133' ' ' ASP . . . . . 0.424 ' OD2' ' HB2' ' A' ' 135' ' ' MET . 12.6 p-10 -146.44 -5.62 0.56 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.791 0.329 . . . . 23.879999999999999 111.086 179.586 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 77.09 11.71 85.31 Favored Glycine 0 C--N 1.331 0.254 0 C-N-CA 120.866 -0.683 . . . . 22.670000000000002 112.699 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 135' ' ' MET . . . . . 0.424 ' HB2' ' OD2' ' A' ' 133' ' ' ASP . 88.9 mtp -133.38 154.27 50.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.646 0.26 . . . . 22.91 110.389 179.653 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.662 HG23 ' HB2' ' A' ' 140' ' ' GLU . 40.4 mm -115.3 144.89 21.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 121.254 0.55 . . . . 18.41 112.155 -179.246 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 137' ' ' ASN . . . . . 0.429 ' O ' ' N ' ' A' ' 139' ' ' GLU . 30.0 p-10 -114.81 157.86 22.68 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.304 -0.862 . . . . 16.82 108.779 178.058 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.645 ' O ' HG23 ' A' ' 142' ' ' VAL . 27.8 t80 -39.27 -25.19 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 112.377 0.51 . . . . 14.65 112.377 -179.152 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.429 ' N ' ' O ' ' A' ' 137' ' ' ASN . 44.9 mt-10 -80.05 -55.92 4.61 Favored 'General case' 0 C--O 1.234 0.275 0 O-C-N 122.226 -0.296 . . . . 14.82 111.401 -179.563 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.662 ' HB2' HG23 ' A' ' 136' ' ' ILE . 30.7 mt-10 -60.82 -27.33 67.97 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.986 0.422 . . . . 17.460000000000001 110.36 179.895 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.619 ' HA ' ' HE2' ' A' ' 144' ' ' MET . 91.6 t80 -69.33 -56.01 8.77 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.905 -0.588 . . . . 12.93 109.787 179.333 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.645 HG23 ' O ' ' A' ' 138' ' ' TYR . 38.9 t -45.41 -40.84 2.84 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 CA-C-N 115.55 -0.75 . . . . 10.699999999999999 111.643 178.917 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 143' ' ' TRP . . . . . 0.41 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 75.5 t90 -67.68 -55.61 12.58 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.744 0.646 . . . . 13.66 112.744 -178.845 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 144' ' ' MET . . . . . 0.628 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 19.9 ptt? -67.07 -20.25 65.79 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 113.257 0.836 . . . . 14.5 113.257 -177.433 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 145' ' ' ILE . . . . . 0.574 HG23 ' O ' ' A' ' 141' ' ' PHE . 43.4 pt -80.52 -46.09 21.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 N-CA-C 112.236 0.458 . . . . 11.25 112.236 -179.121 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 146' ' ' SER . . . . . 0.551 ' N ' HG13 ' A' ' 145' ' ' ILE . 28.8 t -63.58 -13.93 46.55 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.193 0.521 . . . . 8.5399999999999991 110.356 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 147' ' ' GLN . . . . . 0.41 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 16.6 mm-40 -118.35 45.33 2.04 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.385 -0.825 . . . . 11.869999999999999 111.651 -178.245 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 148' ' ' LYS . . . . . 0.442 ' HE3' ' O ' ' A' ' 145' ' ' ILE . 10.4 mtmp? . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.242 -0.885 . . . . 13.68 110.919 179.51 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 149' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 151' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 56.9 m . . . . . 0 N--CA 1.486 1.347 0 CA-C-O 120.8 0.333 . . . . 4.8899999999999997 110.893 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -135.68 14.94 3.39 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.171 -0.468 . . . . 3.2599999999999998 111.164 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.9 mt -61.07 94.48 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.118 -0.492 . . . . 1.27 111.007 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 72.3 p -76.68 -177.45 4.27 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.456 -0.338 . . . . 1.1200000000000001 111.294 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -60.25 -51.26 70.32 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.376 -0.375 . . . . 2.2000000000000002 111.562 -179.512 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -67.74 -45.63 74.44 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.983 0.42 . . . . 1.3500000000000001 111.018 -179.572 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 81.4 mm-40 -59.23 -42.41 90.95 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.812 -0.631 . . . . 2.2200000000000002 111.245 -179.717 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.532 ' HA ' ' CZ ' ' A' ' 12' ' ' PHE . 55.0 mt -60.62 -49.79 83.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.884 0.373 . . . . 0.54000000000000004 110.652 179.744 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.2 -19.07 64.73 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.995 -0.548 . . . . 0.5 111.099 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -73.94 -55.83 5.69 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.259 -0.428 . . . . 2.27 111.767 -179.238 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.532 ' CZ ' ' HA ' ' A' ' 9' ' ' ILE . 4.2 p90 -77.53 -24.51 49.95 Favored 'General case' 0 C--N 1.332 -0.196 0 C-N-CA 120.673 -0.411 . . . . 0.37 111.012 -179.582 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 23.9 tptp -66.92 -41.44 87.05 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 109.397 -0.594 . . . . 1.23 109.397 178.9 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -65.26 -47.67 75.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.898 -0.592 . . . . 0.44 109.477 178.498 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.87 -30.65 70.27 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 115.643 -0.708 . . . . 0.28999999999999998 110.415 179.127 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 24.9 t80 -66.95 -38.89 86.96 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.572 -0.74 . . . . 0.47999999999999998 110.623 179.664 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -70.88 -28.39 33.5 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.774 0 CA-C-N 115.966 -0.561 . . . . 1.1100000000000001 111.153 -179.724 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -60.54 -27.86 67.98 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.791 -0.641 . . . . 1.6000000000000001 111.486 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 54.9 m-85 -94.01 -12.63 28.22 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.63 -0.259 . . . . 0.64000000000000001 111.672 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -84.93 91.25 8.0 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.894 0.378 . . . . 0.44 110.732 179.621 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 71.8 mmtt -100.03 -26.03 14.11 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.965 -0.561 . . . . 2.1000000000000001 111.243 -179.659 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -70.96 -20.14 62.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.168 -0.469 . . . . 1.8 111.281 -179.549 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 86.45 0.2 86.64 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.786 -0.721 . . . . 0.46000000000000002 112.707 179.627 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 22.7 p -79.39 10.74 3.48 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.738 0.304 . . . . 0.40000000000000002 111.212 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 55.54 30.01 54.97 Favored Glycine 0 C--N 1.331 0.293 0 C-N-CA 120.82 -0.705 . . . . 0.33000000000000002 112.066 -179.877 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.482 ' C ' HE22 ' A' ' 62' ' ' GLN . 33.0 mtmm -138.33 155.85 48.18 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.744 0.307 . . . . 1.1000000000000001 111.238 -179.466 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.558 HG13 ' HB2' ' A' ' 63' ' ' LEU . 33.8 pt -116.12 126.41 73.61 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 116.358 -0.383 . . . . 0.5 111.199 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -50.74 142.02 11.99 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.181 -0.463 . . . . 0.29999999999999999 111.501 -179.898 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.503 ' HA ' HD11 ' A' ' 63' ' ' LEU . 9.8 t -67.44 -16.09 64.03 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.886 -0.597 . . . . 1.03 111.745 -179.542 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -89.46 5.08 46.95 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.473 -0.33 . . . . 3.0800000000000001 110.679 179.728 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -123.18 -4.26 8.45 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.091 -0.504 . . . . 2.2599999999999998 110.942 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.508 HD21 ' CD1' ' A' ' 68' ' ' PHE . 1.6 tm? -58.81 -48.6 80.75 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.35 -0.386 . . . . 1.3700000000000001 110.373 179.617 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -55.64 -35.77 63.18 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.533 -0.841 . . . . 0.32000000000000001 111.306 179.341 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 88.5 m -69.74 -39.92 76.5 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.062 0.458 . . . . 0.31 110.21 179.272 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 56.1 tp -65.15 -24.07 67.3 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.731 -0.668 . . . . 1.24 110.322 179.439 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.496 ' HG3' ' HG3' ' A' ' 43' ' ' PRO . 21.5 mmt -75.46 -43.32 50.15 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.94 -0.573 . . . . 1.1000000000000001 110.13 179.139 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -55.87 -50.14 71.43 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.645 -0.707 . . . . 2.6899999999999999 111.102 179.834 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.442 HG23 ' HG ' ' A' ' 39' ' ' LEU . 10.1 t -61.68 -13.49 23.17 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.294 -0.412 . . . . 1.0600000000000001 111.135 179.84 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.442 ' HG ' HG23 ' A' ' 38' ' ' THR . 75.0 mt -113.57 157.16 22.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.096 -0.502 . . . . 1.26 110.613 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -75.85 40.36 1.4 Allowed Glycine 0 CA--C 1.521 0.426 0 C-N-CA 120.883 -0.675 . . . . 0.68999999999999995 114.027 -178.884 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 9.9 mp0 -97.15 -66.72 0.88 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 117.103 0.451 . . . . 1.97 111.109 179.029 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 59.0 m-20 60.82 67.21 1.55 Allowed Pre-proline 0 CA--C 1.53 0.199 0 CA-C-N 116.149 -0.478 . . . . 2.6600000000000001 111.098 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.496 ' HG3' ' HG3' ' A' ' 36' ' ' MET . 60.1 Cg_endo -71.47 160.39 48.65 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.72 2.28 . . . . 0.51000000000000001 112.124 179.655 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 33.4 m -74.5 146.76 42.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.153 -0.476 . . . . 0.72999999999999998 110.604 179.635 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.435 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 41.9 tt0 -46.4 -50.34 16.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.61 -0.268 . . . . 2.7000000000000002 111.137 -179.522 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -51.32 -53.07 39.66 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.274 -0.421 . . . . 0.46000000000000002 111.315 -179.748 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.467 ' HG2' HD23 ' A' ' 51' ' ' LEU . 36.8 tt0 -52.08 -49.5 63.43 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.357 -0.383 . . . . 2.23 110.618 179.888 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 51.6 mt -57.87 -40.24 79.73 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.38 -0.373 . . . . 1.3600000000000001 110.584 179.572 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.435 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 31.7 mm-40 -65.66 -32.74 74.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.411 -0.359 . . . . 1.22 111.026 179.862 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -75.13 -54.64 6.79 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.222 -0.444 . . . . 0.62 112.103 -179.349 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.467 HD23 ' HG2' ' A' ' 47' ' ' GLU . 2.2 pp -66.33 -39.71 89.42 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 111.995 0.368 . . . . 0.39000000000000001 111.995 -178.871 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 86.1 mt -68.48 -43.31 83.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 C-N-CA 121.147 -0.221 . . . . 0.5 111.054 -179.647 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.86 -38.86 89.95 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.809 0.338 . . . . 0.58999999999999997 110.811 179.72 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -64.02 -43.54 95.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.13 -0.486 . . . . 2.54 110.309 179.607 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -77.19 -16.36 59.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.983 -0.553 . . . . 0.53000000000000003 110.996 179.543 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -65.74 -23.9 66.84 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.148 -0.478 . . . . 1.95 110.799 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -103.92 29.61 5.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.035 -0.53 . . . . 2.48 110.621 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 58.8 t30 -158.51 150.26 21.23 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.007 -0.542 . . . . 2.48 110.754 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 74.4 m-20 59.76 15.1 4.54 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.042 -0.526 . . . . 2.0499999999999998 111.021 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 18.3 m-80 60.71 12.9 3.96 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.905 -0.589 . . . . 1.47 111.917 179.29 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 113.62 30.47 2.6 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.636 -0.792 . . . . 0.42999999999999999 112.389 179.722 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.482 HE22 ' C ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -127.32 154.52 44.84 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.095 0.474 . . . . 0.38 111.3 -179.832 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.558 ' HB2' HG13 ' A' ' 27' ' ' ILE . 17.4 mt -121.08 152.42 38.68 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.608 -0.724 . . . . 1.4299999999999999 109.753 179.366 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ASN . . . . . 0.438 ' H ' ' CG ' ' A' ' 67' ' ' GLU . 0.8 OUTLIER -113.07 156.76 22.55 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 110.19 -0.3 . . . . 1.1899999999999999 110.19 -179.483 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.537 ' O ' ' HB2' ' A' ' 69' ' ' CYS . 82.8 t80 -42.41 -41.56 2.93 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.483 -0.326 . . . . 0.40000000000000002 110.959 179.889 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 3.8 m -71.45 -33.85 69.73 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.352 -0.386 . . . . 0.81000000000000005 111.397 -179.766 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.438 ' CG ' ' H ' ' A' ' 64' ' ' ASN . 17.5 mm-40 -62.51 -51.28 68.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.871 0.367 . . . . 1.3600000000000001 110.287 179.393 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.508 ' CD1' HD21 ' A' ' 32' ' ' LEU . 32.8 t80 -67.65 -47.43 69.56 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.021 -0.536 . . . . 0.51000000000000001 110.649 179.534 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.537 ' HB2' ' O ' ' A' ' 65' ' ' PHE . 0.1 OUTLIER -57.27 -38.9 74.62 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-O 120.959 0.409 . . . . 0.75 110.059 179.599 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -57.51 -50.95 60.87 Favored Glycine 0 CA--C 1.507 -0.466 0 N-CA-C 111.119 -0.792 . . . . 0.40999999999999998 111.119 179.462 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.706 HG23 ' HE2' ' A' ' 74' ' ' LYS . 70.6 mt -59.5 -50.12 81.09 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.656 0 CA-C-O 121.032 0.444 . . . . 0.51000000000000001 110.365 178.466 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 15.2 mtp -49.68 -28.94 6.58 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.613 -0.721 . . . . 1.01 110.51 179.524 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -71.87 -45.28 61.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.328 -0.396 . . . . 0.69999999999999996 110.231 179.291 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.706 ' HE2' HG23 ' A' ' 71' ' ' ILE . 49.0 pttt -70.56 -28.87 65.23 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.125 -0.489 . . . . 1.3799999999999999 111.041 179.823 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 20.3 tp60 -80.58 -55.42 4.87 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.001 -0.545 . . . . 1.98 111.623 -179.784 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 68.3 mtp -63.07 -22.96 67.21 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 116.169 -0.469 . . . . 1.2 111.793 -179.275 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 43.3 mtt180 -60.4 -39.09 86.12 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.648 0.261 . . . . 4.6900000000000004 110.705 179.432 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 58.6 -82.71 0.02 OUTLIER 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.085 -0.507 . . . . 4.0099999999999998 110.791 -179.852 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.424 HG22 ' OD2' ' A' ' 80' ' ' ASP . 5.0 m -91.74 -64.49 1.11 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.251 -0.432 . . . . 5.2800000000000002 110.238 179.347 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ASP . . . . . 0.424 ' OD2' HG22 ' A' ' 79' ' ' THR . 1.1 p30 177.55 -12.3 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.781 -0.645 . . . . 5.5999999999999996 111.239 179.683 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.64 ' O ' ' HG2' ' A' ' 85' ' ' MET . 58.8 m 62.67 76.82 0.35 Allowed 'General case' 0 CA--C 1.529 0.137 0 N-CA-C 109.925 -0.398 . . . . 7.29 109.925 -179.104 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -58.12 -16.03 11.72 Favored 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 113.39 0.885 . . . . 9.7400000000000002 113.39 -178.169 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -64.26 -56.5 14.17 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.001 0.429 . . . . 12.109999999999999 111.683 -179.286 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -68.19 -14.08 62.71 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.045 -0.525 . . . . 10.869999999999999 110.919 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' MET . . . . . 0.64 ' HG2' ' O ' ' A' ' 81' ' ' THR . 4.5 mmm -80.35 -38.77 29.83 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.119 -0.491 . . . . 11.09 110.42 -179.441 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 10.4 ttm180 -67.73 -42.55 81.72 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.975 -0.557 . . . . 15.52 109.595 179.303 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.503 ' O ' HG12 ' A' ' 91' ' ' ILE . 36.9 tt0 -59.55 -48.77 80.34 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.879 -0.6 . . . . 14.85 109.811 179.011 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.56 -29.87 70.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.938 -0.574 . . . . 14.109999999999999 110.778 179.583 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 46.7 t80 -59.28 -52.04 67.37 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 109.846 -0.427 . . . . 15.73 109.846 179.492 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -59.06 -37.77 77.82 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.797 -0.638 . . . . 17.66 110.021 178.77 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.503 HG12 ' O ' ' A' ' 87' ' ' GLU . 40.0 mm -59.92 -40.98 84.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.431 -0.804 . . . . 18.149999999999999 110.83 179.469 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.528 ' O ' ' HD3' ' A' ' 94' ' ' ARG . 7.0 m-85 -74.06 -56.64 4.68 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.311 -0.404 . . . . 18.34 111.332 -179.636 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.486 ' HA ' ' CZ ' ' A' ' 94' ' ' ARG . 43.2 t0 -49.96 124.97 10.97 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 120.947 0.403 . . . . 19.289999999999999 110.566 -179.739 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.67 ' CZ ' ' HB3' ' A' ' 104' ' ' GLU . 0.0 OUTLIER -76.78 -31.97 57.38 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.904 -0.589 . . . . 22.25 111.662 -178.694 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -113.76 177.97 4.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.978 0.418 . . . . 23.34 111.368 -179.036 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -88.38 3.9 85.32 Favored Glycine 0 N--CA 1.449 -0.472 0 N-CA-C 110.919 -0.872 . . . . 22.0 110.919 178.632 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 22.3 p-10 -56.02 -39.18 71.55 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.227 -0.487 . . . . 22.280000000000001 111.167 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 89.48 21.57 40.3 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.846 -0.693 . . . . 19.93 111.922 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' PHE . . . . . 0.501 ' HA ' ' O ' ' A' ' 136' ' ' ILE . 97.5 m-85 -136.93 143.83 43.12 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.858 0.361 . . . . 20.300000000000001 111.328 -179.709 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.538 ' HB ' ' HB ' ' A' ' 136' ' ' ILE . 59.6 mt -114.35 132.3 63.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-N 115.904 -0.589 . . . . 19.370000000000001 110.832 179.629 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 26.7 p -114.42 156.18 44.86 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.037 -0.529 . . . . 22.489999999999998 110.693 -179.705 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_exo -42.78 -48.71 7.18 Favored 'Trans proline' 0 C--N 1.348 0.538 0 C-N-CA 122.686 2.257 . . . . 23.0 112.965 -179.78 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.81 -51.29 68.86 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.093 0.473 . . . . 24.559999999999999 111.068 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.67 ' HB3' ' CZ ' ' A' ' 94' ' ' ARG . 38.6 mt-10 -59.15 -41.34 88.1 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.716 -0.674 . . . . 22.23 111.04 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.708 HD23 ' HB ' ' A' ' 121' ' ' ILE . 47.7 tp -54.38 -46.72 73.13 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.67 -0.695 . . . . 20.359999999999999 111.037 -179.476 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 5.4 ttt180 -60.47 -48.16 82.98 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.104 -0.498 . . . . 27.190000000000001 110.854 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 72.5 t80 -52.19 -35.02 47.92 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.223 -0.444 . . . . 25.359999999999999 111.513 -179.457 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.631 HG21 HH11 ' A' ' 94' ' ' ARG . 30.2 t -77.18 -54.12 13.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 N-CA-C 111.748 0.277 . . . . 21.059999999999999 111.748 -179.611 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -49.54 -39.63 35.27 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.834 0.349 . . . . 20.93 110.955 -179.715 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 84.7 mt -66.84 -28.68 43.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.17 -0.468 . . . . 25.129999999999999 110.936 179.757 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 89.1 m-20 -72.84 -46.18 54.37 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.235 -0.439 . . . . 23.32 110.336 179.639 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 9.6 mp -60.32 -45.11 94.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.626 -0.715 . . . . 21.07 110.976 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 128.95 11.81 2.79 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.8 -0.714 . . . . 23.050000000000001 112.474 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -106.51 94.64 5.24 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.789 0.328 . . . . 22.59 111.07 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -60.99 126.2 26.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.159 -0.473 . . . . 27.960000000000001 110.704 179.588 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' VAL . . . . . 0.425 HG12 ' OE1' ' A' ' 120' ' ' GLU . 3.0 m -144.41 150.71 16.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.231 -0.44 . . . . 24.75 111.444 -179.792 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 68.3 p -94.5 149.36 21.32 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.826 -0.625 . . . . 27.239999999999998 110.218 179.231 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -54.78 -17.24 3.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.155 -0.475 . . . . 26.629999999999999 111.601 -179.597 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -77.8 -55.18 5.54 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.479 -0.328 . . . . 29.140000000000001 111.511 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.425 ' OE1' HG12 ' A' ' 116' ' ' VAL . 14.6 pt-20 -63.36 -38.84 92.71 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 111.996 0.369 . . . . 24.190000000000001 111.996 -179.151 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.708 ' HB ' HD23 ' A' ' 105' ' ' LEU . 42.0 pt -71.68 -41.61 71.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 N-CA-C 111.787 0.292 . . . . 22.329999999999998 111.787 -179.408 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.513 ' N ' HG13 ' A' ' 121' ' ' ILE . 19.7 t70 -59.89 -39.76 86.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.741 0.305 . . . . 24.289999999999999 110.702 179.873 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -65.06 -43.9 90.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.11 -0.496 . . . . 24.739999999999998 110.605 179.682 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 52.6 ttp -56.76 -37.78 71.54 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.114 -0.494 . . . . 19.710000000000001 110.585 179.459 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.61 HG23 HD11 ' A' ' 136' ' ' ILE . 72.3 mt -65.85 -43.23 93.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.99 -0.55 . . . . 19.949999999999999 110.448 179.595 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 75.0 ttt180 -60.82 -30.66 70.22 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.701 -0.682 . . . . 24.949999999999999 111.115 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -75.88 -27.62 57.81 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.132 -0.485 . . . . 18.690000000000001 111.362 -179.701 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.581 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -101.06 -8.73 22.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.355 -0.384 . . . . 16.469999999999999 111.181 -179.805 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 30.2 t0 -100.7 87.48 3.35 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.179 -0.464 . . . . 20.399999999999999 110.825 -179.785 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 71.7 m-85 -67.4 -49.81 62.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.895 -0.593 . . . . 21.43 111.147 -179.633 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -57.39 -29.12 63.81 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.239 -0.437 . . . . 23.370000000000001 110.776 179.89 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 67.17 63.62 3.7 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.973 -0.632 . . . . 24.32 112.909 179.419 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -122.95 7.26 9.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.851 0.358 . . . . 23.879999999999999 110.586 179.533 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 69.07 18.83 73.27 Favored Glycine 0 C--N 1.33 0.246 0 C-N-CA 120.99 -0.624 . . . . 22.670000000000002 112.629 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 85.6 mmm -134.57 153.66 51.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.701 0.286 . . . . 22.91 110.545 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.663 HG23 ' HB2' ' A' ' 140' ' ' GLU . 43.4 mm -114.79 141.81 29.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 121.091 0.472 . . . . 18.41 111.563 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 137' ' ' ASN . . . . . 0.435 ' O ' ' N ' ' A' ' 139' ' ' GLU . 37.1 t30 -114.89 156.42 25.02 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.258 -0.883 . . . . 16.82 108.801 178.345 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.694 ' O ' HG23 ' A' ' 142' ' ' VAL . 6.8 t80 -40.08 -24.8 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 120.706 0.288 . . . . 14.65 111.487 179.698 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.435 ' N ' ' O ' ' A' ' 137' ' ' ASN . 14.3 mm-40 -80.28 -55.78 4.67 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.876 0.37 . . . . 14.82 111.01 -179.353 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.663 ' HB2' HG23 ' A' ' 136' ' ' ILE . 35.5 mt-10 -57.74 -31.17 66.19 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.005 -0.543 . . . . 17.460000000000001 110.401 179.742 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.554 ' CE2' HD13 ' A' ' 145' ' ' ILE . 90.0 t80 -69.58 -56.04 8.44 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.599 -0.728 . . . . 12.93 110.708 -179.922 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.694 HG23 ' O ' ' A' ' 138' ' ' TYR . 52.0 t -46.58 -38.22 3.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.002 -0.545 . . . . 10.699999999999999 111.958 179.626 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 143' ' ' TRP . . . . . 0.451 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 91.0 t90 -71.08 -55.87 7.32 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.469 0.544 . . . . 13.66 112.469 -178.809 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 144' ' ' MET . . . . . 0.581 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 18.4 ptt? -62.47 -25.0 67.76 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 112.971 0.73 . . . . 14.5 112.971 -177.75 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 145' ' ' ILE . . . . . 0.587 HD11 ' HB3' ' A' ' 85' ' ' MET . 45.1 pt -80.93 -40.47 18.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 N-CA-C 112.168 0.433 . . . . 11.25 112.168 -179.83 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 146' ' ' SER . . . . . 0.538 ' N ' HG13 ' A' ' 145' ' ' ILE . 88.1 p -61.31 -14.82 29.72 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-O 121.494 0.664 . . . . 8.5399999999999991 109.557 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 147' ' ' GLN . . . . . 0.451 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 2.7 mm-40 -113.6 -11.51 12.99 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 114.899 -1.046 . . . . 11.869999999999999 109.897 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 148' ' ' LYS . . . . . 0.579 ' HB2' ' HA ' ' A' ' 145' ' ' ILE . 28.0 ttpp . . . . . 0 C--O 1.25 1.085 0 CA-C-O 118.247 -0.882 . . . . 13.68 110.92 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 149' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 151' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 53.4 m . . . . . 0 N--CA 1.486 1.325 0 CA-C-O 120.919 0.39 . . . . 4.8899999999999997 110.996 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -142.74 142.02 31.87 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.121 -0.49 . . . . 3.2599999999999998 110.87 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.598 HD13 ' SG ' ' A' ' 69' ' ' CYS . 33.2 mt -70.75 82.78 0.63 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.325 -0.398 . . . . 1.27 110.614 179.738 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 56.5 p -70.99 -165.4 0.12 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.132 -0.486 . . . . 1.1200000000000001 111.194 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -75.48 -42.79 52.16 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.995 0.426 . . . . 2.2000000000000002 110.472 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -73.06 -35.13 66.63 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.834 -0.621 . . . . 1.3500000000000001 110.536 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 86.2 mm-40 -70.85 -47.21 60.59 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.922 -0.581 . . . . 2.2200000000000002 110.817 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.517 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 35.4 mt -58.46 -41.26 81.18 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 116.271 -0.422 . . . . 0.54000000000000004 110.912 179.828 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -76.06 -22.05 56.08 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.438 -0.347 . . . . 0.5 111.043 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -68.47 -57.1 6.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.199 -0.455 . . . . 2.27 111.736 -179.425 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.517 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 11.5 p90 -76.76 -25.29 53.27 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.678 -0.409 . . . . 0.37 110.489 -179.721 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.404 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 18.9 tptm -63.33 -34.01 76.77 Favored 'General case' 0 CA--C 1.519 -0.242 0 N-CA-C 108.87 -0.789 . . . . 1.23 108.87 178.227 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.608 ' O ' HG22 ' A' ' 17' ' ' VAL . 14.0 t70 -69.74 -53.02 20.39 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 109.013 -0.736 . . . . 0.44 109.013 178.418 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.05 -15.23 21.26 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.821 -0.627 . . . . 0.28999999999999998 110.508 178.887 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.404 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 66.1 t80 -80.69 -44.76 18.24 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.746 -0.661 . . . . 0.47999999999999998 111.001 -179.729 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.608 HG22 ' O ' ' A' ' 14' ' ' ASP . 25.7 m -69.33 -21.14 24.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.983 0.42 . . . . 1.1100000000000001 110.675 -179.664 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.55 ' HG3' ' O ' ' A' ' 14' ' ' ASP . 83.8 mt-30 -63.69 -25.29 68.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.83 -0.623 . . . . 1.6000000000000001 111.3 179.814 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -104.9 25.06 10.93 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.57 -0.286 . . . . 0.64000000000000001 111.617 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -116.74 80.64 1.5 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.059 0.457 . . . . 0.44 110.723 179.336 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt -93.83 5.14 52.63 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.85 -0.614 . . . . 2.1000000000000001 111.176 -179.658 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -103.89 -1.26 27.99 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.316 -0.402 . . . . 1.8 111.35 -179.371 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 63.48 10.39 36.03 Favored Glycine 0 CA--C 1.517 0.201 0 C-N-CA 120.921 -0.657 . . . . 0.46000000000000002 113.144 179.578 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 30.4 p -90.15 10.85 22.84 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.699 0.285 . . . . 0.40000000000000002 111.122 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 56.26 18.13 20.12 Favored Glycine 0 C--N 1.332 0.306 0 C-N-CA 120.766 -0.73 . . . . 0.33000000000000002 111.912 -179.653 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.531 ' C ' HE22 ' A' ' 62' ' ' GLN . 32.1 mtpt -129.58 155.95 44.97 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.594 -0.303 . . . . 1.1000000000000001 110.819 -179.339 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.492 ' N ' HE22 ' A' ' 62' ' ' GLN . 35.7 pt -120.87 129.96 75.13 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 120.934 0.397 . . . . 0.5 111.359 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -47.78 137.46 9.6 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.144 -0.48 . . . . 0.29999999999999999 111.336 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.494 HG23 ' HD2' ' A' ' 30' ' ' ARG . 5.5 t -67.31 -0.27 3.41 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.926 -0.579 . . . . 1.03 110.873 179.804 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.494 ' HD2' HG23 ' A' ' 29' ' ' THR . 3.6 mmm180 -94.28 -17.8 22.27 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.98 -0.554 . . . . 3.0800000000000001 110.28 179.839 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -102.07 -3.0 28.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.56 -0.745 . . . . 2.2599999999999998 110.503 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.445 HD12 HD11 ' A' ' 51' ' ' LEU . 3.2 tm? -58.08 -50.66 72.68 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.009 -0.542 . . . . 1.3700000000000001 110.311 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -54.34 -38.56 62.5 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.49 -0.862 . . . . 0.32000000000000001 111.524 179.301 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 92.8 m -65.95 -34.53 78.33 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.006 0.432 . . . . 0.31 110.429 179.145 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 48.3 tp -68.3 -36.68 79.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.789 -0.641 . . . . 1.24 110.909 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.452 ' HG3' ' HG3' ' A' ' 43' ' ' PRO . 40.0 mmm -65.46 -40.19 92.91 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.88 -0.415 . . . . 1.1000000000000001 109.88 179.549 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 74.9 mtp180 -67.9 -30.39 69.71 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.266 -0.642 . . . . 2.6899999999999999 109.266 178.705 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 96.2 m -65.97 -21.29 66.41 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 115.286 -0.87 . . . . 1.0600000000000001 110.415 179.245 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 10.3 mp -114.49 156.96 23.62 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.493 -0.776 . . . . 1.26 110.413 179.757 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -53.16 -8.12 0.64 Allowed Glycine 0 CA--C 1.52 0.402 0 C-N-CA 121.109 -0.567 . . . . 0.68999999999999995 113.339 -179.789 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 82.9 mm-40 -60.43 176.14 0.38 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.089 0.471 . . . . 1.97 111.343 179.752 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 16.8 p-10 -169.81 72.27 0.66 Allowed Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 115.782 -0.645 . . . . 2.6600000000000001 110.85 179.8 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.452 ' HG3' ' HG3' ' A' ' 36' ' ' MET . 56.9 Cg_endo -68.84 142.29 51.68 Favored 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.595 2.196 . . . . 0.51000000000000001 112.316 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 26.9 m -64.22 148.46 50.05 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.243 -0.435 . . . . 0.72999999999999998 110.168 179.346 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.479 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 6.7 tp10 -48.15 -55.69 9.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.595 0.236 . . . . 2.7000000000000002 110.999 -179.356 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -51.13 -52.13 46.9 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.144 -0.48 . . . . 0.46000000000000002 111.42 -179.837 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -50.01 -50.45 47.29 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.375 -0.375 . . . . 2.23 110.702 179.858 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 12.8 mt -57.07 -45.48 83.26 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.229 -0.441 . . . . 1.3600000000000001 110.676 179.751 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.479 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 30.4 mm-40 -60.73 -32.31 71.59 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.811 0.339 . . . . 1.22 110.911 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -73.71 -55.52 6.16 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.204 -0.453 . . . . 0.62 112.185 -179.086 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.445 HD11 HD12 ' A' ' 32' ' ' LEU . 1.8 pp -66.59 -36.72 83.3 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 111.613 0.227 . . . . 0.39000000000000001 111.613 -179.13 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 78.9 mt -64.81 -43.25 96.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.702 0.287 . . . . 0.5 110.483 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.54 -28.84 68.14 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.2 -0.454 . . . . 0.58999999999999997 110.372 179.328 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -66.05 -51.36 58.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.93 -0.577 . . . . 2.54 110.228 179.452 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -78.51 -14.72 59.22 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.055 -0.52 . . . . 0.53000000000000003 111.429 179.708 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.477 ' HA ' HG21 ' A' ' 29' ' ' THR . 40.7 tt0 -59.97 -44.09 94.68 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.504 -0.316 . . . . 1.95 111.051 -179.807 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 79.2 m-20 -122.45 57.64 1.08 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.306 -0.406 . . . . 2.48 110.984 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -149.26 -30.53 0.24 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.157 -0.474 . . . . 2.48 110.782 179.821 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -128.7 25.69 5.65 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.139 -0.482 . . . . 2.0499999999999998 110.784 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 62.69 11.37 4.8 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.96 -0.564 . . . . 1.47 111.667 179.846 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 104.18 37.95 2.78 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.687 -0.768 . . . . 0.42999999999999999 112.647 179.608 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.531 HE22 ' C ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -140.56 154.31 46.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.139 0.495 . . . . 0.38 111.438 179.921 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 81.3 mt -122.02 147.76 45.67 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.742 -0.663 . . . . 1.4299999999999999 110.146 179.607 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -112.9 156.76 22.4 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.61 -0.268 . . . . 1.1899999999999999 110.507 -179.645 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.444 ' O ' ' HB2' ' A' ' 69' ' ' CYS . 78.3 t80 -43.69 -42.6 5.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.206 -0.452 . . . . 0.40000000000000002 111.287 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.27 -34.11 74.27 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 111.874 0.324 . . . . 0.81000000000000005 111.874 -179.713 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -63.09 -54.02 44.56 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.097 0.475 . . . . 1.3600000000000001 110.239 179.501 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.48 ' HE2' ' HB2' ' A' ' 12' ' ' PHE . 28.7 t80 -64.14 -45.01 90.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.752 -0.658 . . . . 0.51000000000000001 110.752 179.676 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.598 ' SG ' HD13 ' A' ' 4' ' ' LEU . 3.9 t -58.15 -44.19 87.74 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.079 -0.509 . . . . 0.75 110.156 179.62 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -53.26 -48.16 60.02 Favored Glycine 0 N--CA 1.45 -0.432 0 CA-C-N 115.622 -0.717 . . . . 0.40999999999999998 111.674 179.536 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.494 HG23 ' CE ' ' A' ' 74' ' ' LYS . 14.4 mt -62.75 -44.7 99.7 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.363 0 CA-C-O 121.091 0.472 . . . . 0.51000000000000001 110.426 179.257 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -53.33 -27.12 21.66 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.555 -0.748 . . . . 1.01 110.035 179.472 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -74.48 -47.29 34.13 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.907 -0.588 . . . . 0.69999999999999996 111.034 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.494 ' CE ' HG23 ' A' ' 71' ' ' ILE . 63.1 pttt -68.74 -27.5 65.98 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 116.551 -0.295 . . . . 1.3799999999999999 111.247 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' GLN . . . . . 0.443 ' NE2' ' HB3' ' A' ' 43' ' ' PRO . 81.3 mt-30 -81.24 -50.41 9.59 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.796 0.332 . . . . 1.98 111.497 179.061 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 33.1 mtt -58.66 -40.13 82.61 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 112.373 0.509 . . . . 1.2 112.373 -178.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.435 ' NE ' ' HA ' ' A' ' 74' ' ' LYS . 10.0 ptp180 -53.6 -43.52 68.69 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-O 121.024 0.44 . . . . 4.6900000000000004 109.939 -179.346 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.422 ' O ' ' C ' ' A' ' 79' ' ' THR . 7.1 pt-20 -89.52 -117.84 0.06 Allowed 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 108.912 -0.773 . . . . 4.0099999999999998 108.912 178.067 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.422 ' C ' ' O ' ' A' ' 78' ' ' GLU . 19.6 m 34.23 49.31 0.31 Allowed 'General case' 0 CA--C 1.531 0.221 0 CA-C-O 121.26 0.552 . . . . 5.2800000000000002 111.099 179.701 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -163.26 -2.09 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.093 -0.503 . . . . 5.5999999999999996 111.305 -179.6 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.519 ' O ' ' HG2' ' A' ' 85' ' ' MET . 13.0 t -44.91 126.63 5.93 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.213 -0.449 . . . . 7.29 111.163 -179.76 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.438 ' HA ' ' HG2' ' A' ' 85' ' ' MET . 41.9 mt-10 -75.61 -14.4 60.37 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.21 -0.45 . . . . 9.7400000000000002 111.495 -179.273 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -60.78 -55.29 34.92 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.384 -0.371 . . . . 12.109999999999999 111.614 -179.716 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -65.74 -20.52 66.3 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.303 -0.408 . . . . 10.869999999999999 111.23 -179.503 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' MET . . . . . 0.539 ' HB3' HD11 ' A' ' 145' ' ' ILE . 1.5 mmm -80.46 -36.01 34.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.991 0.424 . . . . 11.09 110.78 -179.353 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 29.4 ttt180 -67.96 -42.44 80.88 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.821 -0.627 . . . . 15.52 110.487 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -68.06 -37.93 81.86 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.078 -0.51 . . . . 14.85 110.002 179.161 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.16 -31.15 67.33 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.972 -0.558 . . . . 14.109999999999999 110.854 179.499 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -67.71 -40.45 84.27 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.118 -0.492 . . . . 15.73 110.456 179.766 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -66.5 -39.91 88.97 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.914 -0.585 . . . . 17.66 110.559 179.493 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 96.9 mt -64.47 -47.93 87.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.845 -0.616 . . . . 18.149999999999999 110.795 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.482 ' HD2' HG11 ' A' ' 108' ' ' VAL . 4.4 m-85 -63.85 -57.14 10.77 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.114 -0.494 . . . . 18.34 110.695 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.601 ' HA ' HH21 ' A' ' 94' ' ' ARG . 27.4 t0 -53.51 127.3 24.67 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 120.787 0.327 . . . . 19.289999999999999 110.228 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.731 ' H ' ' HE ' ' A' ' 94' ' ' ARG . 0.0 OUTLIER -98.19 -24.18 15.38 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.28 -0.418 . . . . 22.25 111.788 -178.665 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -101.84 -179.93 4.15 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.969 0.414 . . . . 23.34 111.026 -179.794 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.26 3.3 56.67 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.886 -0.673 . . . . 22.0 112.024 179.628 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -71.63 -36.14 70.66 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.869 0.366 . . . . 22.280000000000001 111.24 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 90.38 27.15 21.31 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.737 -0.744 . . . . 19.93 112.494 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' PHE . . . . . 0.422 ' HA ' ' O ' ' A' ' 136' ' ' ILE . 86.3 m-85 -132.32 142.81 49.49 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.569 0.223 . . . . 20.300000000000001 110.764 179.839 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.579 ' HB ' ' HB ' ' A' ' 136' ' ' ILE . 41.5 mt -114.47 126.28 71.97 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-O 120.923 0.392 . . . . 19.370000000000001 111.268 179.893 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 26.8 p -116.05 156.12 47.19 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 115.94 -0.573 . . . . 22.489999999999998 110.555 179.794 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_exo -41.63 -36.33 3.1 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 122.448 2.099 . . . . 23.0 112.464 -179.63 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.416 ' O ' ' HG3' ' A' ' 106' ' ' ARG . . . -64.89 -49.98 68.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.08 0.467 . . . . 24.559999999999999 110.591 179.554 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.582 ' HB3' ' CZ ' ' A' ' 94' ' ' ARG . 38.1 mt-10 -63.24 -50.25 70.94 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.935 -0.575 . . . . 22.23 110.677 179.337 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.626 HD23 ' HB ' ' A' ' 121' ' ' ILE . 48.0 tp -51.55 -35.43 40.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.642 -0.708 . . . . 20.359999999999999 111.799 -179.081 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.448 ' HG3' ' N ' ' A' ' 107' ' ' PHE . 0.1 OUTLIER -76.28 -32.15 58.65 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.91 0.386 . . . . 27.190000000000001 110.551 -179.677 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 107' ' ' PHE . . . . . 0.448 ' N ' ' HG3' ' A' ' 106' ' ' ARG . 85.5 t80 -72.62 -34.75 67.57 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.901 -0.591 . . . . 25.359999999999999 111.732 -179.883 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.487 HG13 ' N ' ' A' ' 109' ' ' MET . 7.3 p -77.86 -47.0 26.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 N-CA-C 112.011 0.374 . . . . 21.059999999999999 112.011 -179.203 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.487 ' N ' HG13 ' A' ' 108' ' ' VAL . 0.2 OUTLIER -51.6 -36.99 47.89 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.724 0.297 . . . . 20.93 111.533 -179.321 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.428 HG13 ' O ' ' A' ' 106' ' ' ARG . 75.7 mt -69.47 -26.8 32.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.349 -0.387 . . . . 25.129999999999999 111.082 -179.827 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -73.29 -41.14 63.94 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.195 -0.457 . . . . 23.32 110.619 179.635 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 9.2 mp -63.5 -44.37 94.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.914 -0.585 . . . . 21.07 110.945 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 133.6 1.88 3.72 Favored Glycine 0 C--N 1.331 0.286 0 C-N-CA 120.688 -0.768 . . . . 23.050000000000001 112.753 179.562 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -103.16 115.38 30.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.784 0.326 . . . . 22.59 111.291 -179.637 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -76.09 128.52 35.15 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.196 -0.456 . . . . 27.960000000000001 110.256 179.434 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 116' ' ' VAL . . . . . 0.466 ' HB ' HG23 ' A' ' 121' ' ' ILE . 3.1 m -142.36 155.6 18.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 121.18 0.514 . . . . 24.75 111.802 -179.474 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 117' ' ' THR . . . . . 0.456 ' O ' HG12 ' A' ' 121' ' ' ILE . 43.0 p -103.44 147.49 27.07 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.472 -0.785 . . . . 27.239999999999998 110.208 179.646 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -51.95 -19.69 1.94 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.241 -0.436 . . . . 26.629999999999999 111.519 -179.635 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -77.9 -54.92 5.76 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.523 -0.308 . . . . 29.140000000000001 111.704 -179.535 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.431 ' OE1' HG12 ' A' ' 116' ' ' VAL . 14.6 pt-20 -63.17 -39.57 95.03 Favored 'General case' 0 C--N 1.332 -0.196 0 N-CA-C 112.034 0.383 . . . . 24.190000000000001 112.034 -179.182 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.626 ' HB ' HD23 ' A' ' 105' ' ' LEU . 15.2 pt -71.63 -40.28 70.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 C-N-CA 121.022 -0.271 . . . . 22.329999999999998 111.63 -179.485 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.532 ' N ' HG13 ' A' ' 121' ' ' ILE . 15.4 t70 -57.79 -43.13 85.43 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.741 0.305 . . . . 24.289999999999999 110.538 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -63.0 -43.7 98.07 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.07 -0.514 . . . . 24.739999999999998 110.171 179.415 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.455 ' HE3' HD21 ' A' ' 105' ' ' LEU . 56.0 ttp -57.15 -33.89 67.87 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.002 -0.545 . . . . 19.710000000000001 110.362 179.148 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.653 HG23 HD11 ' A' ' 136' ' ' ILE . 97.3 mt -67.36 -43.72 87.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.815 -0.629 . . . . 19.949999999999999 110.533 179.638 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 32.3 ttm180 -60.3 -32.6 71.37 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.937 -0.574 . . . . 24.949999999999999 110.801 179.593 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -63.67 -29.73 70.93 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.13 -0.487 . . . . 18.690000000000001 111.278 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.686 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -104.28 -15.37 15.49 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.3 -0.409 . . . . 16.469999999999999 111.329 -179.86 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -93.98 103.53 15.61 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.108 -0.496 . . . . 20.399999999999999 110.771 -179.666 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -96.52 -31.09 12.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.883 -0.599 . . . . 21.43 111.32 -179.427 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -70.69 -15.85 62.75 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.389 -0.369 . . . . 23.370000000000001 110.74 179.932 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 58.88 85.29 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 121.024 -0.607 . . . . 24.32 112.946 179.557 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -152.21 1.98 0.34 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.684 0.278 . . . . 23.879999999999999 111.073 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 69.28 20.85 75.5 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.81 -0.709 . . . . 22.670000000000002 112.753 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 82.1 mmm -135.12 155.04 51.4 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.591 0.234 . . . . 22.91 110.523 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.674 HG23 ' HB2' ' A' ' 140' ' ' GLU . 46.4 mm -116.79 143.81 26.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 121.093 0.473 . . . . 18.41 111.491 179.892 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 137' ' ' ASN . . . . . 0.404 ' C ' ' N ' ' A' ' 139' ' ' GLU . 30.2 m-20 -114.41 156.67 24.07 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.267 -0.878 . . . . 16.82 108.711 178.465 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.686 ' O ' HG23 ' A' ' 142' ' ' VAL . 16.9 t80 -42.65 -23.47 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.673 0.273 . . . . 14.65 111.151 179.823 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.404 ' N ' ' C ' ' A' ' 137' ' ' ASN . 12.0 mm-40 -80.52 -56.03 4.46 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 120.904 0.383 . . . . 14.82 110.831 -179.799 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.674 ' HB2' HG23 ' A' ' 136' ' ' ILE . 29.6 mt-10 -57.96 -27.26 63.26 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.139 -0.482 . . . . 17.460000000000001 110.121 179.616 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.585 ' HA ' ' HE2' ' A' ' 144' ' ' MET . 90.3 t80 -70.4 -55.71 8.41 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.746 -0.661 . . . . 12.93 110.035 179.435 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.686 HG23 ' O ' ' A' ' 138' ' ' TYR . 55.1 t -46.03 -36.91 2.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 115.781 -0.645 . . . . 10.699999999999999 111.507 178.964 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 79.5 t90 -71.81 -55.5 7.47 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 112.563 0.579 . . . . 13.66 112.563 -178.809 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 144' ' ' MET . . . . . 0.686 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 20.8 ptt? -64.28 -22.63 67.02 Favored 'General case' 0 N--CA 1.463 0.203 0 N-CA-C 112.921 0.711 . . . . 14.5 112.921 -177.637 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 145' ' ' ILE . . . . . 0.694 ' HA ' ' HB2' ' A' ' 148' ' ' LYS . 28.3 pt -80.55 -42.58 21.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 C-N-CA 120.702 -0.399 . . . . 11.25 111.416 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 146' ' ' SER . . . . . 0.469 ' N ' HG13 ' A' ' 145' ' ' ILE . 82.3 p -65.04 -14.15 59.7 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.519 0.676 . . . . 8.5399999999999991 109.421 179.235 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 -125.94 19.5 7.76 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 114.839 -1.073 . . . . 11.869999999999999 110.066 -179.589 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 148' ' ' LYS . . . . . 0.694 ' HB2' ' HA ' ' A' ' 145' ' ' ILE . 24.1 ttpp . . . . . 0 C--O 1.25 1.107 0 CA-C-O 118.296 -0.859 . . . . 13.68 110.898 -179.618 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 149' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 151' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 57.9 m . . . . . 0 N--CA 1.485 1.313 0 CA-C-O 120.839 0.352 . . . . 4.8899999999999997 110.892 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -163.81 118.69 1.57 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 3.2599999999999998 111.034 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 51.3 mt -63.49 118.02 7.55 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.031 -0.531 . . . . 1.27 111.105 -179.678 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -98.07 165.16 12.03 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.205 -0.452 . . . . 1.1200000000000001 110.838 179.822 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -51.59 -39.05 57.21 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.797 0.332 . . . . 2.2000000000000002 111.51 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.444 ' HG3' ' N ' ' A' ' 8' ' ' GLN . 11.6 pt-20 -72.08 -46.7 55.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.278 -0.419 . . . . 1.3500000000000001 111.075 -179.406 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.444 ' N ' ' HG3' ' A' ' 7' ' ' GLU . 96.7 mt-30 -61.04 -42.55 98.69 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.885 -0.598 . . . . 2.2200000000000002 110.945 -179.812 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.483 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 77.1 mt -59.29 -51.94 66.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.951 -0.568 . . . . 0.54000000000000004 110.893 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.0 -26.8 67.86 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.12 -0.491 . . . . 0.5 111.654 -179.718 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -69.45 -56.72 6.61 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 112.155 0.428 . . . . 2.27 112.155 -178.834 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.483 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 8.5 p90 -77.89 -25.03 48.29 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 120.466 -0.494 . . . . 0.37 110.908 -179.544 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.457 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 41.6 tptt -64.45 -34.12 77.47 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 108.969 -0.752 . . . . 1.23 108.969 178.707 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -70.12 -48.95 55.35 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 108.697 -0.853 . . . . 0.44 108.697 177.689 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.84 -14.06 41.26 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.268 -0.878 . . . . 0.28999999999999998 110.355 178.697 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.457 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 31.2 t80 -80.04 -54.04 6.16 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.809 -0.632 . . . . 0.47999999999999998 111.0 -179.501 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 15.6 m -62.25 -22.73 30.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 121.105 0.479 . . . . 1.1100000000000001 110.334 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 75.6 mm-40 -61.09 -32.41 72.07 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.624 -0.716 . . . . 1.6000000000000001 111.543 179.597 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 99.7 m-85 -101.97 33.89 2.88 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.741 0.305 . . . . 0.64000000000000001 111.631 -179.817 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -125.64 75.5 1.49 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.042 0.449 . . . . 0.44 110.425 179.32 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 41.1 tptt -87.01 -33.85 19.43 Favored 'General case' 0 N--CA 1.436 -1.129 0 CA-C-N 115.824 -0.625 . . . . 2.1000000000000001 110.925 -179.783 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -63.24 -15.68 57.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.102 -0.499 . . . . 1.8 111.384 -179.52 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.48 10.7 84.6 Favored Glycine 0 C--N 1.331 0.264 0 C-N-CA 120.832 -0.699 . . . . 0.46000000000000002 112.833 179.553 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 20.3 p -86.9 15.35 5.98 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.637 0.256 . . . . 0.40000000000000002 111.213 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 53.35 26.39 29.57 Favored Glycine 0 C--N 1.333 0.388 0 C-N-CA 120.851 -0.69 . . . . 0.33000000000000002 112.234 -179.792 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.474 ' C ' HE22 ' A' ' 62' ' ' GLN . 31.5 mtmm -135.0 156.57 48.82 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.822 0.344 . . . . 1.1000000000000001 111.054 -179.646 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.616 HG13 ' HB2' ' A' ' 63' ' ' LEU . 23.8 pt -114.11 126.02 71.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 121.115 0.483 . . . . 0.5 111.468 -179.649 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -54.49 138.17 41.07 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.861 -0.609 . . . . 0.29999999999999999 111.213 179.707 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 9.4 t -68.31 -9.44 47.75 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.061 -0.518 . . . . 1.03 111.382 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.421 ' HD3' ' N ' ' A' ' 30' ' ' ARG . 0.0 OUTLIER -87.13 -14.14 42.15 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.256 -0.429 . . . . 3.0800000000000001 110.681 179.902 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -108.19 -0.28 21.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.093 -0.503 . . . . 2.2599999999999998 110.632 179.768 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.447 HD22 ' HA ' ' A' ' 32' ' ' LEU . 1.0 OUTLIER -60.08 -46.08 90.77 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.072 -0.513 . . . . 1.3700000000000001 109.972 179.665 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.589 ' HA2' HD11 ' A' ' 48' ' ' LEU . . . -56.89 -36.8 74.8 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.507 -0.854 . . . . 0.32000000000000001 111.277 179.051 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 87.6 m -70.54 -32.5 69.98 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.007 0.432 . . . . 0.31 110.027 179.047 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.46 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 1.2 tt -65.48 -35.47 80.98 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.679 -0.691 . . . . 1.24 110.165 179.68 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.571 ' HG3' ' HG3' ' A' ' 43' ' ' PRO . 21.7 mmt -69.52 -42.17 75.03 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.215 -0.448 . . . . 1.1000000000000001 110.482 179.301 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 62.7 mtp180 -53.19 -51.65 61.39 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.617 -0.719 . . . . 2.6899999999999999 111.403 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 10.2 t -62.99 -12.78 28.1 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.433 -0.349 . . . . 1.0600000000000001 111.538 -179.785 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.46 ' HG ' ' O ' ' A' ' 35' ' ' LEU . 47.1 mt -113.06 156.65 22.75 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.364 -0.38 . . . . 1.26 110.708 -179.827 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -76.88 39.89 1.6 Allowed Glycine 0 CA--C 1.52 0.357 0 C-N-CA 120.88 -0.676 . . . . 0.68999999999999995 113.912 -178.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 67.2 mm-40 -94.3 -59.98 1.83 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 117.148 0.474 . . . . 1.97 110.745 179.034 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 57.15 66.28 3.17 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.132 -0.486 . . . . 2.6600000000000001 111.088 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.571 ' HG3' ' HG3' ' A' ' 36' ' ' MET . 43.5 Cg_endo -67.42 167.95 19.26 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.593 2.195 . . . . 0.51000000000000001 112.117 179.723 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 20.6 m -74.43 150.09 40.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.184 -0.462 . . . . 0.72999999999999998 110.511 179.654 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -54.76 -48.01 73.17 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.654 0.264 . . . . 2.7000000000000002 111.434 -179.716 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.81 -47.19 81.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.375 -0.375 . . . . 0.46000000000000002 111.498 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.451 ' O ' HD23 ' A' ' 51' ' ' LEU . 10.0 tp10 -56.46 -48.79 76.33 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.03 0.443 . . . . 2.23 110.48 -179.554 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.589 HD11 ' HA2' ' A' ' 33' ' ' GLY . 33.4 tp -57.45 -41.24 80.16 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.555 -0.748 . . . . 1.3600000000000001 110.938 -179.759 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 67.8 mt-30 -72.17 -25.95 61.88 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.058 -0.519 . . . . 1.22 111.212 -179.595 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -71.12 -55.05 9.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.483 -0.326 . . . . 0.62 111.565 -179.916 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.451 HD23 ' O ' ' A' ' 47' ' ' GLU . 0.9 OUTLIER -64.9 -38.8 92.16 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.459 -0.337 . . . . 0.39000000000000001 111.844 -179.226 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 94.5 mt -65.5 -48.37 83.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.841 0.353 . . . . 0.5 110.837 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.92 -26.33 66.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.192 -0.458 . . . . 0.58999999999999997 110.745 179.635 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -69.79 -53.98 15.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.991 -0.549 . . . . 2.54 110.416 179.753 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -72.7 -14.3 61.54 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.996 -0.547 . . . . 0.53000000000000003 111.176 179.735 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -55.53 -30.61 61.02 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.097 -0.501 . . . . 1.95 111.406 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -118.57 -33.23 4.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.506 -0.316 . . . . 2.48 111.337 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -69.58 -34.64 74.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.412 -0.358 . . . . 2.48 111.133 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ASN . . . . . 0.453 ' O ' ' HB2' ' A' ' 60' ' ' ASN . 13.5 m120 -114.7 6.25 15.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.315 -0.402 . . . . 2.0499999999999998 111.246 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ASN . . . . . 0.453 ' HB2' ' O ' ' A' ' 59' ' ' ASN . 39.6 m-80 74.0 -49.66 0.68 Allowed 'General case' 0 N--CA 1.466 0.375 0 O-C-N 123.607 0.567 . . . . 1.47 111.527 -179.867 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 169.43 7.52 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.598 -0.81 . . . . 0.42999999999999999 112.992 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.474 HE22 ' C ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -124.66 155.03 39.85 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.995 0.426 . . . . 0.38 111.284 179.837 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.616 ' HB2' HG13 ' A' ' 27' ' ' ILE . 27.3 mt -129.28 156.56 43.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.867 -0.606 . . . . 1.4299999999999999 110.854 -179.79 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ASN . . . . . 0.421 ' H ' ' CG ' ' A' ' 67' ' ' GLU . 44.3 m-80 -112.34 157.26 21.21 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.526 -0.307 . . . . 1.1899999999999999 110.493 179.902 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.473 ' O ' ' HB2' ' A' ' 69' ' ' CYS . 87.8 t80 -43.06 -38.46 2.34 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.986 -0.552 . . . . 0.40000000000000002 110.654 179.589 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -72.81 -37.71 67.44 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.063 -0.517 . . . . 0.81000000000000005 111.922 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.421 ' CG ' ' H ' ' A' ' 64' ' ' ASN . 20.6 mm-40 -59.65 -49.97 75.69 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.179 0.514 . . . . 1.3600000000000001 109.918 179.562 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.466 ' HE2' ' HB2' ' A' ' 12' ' ' PHE . 34.2 t80 -68.5 -53.7 21.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.525 -0.761 . . . . 0.51000000000000001 110.839 179.763 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.473 ' HB2' ' O ' ' A' ' 65' ' ' PHE . 1.8 t -51.52 -41.02 60.74 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-O 120.971 0.415 . . . . 0.75 110.267 179.667 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -56.94 -50.38 64.45 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.864 -0.684 . . . . 0.40999999999999998 111.526 179.577 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.453 ' HA ' ' HE2' ' A' ' 74' ' ' LYS . 11.4 mt -62.38 -36.69 76.02 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.407 0 CA-C-O 120.88 0.372 . . . . 0.51000000000000001 110.852 179.344 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' MET . . . . . 0.406 ' HG2' ' O ' ' A' ' 68' ' ' PHE . 95.0 mmm -59.2 -41.34 88.32 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.153 0.501 . . . . 1.01 109.679 179.104 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -55.93 -52.7 63.19 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.463 -0.79 . . . . 0.69999999999999996 110.659 178.871 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.453 ' HE2' ' HA ' ' A' ' 71' ' ' ILE . 55.3 pttt -68.7 -30.52 69.2 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.287 -0.415 . . . . 1.3799999999999999 111.15 -179.923 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 16.1 tp60 -68.64 -45.61 71.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.92 0.39 . . . . 1.98 110.884 179.624 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 45.1 mtt -58.92 -43.78 91.19 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 115.861 -0.609 . . . . 1.2 111.022 -179.744 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 76.6 mtp180 -79.29 -18.86 51.83 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.125 -0.489 . . . . 4.6900000000000004 111.051 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -64.92 -46.13 82.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.3 -0.409 . . . . 4.0099999999999998 111.215 -179.629 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.482 HG22 ' N ' ' A' ' 80' ' ' ASP . 94.5 m -83.76 -99.84 0.05 Allowed 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 116.381 -0.372 . . . . 5.2800000000000002 111.497 -179.396 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ASP . . . . . 0.482 ' N ' HG22 ' A' ' 79' ' ' THR . 3.2 p30 175.31 17.75 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 117.468 0.122 . . . . 5.5999999999999996 110.842 -179.392 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.532 ' O ' ' HG2' ' A' ' 85' ' ' MET . 3.0 t 37.01 69.04 0.23 Allowed 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 121.17 0.509 . . . . 7.29 111.07 -179.417 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -49.92 -18.95 0.59 Allowed 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 115.281 -0.872 . . . . 9.7400000000000002 113.112 -178.53 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -60.35 -56.28 23.35 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 111.854 0.316 . . . . 12.109999999999999 111.854 -179.213 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -72.73 -13.65 61.38 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.357 -0.383 . . . . 10.869999999999999 111.285 -179.455 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' MET . . . . . 0.628 ' HB3' HG22 ' A' ' 142' ' ' VAL . 5.6 mmm -79.34 -49.28 12.66 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.468 -0.333 . . . . 11.09 110.627 -179.197 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 16.3 ttp180 -63.45 -42.23 98.65 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 116.219 -0.446 . . . . 15.52 109.912 179.586 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -60.11 -42.14 94.1 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.013 -0.539 . . . . 14.85 109.795 179.105 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -72.17 -23.23 61.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.75 -0.659 . . . . 14.109999999999999 110.597 179.426 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -68.95 -43.44 75.04 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.194 -0.457 . . . . 15.73 110.482 179.649 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 47.7 mtmt -68.32 -40.99 81.46 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.135 -0.484 . . . . 17.66 110.353 179.482 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 93.0 mt -64.47 -46.36 93.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.89 -0.595 . . . . 18.149999999999999 111.106 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.457 ' HA ' HG21 ' A' ' 108' ' ' VAL . 0.6 OUTLIER -65.93 -49.13 69.03 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.281 -0.418 . . . . 18.34 110.907 -179.963 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -61.06 98.63 0.08 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.28 -0.418 . . . . 19.289999999999999 110.069 179.75 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.43 ' HG2' ' HB3' ' A' ' 104' ' ' GLU . 18.9 mmm180 -51.7 -27.77 12.76 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.918 -0.583 . . . . 22.25 111.231 -179.414 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.423 ' HB2' ' OD1' ' A' ' 97' ' ' ASP . 4.0 m-20 -112.22 169.9 8.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.3 -0.409 . . . . 23.34 110.731 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.41 5.6 57.31 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.891 -0.671 . . . . 22.0 112.051 179.675 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.423 ' OD1' ' HB2' ' A' ' 95' ' ' ASP . 7.8 p-10 -57.43 -32.7 67.16 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.687 0.28 . . . . 22.280000000000001 111.23 -179.659 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 107.43 12.97 22.06 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.698 -0.763 . . . . 19.93 112.926 179.626 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' PHE . . . . . 0.455 ' HA ' ' O ' ' A' ' 136' ' ' ILE . 97.3 m-85 -138.69 145.26 40.14 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.834 0.349 . . . . 20.300000000000001 111.071 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 48.5 mt -115.85 137.81 48.33 Favored 'Isoleucine or valine' 0 C--O 1.232 0.148 0 CA-C-N 116.151 -0.477 . . . . 19.370000000000001 111.445 -179.726 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 28.3 p -115.84 156.31 46.65 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 115.827 -0.624 . . . . 22.489999999999998 110.606 179.841 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_exo -44.34 -38.01 11.0 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.396 2.064 . . . . 23.0 112.552 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -63.89 -40.05 95.6 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.055 -0.521 . . . . 24.559999999999999 111.037 179.905 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.526 ' O ' HG23 ' A' ' 108' ' ' VAL . 42.2 mt-10 -72.82 -41.44 64.9 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.473 -0.785 . . . . 22.23 110.369 -179.896 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.583 HD23 ' HE1' ' A' ' 109' ' ' MET . 4.9 tp -58.05 -55.04 40.14 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.695 -0.684 . . . . 20.359999999999999 110.381 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 9.0 ttp180 -54.61 -49.78 69.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.588 -0.733 . . . . 27.190000000000001 111.573 -179.813 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 55.3 t80 -54.59 -33.8 60.93 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.203 -0.453 . . . . 25.359999999999999 111.786 -178.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.526 HG23 ' O ' ' A' ' 104' ' ' GLU . 58.3 t -79.23 -55.43 9.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 112.113 0.412 . . . . 21.059999999999999 112.113 -179.187 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.583 ' HE1' HD23 ' A' ' 105' ' ' LEU . 49.5 mtm -50.64 -41.23 55.02 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.524 0.202 . . . . 20.93 111.429 -179.278 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 88.9 mt -62.85 -32.59 56.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.928 0.394 . . . . 25.129999999999999 110.546 179.36 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 95.8 m-20 -71.46 -38.27 71.29 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.007 -0.542 . . . . 23.32 110.828 179.501 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.489 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 2.3 mt -74.66 -25.94 59.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.191 -0.459 . . . . 21.07 110.936 -179.708 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 98.23 46.87 2.12 Favored Glycine 0 N--CA 1.453 -0.23 0 C-N-CA 120.887 -0.673 . . . . 23.050000000000001 112.433 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -100.26 -27.02 13.71 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.523 0.201 . . . . 22.59 111.359 -179.684 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 13.4 mmmm 52.3 85.97 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.327 -0.397 . . . . 27.960000000000001 110.809 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' VAL . . . . . 0.457 HG21 ' SD ' ' A' ' 109' ' ' MET . 2.8 m -129.44 155.38 41.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.122 -0.49 . . . . 24.75 111.824 -179.514 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 59.2 p -95.87 146.71 24.35 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.798 -0.637 . . . . 27.239999999999998 109.864 178.608 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -55.54 -15.85 3.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.476 -0.329 . . . . 26.629999999999999 111.618 -179.453 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -79.21 -55.22 5.26 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.498 -0.319 . . . . 29.140000000000001 111.612 -179.573 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.413 ' OE1' HG12 ' A' ' 116' ' ' VAL . 13.3 pt-20 -62.03 -37.34 84.54 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 111.824 0.305 . . . . 24.190000000000001 111.824 -179.347 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.549 ' HB ' HD23 ' A' ' 105' ' ' LEU . 33.3 pt -74.89 -38.19 43.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 N-CA-C 111.887 0.329 . . . . 22.329999999999998 111.887 -179.06 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.504 ' N ' HG13 ' A' ' 121' ' ' ILE . 18.0 t70 -62.33 -43.94 97.66 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.872 0.367 . . . . 24.289999999999999 110.561 179.753 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -62.55 -43.03 99.83 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.03 -0.532 . . . . 24.739999999999998 110.565 179.631 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 45.4 ttp -56.41 -36.95 69.51 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.063 -0.517 . . . . 19.710000000000001 110.651 179.389 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.644 HG23 HD11 ' A' ' 136' ' ' ILE . 71.9 mt -65.24 -43.05 95.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.045 -0.525 . . . . 19.949999999999999 110.514 179.751 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 69.9 ttt180 -59.4 -37.92 79.25 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.815 -0.63 . . . . 24.949999999999999 111.046 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -70.92 -24.48 62.47 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.202 -0.454 . . . . 18.690000000000001 111.315 -179.635 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.577 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -98.94 -12.77 20.37 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.309 -0.405 . . . . 16.469999999999999 111.272 -179.831 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 62.1 t0 -103.32 96.45 6.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.204 -0.453 . . . . 20.399999999999999 110.935 -179.553 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -66.38 -54.05 28.88 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.896 -0.593 . . . . 21.43 111.128 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -61.14 -19.3 61.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.153 -0.476 . . . . 23.370000000000001 111.042 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 52.16 77.38 0.14 Allowed Glycine 0 N--CA 1.453 -0.186 0 C-N-CA 120.904 -0.665 . . . . 24.32 112.753 179.718 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -128.75 -0.3 5.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.825 0.345 . . . . 23.879999999999999 110.667 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 80.74 19.66 67.56 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.9 -0.667 . . . . 22.670000000000002 112.617 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 38.2 mtp -139.33 149.33 44.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.65 0.262 . . . . 22.91 110.419 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.723 HG23 ' HB2' ' A' ' 140' ' ' GLU . 47.4 mm -116.62 142.3 30.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 121.254 0.549 . . . . 18.41 111.95 -179.408 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 137' ' ' ASN . . . . . 0.423 ' O ' ' N ' ' A' ' 139' ' ' GLU . 1.3 p30 -114.94 158.75 21.58 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.159 -0.928 . . . . 16.82 109.239 178.647 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.699 ' O ' HG23 ' A' ' 142' ' ' VAL . 11.8 t80 -37.72 -27.56 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 112.481 0.549 . . . . 14.65 112.481 -179.067 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.423 ' N ' ' O ' ' A' ' 137' ' ' ASN . 43.3 mt-10 -80.54 -55.73 4.66 Favored 'General case' 0 C--N 1.328 -0.327 0 O-C-N 122.155 -0.34 . . . . 14.82 111.236 -179.328 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.723 ' HB2' HG23 ' A' ' 136' ' ' ILE . 71.4 mt-10 -59.15 -29.76 67.66 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.228 -0.442 . . . . 17.460000000000001 110.504 179.819 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.536 ' CE2' HD13 ' A' ' 145' ' ' ILE . 78.7 t80 -70.23 -55.61 8.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.821 -0.627 . . . . 12.93 110.575 179.715 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.699 HG23 ' O ' ' A' ' 138' ' ' TYR . 53.7 t -48.25 -35.86 5.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 115.917 -0.583 . . . . 10.699999999999999 111.972 179.728 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 143' ' ' TRP . . . . . 0.487 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 91.4 t90 -72.23 -56.06 6.16 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.469 0.544 . . . . 13.66 112.469 -179.018 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 144' ' ' MET . . . . . 0.694 ' HE2' HG21 ' A' ' 136' ' ' ILE . 18.2 ptt? -61.35 -25.76 67.37 Favored 'General case' 0 N--CA 1.464 0.244 0 N-CA-C 112.93 0.715 . . . . 14.5 112.93 -177.993 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 145' ' ' ILE . . . . . 0.561 HD11 ' HB3' ' A' ' 85' ' ' MET . 45.6 pt -80.48 -40.78 19.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 112.022 0.378 . . . . 11.25 112.022 -179.559 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 146' ' ' SER . . . . . 0.546 ' N ' HG13 ' A' ' 145' ' ' ILE . 22.6 t -59.7 -14.49 14.34 Favored 'General case' 0 CA--C 1.519 -0.25 0 CA-C-O 121.45 0.643 . . . . 8.5399999999999991 109.841 -179.804 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 147' ' ' GLN . . . . . 0.487 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 0.7 OUTLIER -114.63 -15.54 11.95 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.887 -1.051 . . . . 11.869999999999999 110.242 -179.579 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.312 -0.851 . . . . 13.68 110.904 179.822 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 149' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 151' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 66.4 m . . . . . 0 N--CA 1.485 1.283 0 CA-C-O 120.658 0.266 . . . . 4.8899999999999997 110.929 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 28.7 mm-40 65.19 136.07 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 115.958 -0.564 . . . . 3.2599999999999998 111.337 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.552 HD13 ' SG ' ' A' ' 69' ' ' CYS . 31.3 mt -76.86 82.92 3.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.106 -0.497 . . . . 1.27 110.925 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 76.3 p -70.34 -167.84 0.2 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.259 -0.428 . . . . 1.1200000000000001 111.057 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.426 ' HG3' ' N ' ' A' ' 7' ' ' GLU . 10.0 pt-20 -72.64 -40.46 66.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.908 0.385 . . . . 2.2000000000000002 110.505 -179.91 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.426 ' N ' ' HG3' ' A' ' 6' ' ' GLU . 9.4 pt-20 -74.18 -39.05 63.46 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.936 -0.574 . . . . 1.3500000000000001 110.515 179.733 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -65.13 -48.99 71.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.905 -0.588 . . . . 2.2200000000000002 110.64 179.721 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.53 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 61.9 mt -55.8 -50.59 67.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.389 -0.369 . . . . 0.54000000000000004 110.705 179.829 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.61 -23.11 66.13 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.163 -0.472 . . . . 0.5 111.255 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -69.71 -56.35 7.45 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.295 -0.412 . . . . 2.27 111.828 -179.108 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.53 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 12.3 p90 -78.22 -25.47 46.99 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 120.586 -0.446 . . . . 0.37 110.879 -179.775 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.471 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 20.0 tptm -63.32 -36.23 83.02 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 108.989 -0.745 . . . . 1.23 108.989 178.484 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.463 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 15.7 t70 -68.44 -51.98 37.75 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 108.825 -0.806 . . . . 0.44 108.825 177.927 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.34 -13.81 22.31 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.399 -0.819 . . . . 0.28999999999999998 110.568 179.069 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.471 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 55.0 t80 -79.43 -51.45 9.35 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.886 -0.597 . . . . 0.47999999999999998 110.597 -179.697 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.442 HG22 ' O ' ' A' ' 14' ' ' ASP . 26.9 m -65.36 -18.92 24.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 121.003 0.43 . . . . 1.1100000000000001 110.294 179.913 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.463 ' HG2' ' O ' ' A' ' 14' ' ' ASP . 29.2 mm-40 -63.2 -29.62 70.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.648 -0.705 . . . . 1.6000000000000001 111.719 179.483 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -105.87 27.1 8.85 Favored 'General case' 0 N--CA 1.463 0.217 0 N-CA-C 112.04 0.385 . . . . 0.64000000000000001 112.04 -179.185 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -113.94 86.74 2.47 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.988 0.423 . . . . 0.44 110.589 179.217 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.546 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -94.85 -38.01 10.94 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.917 -0.583 . . . . 2.1000000000000001 111.438 -179.599 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -56.8 -24.59 51.73 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.307 -0.406 . . . . 1.8 111.477 -179.583 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 87.28 1.92 83.56 Favored Glycine 0 C--N 1.33 0.209 0 C-N-CA 120.793 -0.717 . . . . 0.46000000000000002 112.88 179.62 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 26.8 p -82.35 16.07 2.2 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.688 0.28 . . . . 0.40000000000000002 111.195 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 54.93 25.55 38.17 Favored Glycine 0 C--N 1.331 0.299 0 C-N-CA 120.721 -0.752 . . . . 0.33000000000000002 111.766 -179.539 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.503 ' C ' HE22 ' A' ' 62' ' ' GLN . 35.4 mtmm -132.38 156.61 46.34 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.842 0.353 . . . . 1.1000000000000001 111.067 -179.382 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.711 HG13 ' HB2' ' A' ' 63' ' ' LEU . 31.1 pt -114.33 124.94 71.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 121.001 0.429 . . . . 0.5 111.341 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -51.2 141.19 15.05 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.063 -0.517 . . . . 0.29999999999999999 111.416 179.736 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 8.3 t -65.91 -11.84 50.13 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.94 -0.573 . . . . 1.03 111.313 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.459 ' HD2' ' N ' ' A' ' 30' ' ' ARG . 2.5 mpt_? -90.76 5.25 49.05 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.971 0.415 . . . . 3.0800000000000001 110.492 179.777 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -120.86 -9.43 9.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.923 -0.58 . . . . 2.2599999999999998 110.788 -179.789 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.521 HD22 HD11 ' A' ' 51' ' ' LEU . 7.9 tt -53.25 -52.46 58.92 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.317 -0.401 . . . . 1.3700000000000001 110.747 179.671 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.482 ' HA2' HD11 ' A' ' 48' ' ' LEU . . . -54.3 -48.01 65.97 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.427 -0.892 . . . . 0.32000000000000001 111.602 179.551 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 30.2 m -58.3 -29.25 65.71 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 121.423 0.63 . . . . 0.31 109.643 178.688 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.475 ' O ' HG22 ' A' ' 38' ' ' THR . 1.2 tt -72.67 -35.07 67.62 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.163 -0.926 . . . . 1.24 109.905 179.391 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.557 ' SD ' ' HG3' ' A' ' 43' ' ' PRO . 7.4 mtp -76.92 -16.9 59.23 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.976 -0.556 . . . . 1.1000000000000001 110.297 179.89 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -80.63 -41.78 23.3 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.977 -0.556 . . . . 2.6899999999999999 110.302 179.049 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.475 HG22 ' O ' ' A' ' 35' ' ' LEU . 10.4 t -67.32 -12.44 60.16 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.991 -0.55 . . . . 1.0600000000000001 110.769 179.568 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 26.4 mt -112.28 155.53 23.9 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.918 -0.583 . . . . 1.26 110.136 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -72.42 16.83 1.62 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.834 -0.698 . . . . 0.68999999999999995 113.462 -179.272 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -68.09 -63.2 1.11 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.907 0.384 . . . . 1.97 110.932 179.602 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 69.7 m-20 55.57 70.77 1.43 Allowed Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 115.936 -0.574 . . . . 2.6600000000000001 111.061 -179.707 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.557 ' HG3' ' SD ' ' A' ' 36' ' ' MET . 57.5 Cg_endo -67.97 -167.78 0.18 Allowed 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.87 2.38 . . . . 0.51000000000000001 112.307 179.645 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 41.1 m -100.17 144.23 29.44 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.036 -0.529 . . . . 0.72999999999999998 110.489 179.45 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -48.99 -55.14 12.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.742 0.306 . . . . 2.7000000000000002 111.364 -179.442 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -54.49 -48.24 72.09 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.204 -0.453 . . . . 0.46000000000000002 111.622 -179.646 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.452 ' HG2' HD23 ' A' ' 51' ' ' LEU . 37.8 tt0 -56.4 -47.29 79.27 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.813 0.339 . . . . 2.23 110.651 -179.778 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.482 HD11 ' HA2' ' A' ' 33' ' ' GLY . 13.9 tp -58.83 -41.88 87.92 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.936 -0.575 . . . . 1.3600000000000001 111.112 -179.764 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 82.8 mm-40 -71.12 -31.76 68.15 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.249 -0.432 . . . . 1.22 111.759 -179.384 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.465 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 28.8 m-20 -74.07 -55.88 5.58 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 111.919 0.34 . . . . 0.62 111.919 -179.199 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.521 HD11 HD22 ' A' ' 32' ' ' LEU . 3.1 pp -59.51 -37.29 77.93 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.696 -0.229 . . . . 0.39000000000000001 111.285 -179.314 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 76.8 mt -69.35 -35.39 67.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.754 0.312 . . . . 0.5 110.556 179.539 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.68 -36.55 81.19 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.301 -0.409 . . . . 0.58999999999999997 110.756 179.45 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.465 ' HG2' ' O ' ' A' ' 50' ' ' ASP . 3.3 mm-40 -73.23 -50.38 22.72 Favored 'General case' 0 CA--C 1.516 -0.365 0 N-CA-C 109.623 -0.51 . . . . 2.54 109.623 179.178 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -63.12 -14.36 47.66 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.551 -0.749 . . . . 0.53000000000000003 110.975 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -57.47 -37.26 72.6 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.975 -0.557 . . . . 1.95 111.61 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 6.8 p30 -127.09 -36.95 2.12 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.597 -0.274 . . . . 2.48 111.563 -179.416 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 46.3 m-80 -62.0 -15.53 44.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.557 -0.292 . . . . 2.48 111.37 -179.777 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ASN . . . . . 0.407 ' C ' ' H ' ' A' ' 61' ' ' GLY . 14.4 m120 -123.24 1.28 9.09 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.436 -0.347 . . . . 2.0499999999999998 110.972 179.861 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 69.5 m-20 73.24 -31.24 0.22 Allowed 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.99 -0.55 . . . . 1.47 111.766 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLY . . . . . 0.407 ' H ' ' C ' ' A' ' 59' ' ' ASN . . . 140.5 15.5 0.49 Allowed Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.553 -0.832 . . . . 0.42999999999999999 112.738 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.503 HE22 ' C ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -138.66 151.49 47.24 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.077 0.465 . . . . 0.38 111.195 179.825 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.711 ' HB2' HG13 ' A' ' 27' ' ' ILE . 6.3 mp -119.12 150.02 40.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.627 -0.715 . . . . 1.4299999999999999 110.685 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ASN . . . . . 0.446 ' H ' ' HB2' ' A' ' 67' ' ' GLU . 50.0 m-80 -113.94 157.67 22.12 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.961 -0.385 . . . . 1.1899999999999999 109.961 178.876 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.544 ' O ' ' HB2' ' A' ' 69' ' ' CYS . 85.3 t80 -43.68 -35.32 1.76 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.881 0.372 . . . . 0.40000000000000002 110.411 179.147 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -77.08 -37.84 53.64 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.994 -0.548 . . . . 0.81000000000000005 111.748 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.446 ' HB2' ' H ' ' A' ' 64' ' ' ASN . 10.2 mm-40 -59.64 -49.4 77.88 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.144 0.497 . . . . 1.3600000000000001 110.016 179.486 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.487 ' HE2' ' HB2' ' A' ' 12' ' ' PHE . 28.5 t80 -69.08 -52.85 24.2 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.548 -0.751 . . . . 0.51000000000000001 111.087 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.552 ' SG ' HD13 ' A' ' 4' ' ' LEU . 1.4 t -52.44 -45.02 65.82 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 121.002 0.43 . . . . 0.75 110.311 179.788 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' GLY . . . . . 0.422 ' O ' ' HB3' ' A' ' 73' ' ' ALA . . . -54.26 -50.85 54.46 Favored Glycine 0 N--CA 1.451 -0.32 0 CA-C-N 115.644 -0.707 . . . . 0.40999999999999998 112.046 179.766 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.454 HG23 ' HE3' ' A' ' 74' ' ' LYS . 11.7 mt -62.54 -40.57 88.72 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.375 0 CA-C-O 120.973 0.416 . . . . 0.51000000000000001 110.523 179.296 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 3.6 mtp -58.92 -22.72 60.29 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.784 -0.644 . . . . 1.01 109.998 179.43 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.422 ' HB3' ' O ' ' A' ' 70' ' ' GLY . . . -74.89 -52.23 11.82 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.03 -0.532 . . . . 0.69999999999999996 109.969 178.964 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.454 ' HE3' HG23 ' A' ' 71' ' ' ILE . 61.2 pttt -67.05 -24.25 65.97 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 121.08 0.467 . . . . 1.3799999999999999 110.07 179.164 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 52.8 tt0 -78.08 -49.72 13.41 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.756 -0.657 . . . . 1.98 110.593 178.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' MET . . . . . 0.469 ' SD ' HD23 ' A' ' 4' ' ' LEU . 38.9 mtt -67.9 -13.71 62.37 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.82 -0.627 . . . . 1.2 110.84 179.744 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 23.7 tpt180 -44.11 -21.33 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.734 -0.666 . . . . 4.6900000000000004 112.196 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -51.54 -27.1 9.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.71 0.291 . . . . 4.0099999999999998 111.624 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.4 HG23 ' N ' ' A' ' 80' ' ' ASP . 9.2 t -62.32 -44.33 96.75 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.318 0.488 . . . . 5.2800000000000002 112.318 -178.94 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ASP . . . . . 0.4 ' N ' HG23 ' A' ' 79' ' ' THR . 1.0 OUTLIER -80.04 -65.11 1.05 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.608 0.242 . . . . 5.5999999999999996 111.511 -179.613 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.596 ' O ' ' HG2' ' A' ' 85' ' ' MET . 91.9 m 56.67 81.66 0.13 Allowed 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.377 -0.374 . . . . 7.29 110.477 -179.296 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.435 ' HB3' ' OH ' ' A' ' 138' ' ' TYR . 32.3 mt-10 -59.27 -14.88 12.68 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 113.034 0.753 . . . . 9.7400000000000002 113.034 -178.507 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -64.61 -56.71 12.14 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 120.821 0.344 . . . . 12.109999999999999 111.66 -179.259 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -67.43 -16.55 64.29 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.134 0.492 . . . . 10.869999999999999 110.381 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' MET . . . . . 0.596 ' HG2' ' O ' ' A' ' 81' ' ' THR . 7.1 mmm -80.36 -34.96 36.09 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.646 -0.706 . . . . 11.09 109.768 -179.702 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 17.8 ttm180 -65.82 -42.6 90.42 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.643 -0.708 . . . . 15.52 109.512 179.039 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.425 ' HA ' ' HE3' ' A' ' 90' ' ' LYS . 1.9 tm-20 -59.87 -47.43 85.77 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 109.272 -0.64 . . . . 14.85 109.272 178.62 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.79 -26.08 68.19 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.59 -0.732 . . . . 14.109999999999999 110.553 179.155 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -69.77 -38.22 76.65 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.203 -0.453 . . . . 15.73 110.229 179.481 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.425 ' HE3' ' HA ' ' A' ' 87' ' ' GLU . 9.6 mtmp? -63.09 -48.79 77.09 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.929 -0.578 . . . . 17.66 110.416 179.57 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 84.1 mt -61.21 -46.25 96.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.179 -0.464 . . . . 18.149999999999999 110.882 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.671 ' HA ' HG21 ' A' ' 108' ' ' VAL . 0.9 OUTLIER -60.43 -39.91 89.16 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.147 -0.478 . . . . 18.34 111.132 -179.871 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 36.7 t0 -72.83 95.54 1.95 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.943 0.401 . . . . 19.289999999999999 110.0 179.425 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.444 ' HG3' ' HA ' ' A' ' 104' ' ' GLU . 0.6 OUTLIER -56.75 -16.25 6.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.754 -0.657 . . . . 22.25 111.177 -179.366 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.447 ' HB2' ' OD1' ' A' ' 97' ' ' ASP . 24.2 m-20 -118.14 169.43 9.69 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.94 0.4 . . . . 23.34 110.859 179.73 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.27 5.4 57.45 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.869 -0.681 . . . . 22.0 112.342 179.594 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.447 ' OD1' ' HB2' ' A' ' 95' ' ' ASP . 5.7 p-10 -62.0 -41.69 98.33 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.716 0.293 . . . . 22.280000000000001 111.147 -179.758 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 117.69 10.94 8.9 Favored Glycine 0 C--N 1.332 0.335 0 C-N-CA 120.717 -0.754 . . . . 19.93 112.767 179.783 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -137.87 150.84 47.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.786 0.327 . . . . 20.300000000000001 110.948 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 46.6 mt -114.81 139.44 40.97 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.141 0 CA-C-N 116.253 -0.43 . . . . 19.370000000000001 111.315 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 74.2 m -114.53 156.24 44.9 Favored Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 115.894 -0.594 . . . . 22.489999999999998 110.045 179.512 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_exo -44.16 -36.3 8.71 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.304 2.003 . . . . 23.0 112.846 -179.43 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.63 -39.72 88.41 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.223 0.535 . . . . 24.559999999999999 110.884 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.491 ' O ' HG23 ' A' ' 108' ' ' VAL . 42.1 mt-10 -74.51 -44.65 50.31 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.409 -0.814 . . . . 22.23 110.202 -179.847 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.501 HD23 ' HE1' ' A' ' 109' ' ' MET . 2.8 tp -54.32 -51.66 63.98 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.232 -0.894 . . . . 20.359999999999999 110.246 179.733 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.443 ' HA ' ' HE3' ' A' ' 109' ' ' MET . 10.7 ttt85 -57.07 -55.24 37.32 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.337 -0.847 . . . . 27.190000000000001 111.633 -179.749 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 36.0 t80 -46.11 -44.35 15.6 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.102 -0.499 . . . . 25.359999999999999 112.32 -178.753 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.671 HG21 ' HA ' ' A' ' 92' ' ' PHE . 23.0 t -69.62 -54.55 18.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 N-CA-C 112.235 0.457 . . . . 21.059999999999999 112.235 -178.706 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.501 ' HE1' HD23 ' A' ' 105' ' ' LEU . 62.3 mtm -52.51 -37.38 57.31 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 120.886 0.374 . . . . 20.93 110.531 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 72.5 mt -64.88 -36.47 77.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.987 -0.552 . . . . 25.129999999999999 110.162 178.932 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 91.3 m-20 -67.31 -34.92 78.39 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.844 -0.616 . . . . 23.32 110.504 179.448 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 69.5 mt -72.0 -40.83 68.24 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.875 -0.602 . . . . 21.07 110.825 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 129.51 -3.48 6.18 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.759 -0.734 . . . . 23.050000000000001 112.557 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -86.94 93.92 9.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.679 0.276 . . . . 22.59 110.984 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -64.7 119.34 10.38 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.274 -0.421 . . . . 27.960000000000001 110.635 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 4.8 m -137.89 154.9 29.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.992 -0.549 . . . . 24.75 111.398 -179.638 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 71.3 p -98.12 147.37 24.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.804 -0.634 . . . . 27.239999999999998 110.576 179.463 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' ASP . . . . . 0.427 ' HA ' HG12 ' A' ' 121' ' ' ILE . 21.3 m-20 -53.7 -21.42 7.04 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.23 -0.441 . . . . 26.629999999999999 111.065 -179.908 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -80.5 -50.41 10.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.257 -0.429 . . . . 29.140000000000001 111.106 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.3 -33.62 75.91 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.265 -0.425 . . . . 24.190000000000001 111.121 -179.483 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.453 HG13 ' N ' ' A' ' 122' ' ' ASP . 32.6 pt -79.17 -35.08 16.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.399 -0.364 . . . . 22.329999999999998 110.946 -179.892 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.453 ' N ' HG13 ' A' ' 121' ' ' ILE . 14.8 t70 -62.13 -32.0 72.54 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.041 0.448 . . . . 24.289999999999999 109.827 179.307 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -72.79 -47.08 49.61 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.763 -0.653 . . . . 24.739999999999998 110.203 179.278 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 49.3 ttp -55.62 -40.13 71.7 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.977 -0.556 . . . . 19.710000000000001 110.526 179.375 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.494 HD11 HD22 ' A' ' 105' ' ' LEU . 85.7 mt -65.89 -41.85 90.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.089 -0.505 . . . . 19.949999999999999 110.27 179.33 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 56.1 ttt180 -59.76 -31.96 70.14 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.697 -0.683 . . . . 24.949999999999999 110.826 179.585 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -77.79 -28.18 50.39 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.142 -0.481 . . . . 18.690000000000001 111.101 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.639 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -92.7 -14.13 28.44 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.17 -0.468 . . . . 16.469999999999999 111.029 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 129' ' ' ASP . . . . . 0.447 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 30.0 t70 -100.86 106.64 18.03 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.045 -0.525 . . . . 20.399999999999999 110.613 -179.798 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 74.1 m-85 -93.4 -41.83 9.61 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.739 -0.664 . . . . 21.43 111.499 -179.351 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -56.19 -26.17 49.82 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.417 -0.356 . . . . 23.370000000000001 111.021 -179.76 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 76.26 62.85 2.5 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.879 -0.677 . . . . 24.32 112.432 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 133' ' ' ASP . . . . . 0.4 ' OD2' ' HB2' ' A' ' 135' ' ' MET . 3.3 p-10 -130.35 -0.73 4.51 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.69 0.281 . . . . 23.879999999999999 111.258 -179.697 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 66.98 18.2 68.54 Favored Glycine 0 C--N 1.33 0.245 0 C-N-CA 120.814 -0.708 . . . . 22.670000000000002 112.731 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 135' ' ' MET . . . . . 0.4 ' HB2' ' OD2' ' A' ' 133' ' ' ASP . 68.4 mtp -134.3 155.36 50.35 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 110.183 -0.303 . . . . 22.91 110.183 179.857 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.696 HG23 ' HB2' ' A' ' 140' ' ' GLU . 47.5 mm -114.12 145.59 19.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 121.497 0.665 . . . . 18.41 112.119 -179.089 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 137' ' ' ASN . . . . . 0.428 ' O ' ' N ' ' A' ' 139' ' ' GLU . 26.9 t-20 -118.64 158.41 25.53 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 114.901 -1.045 . . . . 16.82 108.922 178.508 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.576 ' O ' HG23 ' A' ' 142' ' ' VAL . 8.2 t80 -38.72 -26.6 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 112.009 0.374 . . . . 14.65 112.009 -179.664 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.428 ' N ' ' O ' ' A' ' 137' ' ' ASN . 45.4 mt-10 -80.68 -55.85 4.55 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.774 0.321 . . . . 14.82 111.097 -179.546 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.696 ' HB2' HG23 ' A' ' 136' ' ' ILE . 27.5 mt-10 -60.87 -24.41 65.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.164 0.507 . . . . 17.460000000000001 110.214 179.712 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.594 ' HA ' ' HE2' ' A' ' 144' ' ' MET . 86.6 t80 -74.0 -55.56 5.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.556 -0.747 . . . . 12.93 110.527 179.857 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.576 HG23 ' O ' ' A' ' 138' ' ' TYR . 42.9 t -48.63 -37.0 7.9 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 CA-C-N 115.9 -0.591 . . . . 10.699999999999999 111.417 179.499 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 76.8 t90 -70.57 -55.0 9.87 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.265 0.469 . . . . 13.66 112.265 -179.165 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 144' ' ' MET . . . . . 0.639 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 24.6 ptt? -65.13 -22.22 66.9 Favored 'General case' 0 N--CA 1.464 0.274 0 N-CA-C 113.339 0.866 . . . . 14.5 113.339 -177.611 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 145' ' ' ILE . . . . . 0.642 ' HA ' ' HB2' ' A' ' 148' ' ' LYS . 39.6 pt -80.55 -44.6 21.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 C-N-CA 120.751 -0.38 . . . . 11.25 111.833 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 146' ' ' SER . . . . . 0.538 ' N ' HG13 ' A' ' 145' ' ' ILE . 78.7 p -64.29 -14.19 54.41 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-O 121.448 0.642 . . . . 8.5399999999999991 109.59 179.629 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 8.0 mm-40 -125.35 19.93 8.11 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 114.967 -1.015 . . . . 11.869999999999999 110.245 -179.417 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 148' ' ' LYS . . . . . 0.642 ' HB2' ' HA ' ' A' ' 145' ' ' ILE . 16.5 ttpp . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.267 -0.873 . . . . 13.68 111.069 -179.451 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 149' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 151' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.535 ' HB3' ' HB3' ' A' ' 76' ' ' MET . 47.7 t . . . . . 0 N--CA 1.485 1.323 0 CA-C-O 120.781 0.324 . . . . 4.8899999999999997 110.906 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -133.73 138.98 46.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.106 -0.497 . . . . 3.2599999999999998 110.544 -179.928 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 65.2 mt -59.14 95.49 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.209 -0.451 . . . . 1.27 110.898 -179.893 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.402 HG21 ' HB3' ' A' ' 147' ' ' GLN . 67.6 p -87.01 -165.55 1.32 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.242 -0.435 . . . . 1.1200000000000001 111.15 -179.92 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -73.78 -39.78 63.92 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.991 0.424 . . . . 2.2000000000000002 110.762 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -74.46 -41.13 61.32 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.827 -0.624 . . . . 1.3500000000000001 110.813 -179.665 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 -63.74 -49.39 73.2 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.164 -0.471 . . . . 2.2200000000000002 110.79 179.858 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.538 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 63.8 mt -55.95 -52.44 49.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.445 -0.343 . . . . 0.54000000000000004 110.882 179.76 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.86 -21.54 66.82 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.38 -0.373 . . . . 0.5 111.371 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -71.23 -56.75 5.41 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 116.441 -0.345 . . . . 2.27 111.923 -179.181 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.538 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 17.9 p90 -78.51 -26.11 45.81 Favored 'General case' 0 C--N 1.332 -0.154 0 C-N-CA 120.579 -0.448 . . . . 0.37 110.931 -179.666 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 49.9 tptt -66.15 -34.95 79.22 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.348 -0.612 . . . . 1.23 109.348 178.769 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.449 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 24.8 t70 -68.83 -50.94 45.84 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.349 -0.612 . . . . 0.44 109.349 178.489 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.58 -14.3 57.1 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.823 -0.626 . . . . 0.28999999999999998 110.445 178.925 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -80.09 -44.38 20.1 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.816 -0.629 . . . . 0.47999999999999998 111.016 -179.442 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.417 HG22 ' O ' ' A' ' 14' ' ' ASP . 34.2 m -73.45 -22.75 19.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.336 -0.393 . . . . 1.1100000000000001 111.021 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.449 ' HG2' ' O ' ' A' ' 14' ' ' ASP . 82.5 mm-40 -63.21 -34.16 77.05 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.137 -0.483 . . . . 1.6000000000000001 111.201 179.74 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 46.9 m-85 -86.95 -13.38 44.79 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.473 -0.331 . . . . 0.64000000000000001 111.579 -179.701 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -90.35 87.62 6.88 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.832 0.349 . . . . 0.44 110.596 179.777 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 70.4 mmtt -95.0 -19.78 19.91 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.078 -0.51 . . . . 2.1000000000000001 111.292 -179.605 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -78.59 -42.29 29.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.252 -0.431 . . . . 1.8 111.204 -179.669 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.95 3.94 29.77 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.649 -0.786 . . . . 0.46000000000000002 112.735 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 49.4 p -73.06 1.09 9.69 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.628 0.251 . . . . 0.40000000000000002 111.216 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 61.6 23.73 63.24 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.503 -0.856 . . . . 0.33000000000000002 111.679 -179.369 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.661 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 28.9 mtpt -133.83 155.76 49.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.817 0.341 . . . . 1.1000000000000001 111.065 -179.748 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.56 HG13 ' HB3' ' A' ' 63' ' ' LEU . 23.3 pt -117.41 131.77 69.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.108 -0.496 . . . . 0.5 111.714 -179.257 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -54.97 130.46 41.63 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.27 -0.423 . . . . 0.29999999999999999 110.974 179.599 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 81.5 p -62.68 -22.46 66.49 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.154 -0.475 . . . . 1.03 111.13 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 52.6 mtp180 -73.25 -18.03 61.27 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.087 -0.506 . . . . 3.0800000000000001 110.41 179.668 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -102.6 0.85 33.95 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.75 -0.659 . . . . 2.2599999999999998 110.595 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.488 HD23 HD22 ' A' ' 63' ' ' LEU . 0.5 OUTLIER -60.07 -52.44 65.36 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.939 -0.573 . . . . 1.3700000000000001 110.646 -179.818 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -54.12 -39.54 64.04 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.628 -0.796 . . . . 0.32000000000000001 111.799 179.542 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.408 ' O ' HG22 ' A' ' 38' ' ' THR . 60.7 m -70.04 -28.11 65.21 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.021 0.439 . . . . 0.31 110.559 179.462 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 52.4 tp -72.23 -34.41 68.3 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.66 -0.7 . . . . 1.24 111.526 -179.324 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.434 ' SD ' ' HG3' ' A' ' 43' ' ' PRO . 26.7 mtp -80.4 -29.02 37.73 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.439 -0.346 . . . . 1.1000000000000001 110.8 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 76.3 mtp180 -68.21 -41.86 80.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.269 -0.423 . . . . 2.6899999999999999 110.466 179.557 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.426 HG23 ' CD1' ' A' ' 39' ' ' LEU . 1.8 t -66.13 -13.07 59.54 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.153 -0.476 . . . . 1.0600000000000001 111.006 179.51 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.426 ' CD1' HG23 ' A' ' 38' ' ' THR . 10.5 mp -113.12 156.06 23.84 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.982 -0.553 . . . . 1.26 110.553 179.574 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -42.32 -33.48 1.38 Allowed Glycine 0 CA--C 1.52 0.378 0 C-N-CA 121.305 -0.474 . . . . 0.68999999999999995 113.817 -179.173 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 24.8 mp0 -52.52 143.7 15.06 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.883 0.373 . . . . 1.97 111.282 -179.544 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -133.43 72.75 74.45 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 115.886 -0.597 . . . . 2.6600000000000001 110.869 179.706 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.434 ' HG3' ' SD ' ' A' ' 36' ' ' MET . 28.0 Cg_endo -60.54 150.08 83.43 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.814 2.343 . . . . 0.51000000000000001 112.482 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.414 HG22 ' N ' ' A' ' 45' ' ' GLU . 9.3 m -78.61 159.92 27.83 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.191 -0.458 . . . . 0.72999999999999998 110.456 179.662 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.414 ' N ' HG22 ' A' ' 44' ' ' THR . 39.7 tt0 -59.52 -55.23 37.17 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.768 0.318 . . . . 2.7000000000000002 111.242 -179.741 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.0 -49.18 77.08 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.303 -0.408 . . . . 0.46000000000000002 111.459 -179.725 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.496 ' O ' HD23 ' A' ' 51' ' ' LEU . 42.2 tt0 -55.06 -43.95 74.31 Favored 'General case' 0 CA--C 1.518 -0.25 0 CA-C-N 116.322 -0.399 . . . . 2.23 110.086 -179.798 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.425 ' HA ' HD21 ' A' ' 51' ' ' LEU . 55.9 tp -56.55 -44.78 81.25 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.577 -0.738 . . . . 1.3600000000000001 110.806 179.765 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -70.59 -25.55 63.12 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.081 -0.509 . . . . 1.22 111.251 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -68.6 -51.54 41.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.539 -0.3 . . . . 0.62 111.39 179.904 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.496 HD23 ' O ' ' A' ' 47' ' ' GLU . 0.9 OUTLIER -70.64 -36.14 73.25 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.502 -0.317 . . . . 0.39000000000000001 111.363 -179.643 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.401 HD12 ' HG ' ' A' ' 48' ' ' LEU . 75.8 mt -65.68 -46.03 90.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.459 -0.337 . . . . 0.5 111.033 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.56 -34.45 78.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.393 -0.367 . . . . 0.58999999999999997 110.882 179.841 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -65.12 -47.12 78.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.136 -0.484 . . . . 2.54 110.691 179.778 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -79.0 -14.62 59.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.139 -0.482 . . . . 0.53000000000000003 111.383 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -71.33 -37.47 71.72 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.265 -0.425 . . . . 1.95 111.391 -179.556 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 30.5 p-10 -106.91 10.73 30.47 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.503 -0.317 . . . . 2.48 111.654 -179.372 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 24.0 t-20 -125.87 -11.99 6.54 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.91 0.386 . . . . 2.48 110.939 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -138.42 18.8 2.74 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.089 -0.505 . . . . 2.0499999999999998 110.599 179.764 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 21.6 m-80 64.6 -80.26 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 115.672 -0.694 . . . . 1.47 111.544 179.666 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -153.93 4.1 0.29 Allowed Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.502 -0.856 . . . . 0.42999999999999999 112.681 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.661 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -118.46 155.3 31.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.011 0.434 . . . . 0.38 111.271 179.88 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.658 ' HG ' ' HB2' ' A' ' 67' ' ' GLU . 2.4 tp -126.64 155.21 42.92 Favored 'General case' 0 C--O 1.223 -0.304 0 CA-C-N 115.778 -0.647 . . . . 1.4299999999999999 110.554 -179.389 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ASN . . . . . 0.477 ' OD1' ' HE3' ' A' ' 26' ' ' LYS . 0.7 OUTLIER -110.43 155.58 22.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.893 0.377 . . . . 1.1899999999999999 111.3 -179.113 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 82.0 t80 -44.93 -46.07 10.79 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.618 -0.719 . . . . 0.40000000000000002 111.424 179.869 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -64.3 -33.89 76.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.433 -0.349 . . . . 0.81000000000000005 111.926 -179.594 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.658 ' HB2' ' HG ' ' A' ' 63' ' ' LEU . 12.3 mm-40 -63.18 -55.84 21.73 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.778 0.323 . . . . 1.3600000000000001 110.446 179.901 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.466 ' HE2' ' HB2' ' A' ' 12' ' ' PHE . 41.6 t80 -59.93 -49.36 77.99 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.262 -0.426 . . . . 0.51000000000000001 110.337 179.142 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 1.7 t -53.22 -45.25 68.61 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.131 -0.486 . . . . 0.75 110.305 179.548 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -51.5 -47.14 52.24 Favored Glycine 0 N--CA 1.448 -0.512 0 N-CA-C 111.103 -0.799 . . . . 0.40999999999999998 111.103 179.135 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.528 HG23 ' HE3' ' A' ' 74' ' ' LYS . 14.1 mt -63.96 -40.99 91.05 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.45 0 CA-C-O 120.851 0.358 . . . . 0.51000000000000001 110.664 179.104 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' MET . . . . . 0.431 ' HG2' ' O ' ' A' ' 68' ' ' PHE . 95.3 mmm -51.82 -41.76 61.99 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.986 -0.552 . . . . 1.01 109.659 179.346 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.84 -55.35 35.26 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.561 -0.745 . . . . 0.69999999999999996 110.938 179.12 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.528 ' HE3' HG23 ' A' ' 71' ' ' ILE . 21.8 pttp -64.15 -25.95 68.31 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.422 -0.354 . . . . 1.3799999999999999 111.715 -179.411 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 22.3 tp60 -81.92 -33.7 30.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.352 0.596 . . . . 1.98 110.55 -179.865 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' MET . . . . . 0.535 ' HB3' ' HB3' ' A' ' 2' ' ' SER . 54.7 mtt -74.12 -19.45 60.57 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.055 -0.975 . . . . 1.2 111.053 -179.614 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 28.9 mmt180 -54.04 -19.0 4.14 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.112 -0.495 . . . . 4.6900000000000004 111.785 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -120.8 86.53 2.59 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.843 0.354 . . . . 4.0099999999999998 111.802 -179.595 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.486 HG22 ' O ' ' A' ' 76' ' ' MET . 14.9 t -176.31 2.01 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.104 -0.498 . . . . 5.2800000000000002 110.939 179.483 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.4 p-10 -70.09 -63.51 1.07 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.129 -0.487 . . . . 5.5999999999999996 111.489 -179.762 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.588 ' O ' ' HG2' ' A' ' 85' ' ' MET . 52.7 m 58.33 91.66 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.11 0 CA-C-N 116.352 -0.385 . . . . 7.29 110.374 -179.275 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -68.44 -25.12 64.85 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 112.857 0.688 . . . . 9.7400000000000002 112.857 -178.478 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 -54.35 -55.79 25.03 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 111.957 0.354 . . . . 12.109999999999999 111.957 -178.93 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -63.97 -20.82 66.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.949 0.404 . . . . 10.869999999999999 111.065 -179.743 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' MET . . . . . 0.632 ' HB3' HD11 ' A' ' 145' ' ' ILE . 4.7 mmm -79.89 -25.67 40.54 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.07 -0.514 . . . . 11.09 110.175 -179.336 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 29.2 ttt180 -74.19 -50.09 20.72 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.517 -0.765 . . . . 15.52 109.754 179.619 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -59.86 -36.45 76.9 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.826 -0.624 . . . . 14.85 109.512 178.864 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -72.16 -35.5 69.05 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-N 115.663 -0.698 . . . . 14.109999999999999 110.897 179.249 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -67.76 -20.57 65.24 Favored 'General case' 0 CA--C 1.52 -0.183 0 CA-C-O 121.326 0.584 . . . . 15.73 110.093 179.49 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 15.6 tttt -79.91 -47.13 15.55 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 115.298 -0.865 . . . . 17.66 110.169 179.775 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 73.7 mt -64.29 -43.47 97.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.496 -0.775 . . . . 18.149999999999999 111.111 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.536 ' HD1' HG11 ' A' ' 108' ' ' VAL . 5.5 m-85 -66.82 -52.66 41.13 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.271 -0.422 . . . . 18.34 111.025 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -59.63 99.83 0.07 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.303 -0.408 . . . . 19.289999999999999 110.386 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.522 ' HG2' ' HB3' ' A' ' 104' ' ' GLU . 22.4 mmm180 -53.04 -37.2 61.37 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.859 -0.61 . . . . 22.25 111.316 -179.393 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -107.84 -176.73 3.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.9 0.381 . . . . 23.34 111.09 -179.697 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.77 4.26 56.25 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.944 -0.646 . . . . 22.0 112.631 179.754 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -63.66 -31.25 72.37 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.64 0.257 . . . . 22.280000000000001 111.29 -179.761 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 92.89 35.18 6.49 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.791 -0.718 . . . . 19.93 112.83 179.771 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' PHE . . . . . 0.425 ' HA ' ' O ' ' A' ' 136' ' ' ILE . 96.6 m-85 -147.54 142.27 26.7 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.638 0.256 . . . . 20.300000000000001 110.811 179.857 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 59.6 mt -114.35 125.83 71.74 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.162 0 CA-C-O 121.054 0.454 . . . . 19.370000000000001 110.998 179.672 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 23.5 p -114.48 156.07 45.07 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 115.793 -0.639 . . . . 22.489999999999998 110.626 -179.843 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_exo -39.95 -35.61 1.16 Allowed 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.608 2.206 . . . . 23.0 112.681 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.07 -53.43 25.63 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.254 -0.43 . . . . 24.559999999999999 110.973 179.782 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.522 ' HB3' ' HG2' ' A' ' 94' ' ' ARG . 46.8 mt-10 -62.29 -38.78 90.66 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.872 -0.604 . . . . 22.23 110.55 179.87 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.54 HD23 ' HB ' ' A' ' 121' ' ' ILE . 39.9 tp -64.48 -35.6 81.47 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.541 -0.754 . . . . 20.359999999999999 110.869 -179.892 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 10.4 ttp180 -63.97 -52.53 59.25 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.343 -0.389 . . . . 27.190000000000001 110.858 179.69 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 35.7 t80 -54.27 -47.92 71.79 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.088 -0.506 . . . . 25.359999999999999 111.563 -179.407 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.536 HG11 ' HD1' ' A' ' 92' ' ' PHE . 7.7 p -70.77 -46.98 66.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 N-CA-C 112.144 0.424 . . . . 21.059999999999999 112.144 -179.14 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.516 ' N ' HG13 ' A' ' 108' ' ' VAL . 0.4 OUTLIER -57.2 -20.68 28.37 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 111.728 0.27 . . . . 20.93 111.728 -179.018 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.589 ' HA ' ' HA ' ' A' ' 114' ' ' GLU . 83.0 mt -82.67 -28.71 8.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 120.943 0.402 . . . . 25.129999999999999 110.353 178.915 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -73.87 -36.21 64.79 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.103 -0.499 . . . . 23.32 109.904 178.765 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.47 HD13 HG22 ' A' ' 108' ' ' VAL . 7.0 mp -85.85 -41.69 14.78 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.648 -0.705 . . . . 21.07 109.762 179.223 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -148.93 80.83 0.2 Allowed Glycine 0 C--N 1.33 0.235 0 CA-C-N 115.33 -0.85 . . . . 23.050000000000001 111.769 179.498 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.589 ' HA ' ' HA ' ' A' ' 110' ' ' ILE . 0.0 OUTLIER -48.14 160.48 0.15 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.064 0.459 . . . . 22.59 112.136 -179.356 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 23.6 ttmm 70.67 62.97 0.19 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.238 -0.892 . . . . 27.960000000000001 111.858 179.488 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 116' ' ' VAL . . . . . 0.495 HG12 ' OE1' ' A' ' 120' ' ' GLU . 1.6 m -125.81 114.73 40.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.165 -0.47 . . . . 24.75 110.625 178.286 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 72.7 p -67.51 147.42 52.84 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.295 -0.411 . . . . 27.239999999999998 110.419 179.8 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 28.8 m-20 -56.3 -14.73 3.09 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.208 -0.451 . . . . 26.629999999999999 110.581 179.804 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.4 ' O ' ' HG2' ' A' ' 123' ' ' GLU . 12.6 mm-40 -79.7 -55.17 5.2 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.032 -0.531 . . . . 29.140000000000001 111.249 -179.876 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.495 ' OE1' HG12 ' A' ' 116' ' ' VAL . 14.0 pt-20 -58.57 -42.56 88.25 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.748 -0.205 . . . . 24.190000000000001 111.46 -179.576 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.54 ' HB ' HD23 ' A' ' 105' ' ' LEU . 2.7 pt -68.37 -42.92 84.5 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-O 120.643 0.259 . . . . 22.329999999999998 111.144 179.487 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.513 ' H ' HG13 ' A' ' 121' ' ' ILE . 17.8 t70 -60.24 -40.42 90.17 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.826 0.346 . . . . 24.289999999999999 110.444 179.666 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.4 ' HG2' ' O ' ' A' ' 119' ' ' GLU . 16.5 mm-40 -58.34 -46.05 86.96 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.002 -0.545 . . . . 24.739999999999998 110.201 179.382 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.42 ' HE1' HD11 ' A' ' 105' ' ' LEU . 58.9 ttp -55.54 -37.17 67.62 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.214 -0.448 . . . . 19.710000000000001 110.328 179.195 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.5 HG23 HD11 ' A' ' 136' ' ' ILE . 78.6 mt -65.92 -42.38 91.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.049 -0.523 . . . . 19.949999999999999 110.337 179.341 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 21.4 tpp180 -63.43 -25.26 68.19 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.806 -0.634 . . . . 24.949999999999999 111.042 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -78.53 -30.02 46.81 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.229 -0.441 . . . . 18.690000000000001 111.308 -179.535 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.709 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -99.73 -12.39 20.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.309 -0.405 . . . . 16.469999999999999 111.479 -179.689 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 129' ' ' ASP . . . . . 0.457 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 25.4 t0 -100.68 104.03 15.31 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.977 0.418 . . . . 20.399999999999999 110.906 -179.615 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 88.1 m-85 -82.79 -39.46 21.74 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.962 -0.563 . . . . 21.43 111.174 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -69.07 -13.35 62.39 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.381 -0.372 . . . . 23.370000000000001 111.007 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 47.63 82.38 0.03 OUTLIER Glycine 0 C--N 1.331 0.256 0 C-N-CA 121.19 -0.528 . . . . 24.32 113.212 179.629 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -133.22 -24.49 1.84 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.846 0.355 . . . . 23.879999999999999 110.617 179.579 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 105.84 10.62 30.16 Favored Glycine 0 C--N 1.332 0.321 0 C-N-CA 120.794 -0.717 . . . . 22.670000000000002 112.562 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 91.1 mmm -135.37 150.42 49.92 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.805 0.336 . . . . 22.91 110.756 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.587 HG23 ' HB2' ' A' ' 140' ' ' GLU . 46.9 mm -114.83 141.17 32.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.037 0.446 . . . . 18.41 111.486 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 137' ' ' ASN . . . . . 0.451 ' O ' ' N ' ' A' ' 139' ' ' GLU . 29.2 p-10 -114.78 157.51 23.13 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.002 -0.74 . . . . 16.82 109.002 178.405 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.566 ' O ' HG23 ' A' ' 142' ' ' VAL . 42.4 t80 -40.59 -21.51 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 111.97 0.359 . . . . 14.65 111.97 -179.754 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.451 ' N ' ' O ' ' A' ' 137' ' ' ASN . 44.2 mt-10 -80.76 -56.76 3.92 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.786 0.327 . . . . 14.82 111.261 -179.615 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.587 ' HB2' HG23 ' A' ' 136' ' ' ILE . 45.5 mt-10 -61.16 -29.82 70.02 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 121.0 0.429 . . . . 17.460000000000001 110.102 179.93 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.562 ' CE2' HD13 ' A' ' 145' ' ' ILE . 83.9 t80 -67.09 -55.52 13.93 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.848 -0.614 . . . . 12.93 110.186 179.403 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.566 HG23 ' O ' ' A' ' 138' ' ' TYR . 42.9 t -51.42 -30.77 11.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.667 -0.697 . . . . 10.699999999999999 111.392 179.811 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 143' ' ' TRP . . . . . 0.495 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 90.3 t90 -70.65 -55.84 7.82 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.496 0.554 . . . . 13.66 112.496 -179.122 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 144' ' ' MET . . . . . 0.709 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 18.8 ptt? -63.48 -28.79 70.2 Favored 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 113.272 0.842 . . . . 14.5 113.272 -177.771 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 145' ' ' ILE . . . . . 0.632 HD11 ' HB3' ' A' ' 85' ' ' MET . 42.8 pt -80.76 -35.9 15.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 112.383 0.512 . . . . 11.25 112.383 -179.304 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 146' ' ' SER . . . . . 0.493 ' N ' HG13 ' A' ' 145' ' ' ILE . 42.0 t -60.69 -14.12 18.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.198 0.523 . . . . 8.5399999999999991 110.432 -179.679 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 147' ' ' GLN . . . . . 0.495 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 4.0 mm-40 -101.04 -16.22 17.19 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.362 -0.835 . . . . 11.869999999999999 111.089 -179.053 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 65.1 mttm . . . . . 0 C--O 1.25 1.111 0 CA-C-O 118.296 -0.859 . . . . 13.68 110.829 179.685 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 149' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 151' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 76.4 p . . . . . 0 N--CA 1.486 1.334 0 CA-C-O 120.834 0.35 . . . . 4.8899999999999997 110.881 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -80.95 167.17 20.15 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.223 -0.444 . . . . 3.2599999999999998 110.89 179.896 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.5 mp -53.12 102.64 0.06 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.956 -0.565 . . . . 1.27 110.961 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 6.8 m -90.49 158.89 16.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.034 -0.53 . . . . 1.1200000000000001 110.565 179.853 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -47.34 -42.83 22.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.709 0.29 . . . . 2.2000000000000002 111.63 -179.651 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -73.32 -41.41 63.56 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.033 0.444 . . . . 1.3500000000000001 111.005 -179.476 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 80.3 mt-30 -63.99 -40.43 96.36 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.833 -0.622 . . . . 2.2200000000000002 111.001 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.496 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 89.2 mt -62.11 -50.79 78.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.117 -0.492 . . . . 0.54000000000000004 110.628 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.41 -24.81 67.6 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.001 -0.545 . . . . 0.5 111.366 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -69.91 -56.35 7.27 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.39 -0.368 . . . . 2.27 111.939 -179.033 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.496 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 10.5 p90 -78.4 -28.07 46.81 Favored 'General case' 0 C--N 1.332 -0.155 0 C-N-CA 120.603 -0.439 . . . . 0.37 111.009 -179.532 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 21.2 tptm -62.65 -35.62 80.2 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.153 -0.684 . . . . 1.23 109.153 178.669 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.472 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 33.1 t70 -69.44 -50.12 48.66 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 115.706 -0.679 . . . . 0.44 109.179 178.315 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.27 -17.67 54.63 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.68 -0.691 . . . . 0.28999999999999998 110.574 179.058 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -77.96 -48.21 16.78 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.003 -0.544 . . . . 0.47999999999999998 110.638 -179.495 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 23.3 m -70.32 -15.85 19.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.146 -0.479 . . . . 1.1100000000000001 110.532 179.648 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.472 ' HG3' ' O ' ' A' ' 14' ' ' ASP . 73.2 mt-30 -64.01 -44.53 92.3 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.787 -0.642 . . . . 1.6000000000000001 111.111 179.326 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -90.39 31.16 1.04 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.16 -0.473 . . . . 0.64000000000000001 111.71 -179.298 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -118.96 70.96 0.84 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.001 0.429 . . . . 0.44 110.4 179.284 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 33.7 mmtp -76.5 -17.63 59.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.866 -0.606 . . . . 2.1000000000000001 111.205 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -83.05 -10.94 58.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.212 -0.449 . . . . 1.8 110.907 -179.936 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 65.44 14.3 59.72 Favored Glycine 0 C--N 1.33 0.236 0 C-N-CA 120.869 -0.681 . . . . 0.46000000000000002 112.648 179.874 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 30.0 p -83.74 11.86 6.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.671 0.272 . . . . 0.40000000000000002 111.205 -179.929 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 56.22 18.88 22.3 Favored Glycine 0 C--N 1.332 0.361 0 C-N-CA 120.709 -0.758 . . . . 0.33000000000000002 111.596 -179.383 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.633 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 51.7 mtpt -135.43 155.26 50.84 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.501 -0.35 . . . . 1.1000000000000001 110.334 -179.488 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.421 ' N ' HE22 ' A' ' 62' ' ' GLN . 42.4 pt -120.9 140.65 44.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.871 0.367 . . . . 0.5 111.286 -179.799 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -57.97 135.95 57.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.153 -0.476 . . . . 0.29999999999999999 110.612 179.651 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.418 ' HA ' HD23 ' A' ' 63' ' ' LEU . 5.7 t -64.69 -8.56 15.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.19 -0.459 . . . . 1.03 110.994 179.808 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 43.5 mtt180 -89.76 -11.21 42.89 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.043 -0.526 . . . . 3.0800000000000001 110.851 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -107.57 -4.58 18.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.92 -0.582 . . . . 2.2599999999999998 110.908 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.647 HD23 HD21 ' A' ' 63' ' ' LEU . 1.4 tm? -57.72 -51.0 71.32 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.355 -0.384 . . . . 1.3700000000000001 110.311 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -53.59 -42.71 67.25 Favored Glycine 0 C--N 1.332 0.344 0 C-N-CA 120.617 -0.801 . . . . 0.32000000000000001 111.692 179.438 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 94.9 m -63.88 -36.07 82.73 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.226 0.536 . . . . 0.31 109.868 179.038 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 38.8 tp -65.94 -24.05 66.74 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.369 -0.832 . . . . 1.24 110.773 -179.921 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.462 ' HG2' ' O ' ' A' ' 32' ' ' LEU . 79.9 mmm -80.36 -37.87 31.53 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.252 -0.431 . . . . 1.1000000000000001 110.19 179.346 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 69.6 mtp180 -59.64 -44.34 93.53 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.942 -0.572 . . . . 2.6899999999999999 110.964 179.89 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.426 HG23 HD13 ' A' ' 39' ' ' LEU . 1.3 t -64.23 -13.52 49.61 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.235 -0.439 . . . . 1.0600000000000001 111.321 179.835 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.426 HD13 HG23 ' A' ' 38' ' ' THR . 10.8 mp -113.75 156.14 24.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.115 -0.493 . . . . 1.26 110.412 179.365 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -58.35 -5.69 2.67 Favored Glycine 0 CA--C 1.518 0.255 0 CA-C-N 116.014 -0.539 . . . . 0.68999999999999995 113.759 -178.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 15.9 mp0 -88.29 130.91 34.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 117.107 0.453 . . . . 1.97 110.972 179.746 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -131.88 87.05 46.06 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.092 -0.503 . . . . 2.6600000000000001 110.775 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -70.47 151.37 64.98 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 122.511 2.141 . . . . 0.51000000000000001 112.275 -179.839 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 27.4 m -64.35 150.06 46.99 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.22 -0.445 . . . . 0.72999999999999998 110.738 179.746 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -48.07 -54.51 12.86 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.562 -0.29 . . . . 2.7000000000000002 111.336 -179.631 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.57 -53.27 54.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.264 -0.426 . . . . 0.46000000000000002 111.745 -179.574 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -53.79 -46.03 70.9 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-O 120.938 0.399 . . . . 2.23 110.446 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.569 HD12 HD11 ' A' ' 51' ' ' LEU . 32.5 tp -57.27 -42.69 82.12 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.741 -0.663 . . . . 1.3600000000000001 110.71 179.837 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -68.46 -30.19 69.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.227 -0.442 . . . . 1.22 111.095 -179.8 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -68.45 -53.55 22.81 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.382 -0.372 . . . . 0.62 110.965 179.551 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.569 HD11 HD12 ' A' ' 48' ' ' LEU . 1.0 OUTLIER -65.38 -34.87 79.34 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.318 -0.401 . . . . 0.39000000000000001 110.979 179.931 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 34.9 mt -59.78 -44.73 94.58 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.134 0 CA-C-N 116.523 -0.308 . . . . 0.5 110.458 179.467 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.68 -32.47 73.81 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.236 -0.438 . . . . 0.58999999999999997 110.53 179.624 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -66.53 -46.04 77.48 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.007 -0.542 . . . . 2.54 110.178 179.352 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 0.433 ' HB1' ' HB3' ' A' ' 63' ' ' LEU . . . -76.21 -20.76 57.17 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.014 -0.539 . . . . 0.53000000000000003 111.078 179.585 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -80.35 -31.74 37.89 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.277 -0.42 . . . . 1.95 110.985 -179.88 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -91.98 -12.95 31.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.053 -0.522 . . . . 2.48 110.763 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 30.4 t-20 -81.2 -84.02 0.11 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.098 -0.501 . . . . 2.48 110.785 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ASN . . . . . 0.492 ' HB2' ' O ' ' A' ' 62' ' ' GLN . 15.7 m-80 -101.54 35.97 2.16 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.885 0.374 . . . . 2.0499999999999998 110.805 -179.914 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 11.6 m-20 62.27 -132.82 0.55 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.883 -0.599 . . . . 1.47 111.116 179.62 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -78.71 29.65 2.04 Favored Glycine 0 C--N 1.334 0.419 0 C-N-CA 120.638 -0.791 . . . . 0.42999999999999999 112.526 -179.706 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.633 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -145.1 155.32 43.25 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.17 0.51 . . . . 0.38 111.338 179.829 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.647 HD21 HD23 ' A' ' 32' ' ' LEU . 2.1 pp -142.07 157.93 44.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.442 -0.799 . . . . 1.4299999999999999 109.084 179.529 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ASN . . . . . 0.482 ' OD1' ' HE3' ' A' ' 26' ' ' LYS . 0.7 OUTLIER -110.23 157.37 19.51 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.74 -0.384 . . . . 1.1899999999999999 111.856 -177.411 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -39.28 -33.47 0.15 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.476 -0.784 . . . . 0.40000000000000002 111.846 -179.794 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 2.8 m -64.25 -43.9 93.47 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 111.663 0.245 . . . . 0.81000000000000005 111.663 -179.582 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.535 ' HB2' HD13 ' A' ' 63' ' ' LEU . 22.7 mm-40 -61.96 -55.14 32.49 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.853 0.359 . . . . 1.3600000000000001 110.958 179.818 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -59.39 -49.7 76.78 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.041 -0.527 . . . . 0.51000000000000001 111.376 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 6.3 t -61.14 -39.24 89.3 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-O 120.869 0.366 . . . . 0.75 110.692 -179.978 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' GLY . . . . . 0.528 ' O ' ' HB3' ' A' ' 73' ' ' ALA . . . -60.08 -42.86 98.65 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.648 -0.787 . . . . 0.40999999999999998 111.85 179.783 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.56 HD13 HD13 ' A' ' 51' ' ' LEU . 64.8 mt -63.59 -51.23 72.92 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.688 0 CA-C-O 121.657 0.742 . . . . 0.51000000000000001 109.294 177.997 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' MET . . . . . 0.497 ' O ' ' HB2' ' A' ' 76' ' ' MET . 14.2 mtp -53.73 -29.63 40.36 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.027 -0.988 . . . . 1.01 108.729 178.375 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.528 ' HB3' ' O ' ' A' ' 70' ' ' GLY . . . -72.14 -35.39 69.06 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.12 -0.945 . . . . 0.69999999999999996 110.623 179.866 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.555 ' HG2' ' O ' ' A' ' 71' ' ' ILE . 0.1 OUTLIER -80.34 -32.83 37.75 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.338 -0.392 . . . . 1.3799999999999999 111.73 -179.724 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -82.71 -42.72 17.72 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.082 0.468 . . . . 1.98 111.195 -178.882 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' MET . . . . . 0.497 ' HB2' ' O ' ' A' ' 72' ' ' MET . 80.7 mtp -69.89 -55.33 10.0 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.574 -0.739 . . . . 1.2 112.005 -179.299 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 80.6 mtt180 -61.4 -13.95 24.08 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.648 0.261 . . . . 4.6900000000000004 111.328 -179.296 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -60.07 -17.28 38.36 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.328 -0.396 . . . . 4.0099999999999998 111.381 -179.981 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.457 HG22 ' O ' ' A' ' 76' ' ' MET . 8.4 t -89.63 -15.17 33.31 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 111.953 0.353 . . . . 5.2800000000000002 111.953 -179.189 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.76 -23.16 67.06 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.569 -0.287 . . . . 5.5999999999999996 110.858 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.509 ' O ' ' HG2' ' A' ' 85' ' ' MET . 3.9 t 34.98 65.66 0.35 Allowed 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 116.058 -0.519 . . . . 7.29 111.298 -179.567 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -47.32 -24.23 0.72 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.51 -0.768 . . . . 9.7400000000000002 112.3 -179.138 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -64.14 -55.28 22.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.753 0.311 . . . . 12.109999999999999 111.391 -179.78 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -64.03 -18.3 64.19 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.379 -0.373 . . . . 10.869999999999999 110.908 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' MET . . . . . 0.554 ' HB3' HD11 ' A' ' 145' ' ' ILE . 4.1 mmm -78.81 -48.03 15.55 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.104 -0.498 . . . . 11.09 110.059 -179.662 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 21.0 ttt180 -55.71 -39.0 70.45 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.517 -0.765 . . . . 15.52 110.134 179.272 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -65.2 -47.66 76.15 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.989 -0.551 . . . . 14.85 110.228 179.158 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -65.57 -24.26 67.05 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.057 -0.52 . . . . 14.109999999999999 111.332 179.781 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 86.7 t80 -73.83 -46.91 42.18 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.95 0.405 . . . . 15.73 110.852 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -60.65 -38.31 84.42 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.991 -0.549 . . . . 17.66 110.866 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 67.7 mt -70.98 -46.27 68.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.863 -0.608 . . . . 18.149999999999999 111.166 -179.631 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.514 ' HA ' HG21 ' A' ' 108' ' ' VAL . 0.7 OUTLIER -66.96 -26.67 66.94 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.382 -0.372 . . . . 18.34 111.099 -179.885 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 23.7 t0 -96.16 93.92 7.21 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.153 -0.476 . . . . 19.289999999999999 110.237 179.69 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -69.61 -11.46 60.85 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.083 -0.508 . . . . 22.25 111.354 -179.386 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 47.8 m-20 -101.71 167.75 9.9 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.341 -0.391 . . . . 23.34 110.94 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.07 5.18 57.66 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.842 -0.694 . . . . 22.0 112.072 179.513 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -70.84 -31.47 68.19 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.682 0.277 . . . . 22.280000000000001 111.267 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 92.37 27.25 15.81 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.686 -0.768 . . . . 19.93 112.519 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 90.1 m-85 -139.47 147.23 41.04 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.498 0.19 . . . . 20.300000000000001 110.632 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.466 ' HB ' ' HB ' ' A' ' 136' ' ' ILE . 71.1 mt -113.92 131.37 66.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 121.149 0.5 . . . . 19.370000000000001 111.223 179.789 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 79.4 p -114.02 157.8 41.09 Favored Pre-proline 0 C--N 1.326 -0.42 0 CA-C-N 115.509 -0.769 . . . . 22.489999999999998 110.049 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_exo -47.94 -31.55 15.9 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.068 1.845 . . . . 23.0 111.676 -179.658 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.57 -36.86 79.33 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.726 -0.67 . . . . 24.559999999999999 111.11 179.668 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.431 ' O ' HG23 ' A' ' 108' ' ' VAL . 39.0 mt-10 -80.26 -36.68 34.23 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.938 -0.574 . . . . 22.23 109.889 -179.477 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.563 HD22 ' HB ' ' A' ' 121' ' ' ILE . 5.5 tt -62.12 -43.57 98.54 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.331 -0.85 . . . . 20.359999999999999 110.267 179.859 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.432 ' O ' HG13 ' A' ' 110' ' ' ILE . 61.1 ttt180 -65.59 -54.63 25.24 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.933 -0.576 . . . . 27.190000000000001 110.89 179.783 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 4.3 m-85 -49.38 -49.46 44.46 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.137 -0.483 . . . . 25.359999999999999 111.973 -179.454 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.514 HG21 ' HA ' ' A' ' 92' ' ' PHE . 83.6 t -64.46 -50.72 74.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.695 -0.23 . . . . 21.059999999999999 111.557 -179.475 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.464 ' HG3' HD23 ' A' ' 105' ' ' LEU . 0.3 OUTLIER -53.15 -39.22 63.38 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.741 0.305 . . . . 20.93 110.739 -179.951 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.432 HG13 ' O ' ' A' ' 106' ' ' ARG . 82.7 mt -70.74 -29.59 38.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 120.999 0.428 . . . . 25.129999999999999 110.28 179.329 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -71.13 -39.73 71.83 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.828 -0.624 . . . . 23.32 110.741 179.604 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.433 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 38.2 mt -65.33 -32.57 74.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.043 -0.526 . . . . 21.07 110.664 179.879 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 126.87 -11.98 6.92 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.828 -0.701 . . . . 23.050000000000001 112.271 -179.854 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -91.06 114.49 27.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.743 0.306 . . . . 22.59 111.127 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.43 ' HD3' ' N ' ' A' ' 115' ' ' LYS . 3.8 mppt? -84.08 125.65 32.32 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.225 -0.443 . . . . 27.960000000000001 110.779 179.848 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 116' ' ' VAL . . . . . 0.403 HG12 ' OE1' ' A' ' 120' ' ' GLU . 2.4 m -135.57 147.27 28.79 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.241 -0.436 . . . . 24.75 111.44 -179.951 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 82.2 p -87.99 147.24 25.11 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.935 -0.575 . . . . 27.239999999999998 110.198 179.105 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' ASP . . . . . 0.408 ' O ' ' HB2' ' A' ' 122' ' ' ASP . 8.1 m-20 -53.64 -19.93 4.63 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.259 -0.428 . . . . 26.629999999999999 111.576 -179.529 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 23.1 mm-40 -77.61 -55.69 5.15 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.01 0.374 . . . . 29.140000000000001 112.01 -179.264 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.403 ' OE1' HG12 ' A' ' 116' ' ' VAL . 14.6 pt-20 -58.47 -41.69 85.82 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.636 0.255 . . . . 24.190000000000001 111.563 -179.306 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.563 ' HB ' HD22 ' A' ' 105' ' ' LEU . 45.7 pt -70.74 -33.59 53.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 C-N-CA 120.903 -0.319 . . . . 22.329999999999998 110.749 179.67 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.408 ' HB2' ' O ' ' A' ' 118' ' ' ASP . 16.2 t70 -56.03 -50.98 69.41 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 120.768 0.318 . . . . 24.289999999999999 110.617 179.401 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.55 -43.35 99.02 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.204 -0.453 . . . . 24.739999999999998 110.736 179.797 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 51.0 ttp -54.66 -38.6 67.13 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.174 -0.466 . . . . 19.710000000000001 110.915 179.65 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.551 HG23 HD11 ' A' ' 136' ' ' ILE . 85.0 mt -68.47 -37.07 77.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.232 -0.44 . . . . 19.949999999999999 110.742 179.682 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 70.3 ttt180 -65.94 -30.08 70.59 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.155 -0.475 . . . . 24.949999999999999 110.637 179.677 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -74.67 -24.86 58.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.077 -0.511 . . . . 18.690000000000001 111.173 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.613 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -100.58 -13.63 18.52 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.183 -0.462 . . . . 16.469999999999999 111.118 179.855 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -97.14 105.31 17.43 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.052 -0.522 . . . . 20.399999999999999 110.931 -179.684 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 -97.96 -33.94 11.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.931 -0.577 . . . . 21.43 111.153 -179.651 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -66.02 -13.86 60.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.365 -0.38 . . . . 23.370000000000001 110.777 -179.835 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.13 85.31 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.834 -0.698 . . . . 24.32 112.521 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -153.8 -19.53 0.14 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.661 0.267 . . . . 23.879999999999999 111.475 -179.84 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 87.21 16.25 61.09 Favored Glycine 0 N--CA 1.453 -0.211 0 C-N-CA 120.67 -0.776 . . . . 22.670000000000002 112.6 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 70.3 mtp -132.72 155.54 48.65 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.625 0.25 . . . . 22.91 110.539 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.742 HG23 ' HB2' ' A' ' 140' ' ' GLU . 50.5 mm -114.61 138.65 44.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.367 0.604 . . . . 18.41 112.076 -179.238 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 137' ' ' ASN . . . . . 0.472 ' O ' ' N ' ' A' ' 139' ' ' GLU . 21.8 p30 -115.5 159.06 21.69 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.194 -0.912 . . . . 16.82 108.644 177.893 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.611 ' O ' HG23 ' A' ' 142' ' ' VAL . 47.0 t80 -38.21 -24.67 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 112.416 0.524 . . . . 14.65 112.416 -178.789 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.472 ' N ' ' O ' ' A' ' 137' ' ' ASN . 47.2 mt-10 -80.44 -55.27 5.0 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.742 0.306 . . . . 14.82 111.19 -179.636 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.742 ' HB2' HG23 ' A' ' 136' ' ' ILE . 30.2 mt-10 -60.69 -28.4 68.6 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.319 -0.4 . . . . 17.460000000000001 110.738 -179.851 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.681 ' HA ' ' HE2' ' A' ' 144' ' ' MET . 86.5 t80 -72.46 -56.12 5.93 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.292 -0.413 . . . . 12.93 110.703 179.841 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.611 HG23 ' O ' ' A' ' 138' ' ' TYR . 50.3 t -48.32 -37.01 7.09 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 CA-C-N 115.939 -0.573 . . . . 10.699999999999999 111.589 179.478 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 143' ' ' TRP . . . . . 0.522 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 92.7 t90 -71.11 -55.58 7.91 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.296 0.48 . . . . 13.66 112.296 -178.872 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 144' ' ' MET . . . . . 0.681 ' HE2' ' HA ' ' A' ' 141' ' ' PHE . 22.8 ptt? -63.11 -24.38 67.87 Favored 'General case' 0 N--CA 1.464 0.237 0 N-CA-C 112.957 0.725 . . . . 14.5 112.957 -177.808 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 145' ' ' ILE . . . . . 0.554 HD11 ' HB3' ' A' ' 85' ' ' MET . 48.6 pt -80.73 -40.48 19.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 N-CA-C 112.182 0.438 . . . . 11.25 112.182 -179.513 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 146' ' ' SER . . . . . 0.521 ' N ' HG13 ' A' ' 145' ' ' ILE . 86.4 p -59.38 -13.61 9.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.275 0.559 . . . . 8.5399999999999991 110.436 -179.759 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 147' ' ' GLN . . . . . 0.522 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 1.6 mm100 -105.34 26.71 9.08 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.304 -0.862 . . . . 11.869999999999999 111.529 -178.692 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 9.6 mtmp? . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.158 -0.925 . . . . 13.68 110.721 179.593 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 149' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 151' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 44.7 t . . . . . 0 N--CA 1.485 1.278 0 CA-C-O 120.744 0.307 . . . . 4.8899999999999997 110.983 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -152.74 76.29 1.13 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.239 -0.437 . . . . 3.2599999999999998 111.217 -179.828 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 20.1 mt -58.22 108.02 0.56 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.276 -0.42 . . . . 1.27 110.806 179.854 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 6.2 m -84.0 158.99 21.31 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.139 -0.482 . . . . 1.1200000000000001 110.801 -179.9 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -47.63 -30.84 4.0 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 111.818 0.303 . . . . 2.2000000000000002 111.818 -179.624 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.413 ' HG3' ' N ' ' A' ' 8' ' ' GLN . 11.0 pt-20 -76.58 -51.29 11.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.947 0.403 . . . . 1.3500000000000001 110.916 -179.567 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.413 ' N ' ' HG3' ' A' ' 7' ' ' GLU . 86.0 mt-30 -63.18 -36.08 82.44 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.025 -0.534 . . . . 2.2200000000000002 110.682 179.924 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.559 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 97.1 mt -62.68 -52.09 63.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.959 -0.564 . . . . 0.54000000000000004 110.65 179.859 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.25 -26.48 67.78 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.888 -0.596 . . . . 0.5 111.4 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -69.61 -56.93 5.91 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 111.889 0.329 . . . . 2.27 111.889 -179.161 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.559 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 4.1 p90 -76.47 -23.6 53.83 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 120.54 -0.464 . . . . 0.37 110.92 -179.557 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.442 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 18.1 tptm -66.33 -35.59 80.76 Favored 'General case' 0 C--N 1.332 -0.163 0 N-CA-C 109.145 -0.687 . . . . 1.23 109.145 178.911 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.44 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 23.5 t70 -68.03 -49.82 59.1 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 108.777 -0.823 . . . . 0.44 108.777 177.995 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.28 -13.95 52.82 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.303 -0.862 . . . . 0.28999999999999998 110.453 178.824 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.519 ' HA ' HD11 ' A' ' 35' ' ' LEU . 83.4 t80 -79.65 -48.9 12.96 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.842 -0.617 . . . . 0.47999999999999998 110.823 -179.629 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 19.7 m -67.89 -20.88 26.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 120.974 0.416 . . . . 1.1100000000000001 110.415 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.44 ' HG2' ' O ' ' A' ' 14' ' ' ASP . 77.6 mm-40 -60.36 -32.82 71.63 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.827 -0.624 . . . . 1.6000000000000001 111.455 179.334 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 82.3 m-85 -93.93 4.02 54.52 Favored 'General case' 0 N--CA 1.463 0.191 0 N-CA-C 111.721 0.267 . . . . 0.64000000000000001 111.721 -179.578 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -101.79 87.21 3.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.002 0.43 . . . . 0.44 110.672 179.672 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -97.4 -15.0 20.88 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.9 -0.591 . . . . 2.1000000000000001 111.322 -179.878 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -83.58 1.14 43.58 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.225 -0.443 . . . . 1.8 111.365 -179.547 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 63.67 16.07 58.43 Favored Glycine 0 C--N 1.331 0.268 0 C-N-CA 120.987 -0.625 . . . . 0.46000000000000002 113.032 179.645 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 46.1 p -92.65 8.34 39.55 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.642 0.258 . . . . 0.40000000000000002 111.124 179.838 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 57.1 18.19 26.35 Favored Glycine 0 C--N 1.331 0.304 0 C-N-CA 120.823 -0.703 . . . . 0.33000000000000002 111.822 -179.677 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.492 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 35.7 mtpt -127.4 155.54 43.47 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.82 0.343 . . . . 1.1000000000000001 111.06 -179.512 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.445 ' N ' HE22 ' A' ' 62' ' ' GLN . 43.6 pt -116.67 134.72 59.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.272 -0.422 . . . . 0.5 111.601 -179.711 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -53.47 138.91 32.49 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.083 -0.508 . . . . 0.29999999999999999 111.282 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.585 ' HA ' HD11 ' A' ' 63' ' ' LEU . 7.7 t -68.98 -5.39 21.35 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.073 -0.512 . . . . 1.03 111.161 -179.901 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 49.6 mtp180 -97.53 4.93 50.22 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.954 -0.566 . . . . 3.0800000000000001 110.385 179.717 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -128.7 -1.49 5.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.864 -0.607 . . . . 2.2599999999999998 110.824 -179.862 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.461 HD21 ' CD1' ' A' ' 68' ' ' PHE . 2.6 tm? -55.3 -54.15 47.11 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.158 -0.474 . . . . 1.3700000000000001 110.495 179.834 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.411 ' O ' ' HG3' ' A' ' 37' ' ' ARG . . . -56.01 -42.25 86.59 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.578 -0.82 . . . . 0.32000000000000001 111.815 179.433 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 56.6 m -55.63 -37.19 67.86 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.023 0.44 . . . . 0.31 110.256 179.291 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.519 HD11 ' HA ' ' A' ' 16' ' ' PHE . 1.2 tt -65.36 -36.23 83.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.681 -0.69 . . . . 1.24 110.031 179.386 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.495 ' SD ' ' HG3' ' A' ' 43' ' ' PRO . 25.1 mtp -78.2 -20.35 52.04 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.788 -0.642 . . . . 1.1000000000000001 110.853 179.887 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.411 ' HG3' ' O ' ' A' ' 33' ' ' GLY . 62.3 mtp180 -77.57 -38.52 48.28 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.315 -0.402 . . . . 2.6899999999999999 110.498 179.527 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.444 HG23 ' CD1' ' A' ' 39' ' ' LEU . 1.5 t -71.39 -13.31 61.81 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.222 -0.444 . . . . 1.0600000000000001 110.943 179.588 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.449 ' HB3' ' OE1' ' A' ' 41' ' ' GLN . 10.9 mp -113.28 156.23 23.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.096 -0.502 . . . . 1.26 110.701 179.691 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -49.5 -20.69 2.67 Favored Glycine 0 CA--C 1.521 0.46 0 CA-C-N 115.679 -0.691 . . . . 0.68999999999999995 114.303 -178.824 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.449 ' OE1' ' HB3' ' A' ' 39' ' ' LEU . 20.0 mp0 -60.78 139.06 58.04 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 117.382 0.591 . . . . 1.97 111.09 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 74.9 m-20 -130.97 78.51 73.32 Favored Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 116.179 -0.464 . . . . 2.6600000000000001 110.966 179.851 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.495 ' HG3' ' SD ' ' A' ' 36' ' ' MET . 59.9 Cg_endo -68.97 147.59 68.3 Favored 'Trans proline' 0 C--N 1.343 0.259 0 C-N-CA 122.767 2.311 . . . . 0.51000000000000001 112.256 179.757 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 63.5 m -68.9 143.34 54.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.339 -0.391 . . . . 0.72999999999999998 110.59 179.505 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.47 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 8.9 tp10 -47.93 -55.32 10.2 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.612 0.244 . . . . 2.7000000000000002 111.051 -179.601 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -55.09 -45.08 75.41 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.296 -0.411 . . . . 0.46000000000000002 111.164 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -53.27 -53.8 45.49 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.278 -0.419 . . . . 2.23 110.704 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.442 ' HA ' HD21 ' A' ' 51' ' ' LEU . 12.3 mt -56.6 -38.14 71.62 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.313 -0.403 . . . . 1.3600000000000001 110.47 179.44 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.47 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 84.0 mm-40 -67.25 -27.17 66.99 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.394 -0.366 . . . . 1.22 110.585 179.603 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 38.5 m-20 -77.35 -55.35 5.48 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.207 -0.451 . . . . 0.62 111.8 -179.646 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.56 HD13 HD13 ' A' ' 71' ' ' ILE . 1.1 pp -65.8 -35.88 81.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.497 -0.319 . . . . 0.39000000000000001 111.8 -179.19 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 82.6 mt -71.21 -43.22 74.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.698 0.285 . . . . 0.5 111.016 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.58 -49.94 71.39 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.406 -0.361 . . . . 0.58999999999999997 111.0 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -58.91 -36.15 74.23 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.892 0.377 . . . . 2.54 110.072 179.474 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -76.23 -19.63 58.18 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.077 -0.511 . . . . 0.53000000000000003 110.767 179.217 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -79.16 -31.21 43.91 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.164 -0.471 . . . . 1.95 110.802 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 85.2 m-20 -111.5 41.75 1.83 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.145 -0.48 . . . . 2.48 110.875 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 -158.03 -63.42 0.09 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.076 -0.511 . . . . 2.48 110.519 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -87.42 23.1 1.98 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.122 -0.49 . . . . 2.0499999999999998 110.803 179.827 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 68.0 m-20 66.27 -76.69 0.05 OUTLIER 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.009 -0.541 . . . . 1.47 111.086 -179.814 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -165.15 21.01 0.12 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.842 -0.694 . . . . 0.42999999999999999 112.373 179.767 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.492 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -132.14 155.22 48.56 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.982 0.42 . . . . 0.38 111.406 -179.814 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.585 HD11 ' HA ' ' A' ' 29' ' ' THR . 24.1 mt -123.88 152.38 42.43 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.837 -0.619 . . . . 1.4299999999999999 110.403 179.858 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 19.9 m-80 -113.2 157.77 21.29 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.884 0.373 . . . . 1.1899999999999999 111.132 -179.757 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -42.3 -37.71 1.6 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.67 -0.695 . . . . 0.40000000000000002 111.158 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -72.32 -38.96 68.56 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.206 -0.452 . . . . 0.81000000000000005 111.544 179.8 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -58.07 -51.2 70.66 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.026 0.441 . . . . 1.3600000000000001 110.4 179.744 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.461 ' CD1' HD21 ' A' ' 32' ' ' LEU . 29.5 t80 -67.1 -46.83 73.03 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.739 -0.664 . . . . 0.51000000000000001 110.797 179.904 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 10.6 m -55.12 -50.82 68.29 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.148 -0.478 . . . . 0.75 111.038 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -52.82 -52.4 39.1 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.891 -0.671 . . . . 0.40999999999999998 112.007 179.799 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.687 HG23 ' HE2' ' A' ' 74' ' ' LYS . 70.2 mt -58.24 -50.28 78.95 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.601 0 CA-C-O 120.967 0.413 . . . . 0.51000000000000001 110.8 179.204 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 2.3 mtp -43.39 -37.63 2.39 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.569 -0.741 . . . . 1.01 110.819 179.625 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.27 -55.28 10.98 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.118 -0.492 . . . . 0.69999999999999996 111.133 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.687 ' HE2' HG23 ' A' ' 71' ' ' ILE . 57.7 pttt -59.8 -30.26 68.79 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.963 -0.562 . . . . 1.3799999999999999 111.411 -179.389 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 6.9 tm0? -81.59 -46.46 14.39 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.289 -0.414 . . . . 1.98 111.919 -179.369 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 32.4 mtt -49.74 -48.03 50.38 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 116.328 -0.396 . . . . 1.2 111.632 -179.431 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 39.2 ptt180 -80.36 -42.47 22.84 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.093 0.405 . . . . 4.6900000000000004 112.093 -179.174 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -61.85 -21.52 64.73 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.596 0.236 . . . . 4.0099999999999998 111.385 -179.561 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 29.1 m -93.31 -72.56 0.6 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.498 -0.319 . . . . 5.2800000000000002 111.4 -179.616 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -172.83 89.77 0.09 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.723 -0.217 . . . . 5.5999999999999996 111.531 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.53 ' O ' ' HG2' ' A' ' 85' ' ' MET . 1.7 t -49.6 93.3 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 120.972 0.415 . . . . 7.29 110.723 178.969 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.426 ' HA ' ' HG2' ' A' ' 85' ' ' MET . 43.8 mt-10 -49.34 -19.88 0.58 Allowed 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 113.353 0.871 . . . . 9.7400000000000002 113.353 -178.221 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -62.28 -55.87 24.05 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 120.992 0.425 . . . . 12.109999999999999 111.461 -179.423 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -69.63 -16.01 63.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.131 -0.486 . . . . 10.869999999999999 111.17 -179.525 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' MET . . . . . 0.537 ' HB3' HG22 ' A' ' 142' ' ' VAL . 2.8 mmm -82.61 -32.12 28.53 Favored 'General case' 0 CA--C 1.508 -0.639 0 CA-C-O 121.979 0.895 . . . . 11.09 108.84 -179.24 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 25.9 tpt180 -64.67 -50.12 68.28 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 113.655 -1.611 . . . . 15.52 110.037 179.404 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -65.54 -37.09 85.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.8 -0.636 . . . . 14.85 110.195 179.164 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.79 -31.13 69.92 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.973 -0.558 . . . . 14.109999999999999 111.128 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 87.6 t80 -68.04 -39.59 83.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.137 0.494 . . . . 15.73 110.373 179.789 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 65.7 mttm -65.83 -39.51 90.88 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.543 -0.753 . . . . 17.66 110.918 179.769 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 78.2 mt -70.46 -45.43 74.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.059 -0.518 . . . . 18.149999999999999 111.59 -179.755 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.534 ' HD1' HG11 ' A' ' 108' ' ' VAL . 1.9 m-85 -67.51 -55.46 13.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.452 -0.34 . . . . 18.34 111.511 -179.503 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 27.9 t0 -58.35 109.14 0.72 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.879 0.371 . . . . 19.289999999999999 110.523 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.516 ' HG2' ' HB3' ' A' ' 104' ' ' GLU . 22.4 mmm180 -57.88 -37.0 73.18 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.967 -0.56 . . . . 22.25 111.129 -179.464 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.418 ' HB2' ' OD1' ' A' ' 97' ' ' ASP . 0.3 OUTLIER -107.8 176.46 5.14 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.22 -0.445 . . . . 23.34 110.784 -179.78 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.03 5.34 57.79 Favored Glycine 0 N--CA 1.449 -0.433 0 C-N-CA 120.896 -0.668 . . . . 22.0 112.157 179.721 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.437 ' OD2' ' HB2' ' A' ' 99' ' ' PHE . 11.6 p-10 -58.8 -38.79 79.38 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.808 0.337 . . . . 22.280000000000001 110.98 -179.875 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 105.21 28.15 5.62 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.858 -0.687 . . . . 19.93 113.076 179.427 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' PHE . . . . . 0.437 ' HB2' ' OD2' ' A' ' 97' ' ' ASP . 59.8 m-85 -145.39 139.06 26.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.012 0.435 . . . . 20.300000000000001 111.622 179.89 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.426 ' HB ' ' HB ' ' A' ' 136' ' ' ILE . 84.3 mt -114.84 124.59 71.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 115.774 -0.648 . . . . 19.370000000000001 110.619 179.414 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 58.4 m -114.21 156.55 44.1 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.154 -0.475 . . . . 22.489999999999998 110.958 -179.56 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -41.25 -32.54 1.18 Allowed 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 122.723 2.282 . . . . 23.0 112.181 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.55 -51.08 62.53 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.1 0.476 . . . . 24.559999999999999 110.531 179.299 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.543 ' O ' HG12 ' A' ' 108' ' ' VAL . 45.0 mt-10 -69.57 -26.99 64.75 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.674 -0.694 . . . . 22.23 110.875 179.851 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.493 HD23 ' C ' ' A' ' 105' ' ' LEU . 5.8 tt -69.13 -55.83 9.51 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.333 -0.394 . . . . 20.359999999999999 111.161 -179.583 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 7.1 ppt_? -62.49 -30.57 71.36 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.034 0.445 . . . . 27.190000000000001 110.597 -179.679 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -74.19 -36.59 64.02 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.785 -0.643 . . . . 25.359999999999999 112.043 -179.866 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.543 HG12 ' O ' ' A' ' 104' ' ' GLU . 7.2 p -80.0 -44.88 22.85 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 N-CA-C 111.947 0.351 . . . . 21.059999999999999 111.947 -179.352 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.473 ' N ' HG13 ' A' ' 108' ' ' VAL . 12.0 mmt -52.69 -38.98 61.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.49 -0.323 . . . . 20.93 111.429 -179.587 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 89.6 mt -65.65 -34.48 70.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.843 0.354 . . . . 25.129999999999999 110.538 179.488 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 11.5 m120 -65.64 -22.93 66.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.09 -0.505 . . . . 23.32 110.444 179.559 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 7.5 mt -88.42 -27.87 21.28 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.954 -0.566 . . . . 21.07 110.531 179.722 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 106.22 10.8 29.02 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.896 -0.668 . . . . 23.050000000000001 112.217 -179.741 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -74.61 -34.86 62.9 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.65 0.262 . . . . 22.59 111.306 -179.737 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 57.3 tptt 53.85 90.69 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.119 -0.491 . . . . 27.960000000000001 110.76 -179.708 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' VAL . . . . . 0.414 ' HB ' HG23 ' A' ' 121' ' ' ILE . 3.3 m -124.23 156.33 31.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.919 -0.582 . . . . 24.75 111.698 -179.525 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 117' ' ' THR . . . . . 0.45 ' O ' HG12 ' A' ' 121' ' ' ILE . 61.9 p -99.22 147.16 25.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.696 -0.683 . . . . 27.239999999999998 110.272 179.676 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 118' ' ' ASP . . . . . 0.436 ' O ' ' HB2' ' A' ' 122' ' ' ASP . 14.8 m-20 -53.55 -17.67 2.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.258 -0.428 . . . . 26.629999999999999 111.439 -179.593 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -79.93 -55.71 4.77 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.739 0.304 . . . . 29.140000000000001 111.381 -179.807 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.401 ' OE1' HG12 ' A' ' 116' ' ' VAL . 14.7 pt-20 -61.79 -35.03 76.99 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.412 -0.358 . . . . 24.190000000000001 111.44 -179.539 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.462 ' O ' HG13 ' A' ' 125' ' ' ILE . 7.4 pt -78.01 -33.52 18.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 C-N-CA 120.976 -0.289 . . . . 22.329999999999998 111.174 -179.909 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.442 ' N ' HG13 ' A' ' 121' ' ' ILE . 12.7 t70 -55.85 -44.83 78.37 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.598 -0.519 . . . . 24.289999999999999 109.598 178.819 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -67.66 -42.59 81.95 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.621 -0.718 . . . . 24.739999999999998 110.214 179.073 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 54.7 ttp -58.1 -37.06 73.82 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.026 -0.533 . . . . 19.710000000000001 110.99 179.643 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.462 HG13 ' O ' ' A' ' 121' ' ' ILE . 77.3 mt -65.87 -45.32 91.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.278 -0.419 . . . . 19.949999999999999 110.38 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 61.3 ttt180 -58.68 -38.05 77.38 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.81 -0.632 . . . . 24.949999999999999 111.089 179.753 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -63.01 -28.12 69.89 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.205 -0.452 . . . . 18.690000000000001 111.076 -179.88 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.536 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -103.44 -6.61 21.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.259 -0.428 . . . . 16.469999999999999 111.038 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 54.4 t0 -109.34 100.96 10.0 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.15 -0.477 . . . . 20.399999999999999 111.071 -179.583 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 92.6 m-85 -70.38 -48.82 54.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.948 -0.569 . . . . 21.43 111.018 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -64.99 -21.85 66.91 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.182 -0.463 . . . . 23.370000000000001 110.863 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 55.26 55.51 28.01 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.941 -0.647 . . . . 24.32 112.698 179.74 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -101.73 -7.07 22.93 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.826 0.346 . . . . 23.879999999999999 110.765 179.8 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 89.93 9.49 65.85 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.844 -0.693 . . . . 22.670000000000002 112.305 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 68.3 mtp -134.93 154.38 51.71 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.843 0.354 . . . . 22.91 110.835 -179.901 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.554 HG23 ' HB2' ' A' ' 140' ' ' GLU . 27.8 mm -114.87 144.0 23.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.1 -0.5 . . . . 18.41 111.812 -179.516 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 137' ' ' ASN . . . . . 0.415 ' O ' ' N ' ' A' ' 139' ' ' GLU . 24.4 t-20 -114.59 157.15 23.43 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.43 -0.805 . . . . 16.82 108.993 178.437 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.683 ' O ' HG23 ' A' ' 142' ' ' VAL . 39.4 t80 -40.85 -24.08 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 111.821 0.304 . . . . 14.65 111.821 -179.828 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.415 ' N ' ' O ' ' A' ' 137' ' ' ASN . 10.6 mm-40 -80.8 -56.25 4.26 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 120.818 0.342 . . . . 14.82 110.983 -179.359 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.554 ' HB2' HG23 ' A' ' 136' ' ' ILE . 39.5 mt-10 -59.09 -29.45 67.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.134 0.492 . . . . 17.460000000000001 109.892 179.539 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.451 ' CZ ' HG21 ' A' ' 145' ' ' ILE . 86.5 t80 -66.37 -55.41 16.0 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.585 -0.734 . . . . 12.93 109.834 179.141 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.683 HG23 ' O ' ' A' ' 138' ' ' TYR . 55.3 t -47.67 -36.53 5.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.65 -0.704 . . . . 10.699999999999999 111.273 179.022 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 79.4 t90 -67.81 -55.97 10.98 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.833 0.679 . . . . 13.66 112.833 -178.656 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 144' ' ' MET . . . . . 0.536 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 15.5 ptt? -65.72 -28.72 69.26 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 113.348 0.87 . . . . 14.5 113.348 -177.564 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 145' ' ' ILE . . . . . 0.542 ' O ' ' HG2' ' A' ' 148' ' ' LYS . 49.2 pt -73.19 -42.05 58.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 C-N-CA 120.832 -0.347 . . . . 11.25 111.763 -179.388 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 146' ' ' SER . . . . . 0.538 ' N ' HG13 ' A' ' 145' ' ' ILE . 79.0 p -64.6 -13.03 51.52 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.227 0.536 . . . . 8.5399999999999991 109.845 179.374 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 11.1 mm-40 -122.11 13.1 10.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.265 -0.88 . . . . 11.869999999999999 111.839 -178.355 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 148' ' ' LYS . . . . . 0.542 ' HG2' ' O ' ' A' ' 145' ' ' ILE . 19.2 pttp . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.162 -0.923 . . . . 13.68 110.914 179.611 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 149' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 151' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 56.5 m . . . . . 0 N--CA 1.486 1.362 0 CA-C-O 120.771 0.319 . . . . 4.8899999999999997 110.929 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -163.79 148.83 10.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.173 -0.467 . . . . 3.2599999999999998 110.886 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.442 HD13 ' SG ' ' A' ' 69' ' ' CYS . 56.2 mt -67.25 91.03 0.23 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.251 -0.431 . . . . 1.27 110.674 -179.98 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 58.8 p -80.02 -170.71 2.58 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.261 -0.427 . . . . 1.1200000000000001 111.423 -179.679 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -66.15 -46.79 76.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.277 -0.42 . . . . 2.2000000000000002 111.259 -179.829 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -71.9 -38.81 69.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.235 -0.439 . . . . 1.3500000000000001 110.947 -179.519 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 15.9 mm100 -64.64 -44.38 90.65 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.108 -0.496 . . . . 2.2200000000000002 110.676 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.519 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 45.7 mt -59.35 -50.47 79.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.376 -0.374 . . . . 0.54000000000000004 110.484 179.598 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.89 -19.78 65.79 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.111 -0.495 . . . . 0.5 111.08 179.888 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -71.44 -56.2 6.42 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.231 -0.44 . . . . 2.27 111.887 -178.941 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.519 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 20.1 p90 -78.67 -27.96 45.24 Favored 'General case' 0 C--N 1.333 -0.122 0 C-N-CA 120.565 -0.454 . . . . 0.37 110.863 -179.823 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 27.3 tptp -61.83 -37.65 85.23 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.272 -0.64 . . . . 1.23 109.272 178.663 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.412 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 22.8 t70 -69.39 -49.93 50.82 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.719 -0.673 . . . . 0.44 109.488 178.483 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.26 -14.82 42.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.617 -0.72 . . . . 0.28999999999999998 110.79 179.389 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 47.3 t80 -80.5 -51.84 8.32 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.975 -0.557 . . . . 0.47999999999999998 110.863 -179.61 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 13.6 m -66.1 -19.55 25.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.091 0.472 . . . . 1.1100000000000001 110.629 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.412 ' HG2' ' O ' ' A' ' 14' ' ' ASP . 73.5 mm-40 -65.22 -21.8 66.8 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.648 -0.706 . . . . 1.6000000000000001 111.37 179.588 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 -110.85 12.34 22.34 Favored 'General case' 0 N--CA 1.462 0.174 0 N-CA-C 112.026 0.38 . . . . 0.64000000000000001 112.026 -179.499 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -100.96 92.55 5.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.023 0.44 . . . . 0.44 110.716 179.483 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -99.7 -1.13 38.66 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.885 -0.598 . . . . 2.1000000000000001 111.222 -179.883 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -95.29 -23.19 17.33 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.186 -0.461 . . . . 1.8 111.465 -179.299 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.1 7.21 87.69 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.831 -0.7 . . . . 0.46000000000000002 112.796 179.784 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 24.3 p -84.53 17.36 2.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.589 0.233 . . . . 0.40000000000000002 111.172 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 57.48 18.0 28.27 Favored Glycine 0 C--N 1.332 0.332 0 C-N-CA 120.718 -0.753 . . . . 0.33000000000000002 111.841 -179.475 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.667 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 44.8 mtpt -136.82 154.71 50.45 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.598 -0.301 . . . . 1.1000000000000001 110.444 -179.443 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.48 ' CD1' HD12 ' A' ' 35' ' ' LEU . 44.1 pt -119.68 135.45 59.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 120.612 0.244 . . . . 0.5 111.048 179.948 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -49.17 132.12 19.54 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.499 -0.319 . . . . 0.29999999999999999 110.894 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 5.9 t -61.03 -17.05 50.19 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.129 -0.487 . . . . 1.03 111.019 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 69.3 mtt180 -79.23 -2.67 42.22 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.826 -0.625 . . . . 3.0800000000000001 110.653 179.894 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -116.83 -8.8 11.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.79 -0.641 . . . . 2.2599999999999998 110.799 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.402 ' O ' ' HG3' ' A' ' 36' ' ' MET . 0.8 OUTLIER -55.64 -48.09 75.55 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.155 -0.475 . . . . 1.3700000000000001 110.228 179.916 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.595 ' HA2' HD11 ' A' ' 48' ' ' LEU . . . -56.1 -41.34 85.44 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.503 -0.856 . . . . 0.32000000000000001 111.485 179.28 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 77.3 m -65.54 -28.91 69.51 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.066 0.46 . . . . 0.31 110.314 179.069 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.48 HD12 ' CD1' ' A' ' 27' ' ' ILE . 0.2 OUTLIER -70.83 -35.07 72.31 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.751 -0.659 . . . . 1.24 110.593 -179.982 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.441 ' SD ' ' HG3' ' A' ' 43' ' ' PRO . 26.7 mtp -80.27 -21.62 42.53 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.224 -0.444 . . . . 1.1000000000000001 110.648 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -77.0 -37.33 55.3 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.069 -0.514 . . . . 2.6899999999999999 110.224 179.277 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 5.9 t -73.41 -12.17 60.72 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.802 -0.636 . . . . 1.0600000000000001 110.636 179.266 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 65.5 mt -111.86 155.71 23.18 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.798 -0.637 . . . . 1.26 110.366 -179.895 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -50.73 -18.12 2.49 Favored Glycine 0 CA--C 1.52 0.352 0 CA-C-N 115.929 -0.578 . . . . 0.68999999999999995 114.358 -178.737 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 26.7 mp0 -65.54 141.61 58.4 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 117.354 0.577 . . . . 1.97 111.352 -179.859 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 48.9 m-80 -129.29 72.65 81.96 Favored Pre-proline 0 C--N 1.331 -0.225 0 CA-C-N 116.196 -0.456 . . . . 2.6600000000000001 110.857 179.393 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.441 ' HG3' ' SD ' ' A' ' 36' ' ' MET . 29.4 Cg_endo -60.83 148.96 90.54 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.719 2.28 . . . . 0.51000000000000001 112.309 179.806 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 32.3 m -77.34 150.02 35.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.167 -0.469 . . . . 0.72999999999999998 110.6 179.565 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.409 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 1.0 OUTLIER -49.41 -55.23 13.79 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.573 0.225 . . . . 2.7000000000000002 111.483 -179.556 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -55.89 -42.79 76.49 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.443 -0.344 . . . . 0.46000000000000002 111.735 -179.497 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -62.29 -53.89 48.62 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.375 -0.375 . . . . 2.23 110.95 -179.57 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.595 HD11 ' HA2' ' A' ' 33' ' ' GLY . 14.5 tp -55.57 -42.22 74.42 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.009 -0.541 . . . . 1.3600000000000001 111.168 -179.745 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.409 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 85.2 mm-40 -69.27 -32.13 71.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.47 -0.332 . . . . 1.22 111.281 -179.686 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 76.6 m-20 -70.62 -51.5 27.7 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.527 -0.306 . . . . 0.62 111.638 -179.727 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.489 HD21 ' HA ' ' A' ' 48' ' ' LEU . 1.8 pp -65.85 -41.16 92.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.624 -0.262 . . . . 0.39000000000000001 111.508 -179.516 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 60.5 mt -62.79 -49.2 84.65 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-O 120.808 0.337 . . . . 0.5 110.477 179.51 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.77 -34.19 76.73 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.214 -0.448 . . . . 0.58999999999999997 110.381 179.471 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -63.85 -50.22 69.7 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.008 -0.542 . . . . 2.54 110.145 179.305 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -71.99 -14.59 61.93 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.93 -0.577 . . . . 0.53000000000000003 110.984 179.446 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -68.99 -55.4 10.98 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.303 -0.408 . . . . 1.95 111.301 -179.751 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 -97.03 48.58 1.05 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.033 0.444 . . . . 2.48 111.083 -179.757 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 32.3 m-80 -156.21 -41.31 0.08 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.721 -0.672 . . . . 2.48 110.719 179.887 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 12.4 m120 -115.17 23.33 12.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.967 -0.56 . . . . 2.0499999999999998 110.694 179.866 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 70.2 m-20 65.87 -78.21 0.04 OUTLIER 'General case' 0 C--O 1.232 0.178 0 CA-C-N 115.869 -0.605 . . . . 1.47 111.052 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -159.24 23.21 0.3 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.671 -0.776 . . . . 0.42999999999999999 112.729 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.667 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -126.93 155.19 43.47 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.348 0.594 . . . . 0.38 111.639 -179.938 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.492 HD13 ' N ' ' A' ' 64' ' ' ASN . 1.2 tm? -121.97 148.25 45.03 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.108 -0.951 . . . . 1.4299999999999999 109.002 -179.714 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ASN . . . . . 0.518 ' OD1' ' HE3' ' A' ' 26' ' ' LYS . 0.1 OUTLIER -111.35 155.67 22.75 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.587 -0.445 . . . . 1.1899999999999999 111.965 -178.561 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.482 ' O ' ' HB2' ' A' ' 69' ' ' CYS . 70.0 t80 -51.99 -31.52 29.83 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.638 -0.71 . . . . 0.40000000000000002 110.713 179.491 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -77.13 -36.6 55.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.327 -0.397 . . . . 0.81000000000000005 111.868 -179.914 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -63.68 -46.46 85.44 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 110.043 -0.354 . . . . 1.3600000000000001 110.043 179.767 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.451 ' HE2' ' HB2' ' A' ' 12' ' ' PHE . 31.0 t80 -68.44 -51.52 42.76 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.183 -0.462 . . . . 0.51000000000000001 110.472 179.263 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.482 ' HB2' ' O ' ' A' ' 65' ' ' PHE . 2.1 t -53.43 -45.86 69.57 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-O 120.945 0.402 . . . . 0.75 110.121 179.739 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -52.61 -51.27 44.84 Favored Glycine 0 N--CA 1.448 -0.542 0 CA-C-N 115.666 -0.697 . . . . 0.40999999999999998 111.68 179.463 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.472 ' HA ' ' HG2' ' A' ' 74' ' ' LYS . 13.0 mt -61.9 -39.44 83.57 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.316 0 CA-C-O 121.026 0.441 . . . . 0.51000000000000001 110.602 179.429 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 3.4 mtp -57.88 -30.21 65.66 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.802 -0.635 . . . . 1.01 110.096 179.618 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.25 -45.72 65.87 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.965 -0.561 . . . . 0.69999999999999996 110.799 179.694 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.472 ' HG2' ' HA ' ' A' ' 71' ' ' ILE . 58.2 pttt -75.52 -25.46 57.26 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.194 -0.457 . . . . 1.3799999999999999 111.767 -179.667 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' GLN . . . . . 0.515 ' O ' ' HB3' ' A' ' 78' ' ' GLU . 4.4 tt0 -82.53 -43.95 16.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.056 0.455 . . . . 1.98 110.851 -179.533 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' MET . . . . . 0.433 ' SD ' HD23 ' A' ' 4' ' ' LEU . 29.0 mtt -63.37 -40.28 96.84 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.787 -0.642 . . . . 1.2 111.41 179.751 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.433 ' NE ' ' HA ' ' A' ' 74' ' ' LYS . 33.9 ptt180 -67.68 -31.07 70.79 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.321 -0.4 . . . . 4.6900000000000004 111.248 -179.659 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.515 ' HB3' ' O ' ' A' ' 75' ' ' GLN . 2.9 tt0 -42.51 -35.34 1.04 Allowed 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.459 -0.337 . . . . 4.0099999999999998 111.24 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 53.7 m -49.44 -55.32 13.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.152 -0.476 . . . . 5.2800000000000002 110.887 179.636 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -96.78 -80.49 0.43 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.184 -0.462 . . . . 5.5999999999999996 110.641 179.386 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.577 ' O ' ' HG3' ' A' ' 85' ' ' MET . 61.9 m 31.07 86.23 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 116.105 -0.498 . . . . 7.29 111.993 -179.671 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.459 ' HA ' ' SD ' ' A' ' 85' ' ' MET . 38.6 tt0 -44.88 -41.73 7.39 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.002 -0.544 . . . . 9.7400000000000002 112.456 -179.163 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -55.92 -54.02 49.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.786 0.327 . . . . 12.109999999999999 111.623 -179.372 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.528 ' H ' HG22 ' A' ' 81' ' ' THR . 37.0 tt0 -63.24 -18.75 63.89 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.305 -0.407 . . . . 10.869999999999999 111.386 -179.467 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' MET . . . . . 0.577 ' HG3' ' O ' ' A' ' 81' ' ' THR . 6.6 mtp -74.74 -35.62 62.62 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-O 121.185 0.517 . . . . 11.09 109.894 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 15.9 ttm180 -68.63 -51.46 41.97 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.542 -0.754 . . . . 15.52 110.295 179.457 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.438 ' HA ' ' HD3' ' A' ' 90' ' ' LYS . 16.2 mm-40 -58.41 -39.16 78.98 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.11 -0.496 . . . . 14.85 110.501 179.32 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -69.87 -33.02 71.68 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.006 -0.543 . . . . 14.109999999999999 110.568 179.543 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 52.8 t80 -66.78 -29.05 68.9 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.949 -0.568 . . . . 15.73 110.234 179.594 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.438 ' HD3' ' HA ' ' A' ' 87' ' ' GLU . 24.9 mtpp -73.32 -46.48 49.19 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.475 -0.784 . . . . 17.66 110.945 179.783 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 75.2 mt -58.6 -50.52 78.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.164 -0.471 . . . . 18.149999999999999 111.245 -179.751 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.553 ' HD1' HG11 ' A' ' 108' ' ' VAL . 22.3 m-85 -64.08 -43.4 95.51 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.36 -0.382 . . . . 18.34 110.976 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 30.7 t0 -64.47 93.28 0.1 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.997 0.427 . . . . 19.289999999999999 110.297 179.621 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -56.48 -29.42 61.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.778 -0.646 . . . . 22.25 111.532 -179.269 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -101.12 177.97 4.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.874 0.369 . . . . 23.34 111.028 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -101.0 0.27 54.99 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.949 -0.643 . . . . 22.0 112.002 179.364 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -70.36 -22.36 62.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.701 0.286 . . . . 22.280000000000001 111.659 -179.691 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 86.39 45.45 5.56 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.705 -0.76 . . . . 19.93 112.492 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' PHE . . . . . 0.43 ' HA ' ' O ' ' A' ' 136' ' ' ILE . 99.6 m-85 -147.64 138.86 23.62 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.595 0.236 . . . . 20.300000000000001 111.04 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 53.7 mt -114.13 117.43 55.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 121.009 0.433 . . . . 19.370000000000001 110.756 179.407 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 68.1 m -114.11 157.32 42.49 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 115.736 -0.666 . . . . 22.489999999999998 111.046 -179.296 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' PRO . . . . . 0.434 ' HG3' HD12 ' A' ' 125' ' ' ILE . 94.4 Cg_exo -41.45 -36.57 2.92 Favored 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 122.602 2.201 . . . . 23.0 112.742 -179.832 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.32 -40.9 81.52 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.161 -0.472 . . . . 24.559999999999999 111.17 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.487 ' O ' HG12 ' A' ' 108' ' ' VAL . 43.2 mt-10 -78.02 -22.85 48.64 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.835 -0.62 . . . . 22.23 109.878 -179.473 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.563 HD22 ' HB ' ' A' ' 121' ' ' ILE . 3.4 tt -77.0 -43.04 36.3 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 115.215 -0.902 . . . . 20.359999999999999 111.128 -179.445 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.414 ' O ' HG13 ' A' ' 110' ' ' ILE . 54.2 ttt180 -66.57 -48.27 70.15 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.468 -0.333 . . . . 27.190000000000001 110.346 179.463 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 8.5 m-85 -55.86 -50.69 69.9 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.159 -0.473 . . . . 25.359999999999999 111.492 -179.681 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.553 HG11 ' HD1' ' A' ' 92' ' ' PHE . 9.3 p -63.99 -43.13 97.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.582 0.229 . . . . 21.059999999999999 111.568 -179.623 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.472 ' N ' HG13 ' A' ' 108' ' ' VAL . 9.0 mmt -58.98 -43.19 91.37 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 120.773 0.32 . . . . 20.93 111.013 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.414 HG13 ' O ' ' A' ' 106' ' ' ARG . 90.9 mt -67.33 -21.6 28.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.144 -0.48 . . . . 25.129999999999999 110.313 179.704 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 84.1 m-20 -79.74 -37.64 35.06 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.861 -0.609 . . . . 23.32 110.495 179.345 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.451 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 58.2 mt -59.64 -36.02 75.54 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.103 -0.499 . . . . 21.07 110.422 179.754 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 133.84 -15.88 4.55 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.858 -0.687 . . . . 23.050000000000001 112.22 -179.808 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -93.62 165.2 12.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.863 0.363 . . . . 22.59 111.227 -179.689 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -124.07 128.06 48.76 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.064 -0.517 . . . . 27.960000000000001 110.676 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 116' ' ' VAL . . . . . 0.424 ' HB ' HG23 ' A' ' 121' ' ' ILE . 2.8 m -135.57 146.79 29.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.207 -0.451 . . . . 24.75 111.624 -179.885 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 59.5 p -89.32 147.15 24.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.734 -0.666 . . . . 27.239999999999998 110.223 179.331 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -53.74 -19.04 3.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.21 -0.45 . . . . 26.629999999999999 111.411 -179.521 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -78.5 -54.64 5.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.405 -0.362 . . . . 29.140000000000001 111.575 -179.51 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.413 ' OE1' HG12 ' A' ' 116' ' ' VAL . 14.0 pt-20 -61.46 -37.92 85.34 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.557 -0.292 . . . . 24.190000000000001 111.769 -179.063 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.563 ' HB ' HD22 ' A' ' 105' ' ' LEU . 47.8 pt -74.32 -35.88 41.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 C-N-CA 120.689 -0.404 . . . . 22.329999999999998 111.062 179.99 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -58.72 -37.6 76.5 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.915 0.388 . . . . 24.289999999999999 110.365 179.251 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -69.53 -47.1 64.85 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.912 -0.585 . . . . 24.739999999999998 110.709 179.693 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 56.5 ttp -53.37 -38.71 63.59 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 116.246 -0.433 . . . . 19.710000000000001 110.76 179.658 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.535 HG23 HD11 ' A' ' 136' ' ' ILE . 79.7 mt -67.42 -42.99 87.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.118 -0.492 . . . . 19.949999999999999 110.473 179.686 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 3.2 tmt_? -61.87 -30.52 70.92 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.989 -0.551 . . . . 24.949999999999999 110.942 179.793 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -69.87 -28.01 65.29 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.354 -0.385 . . . . 18.690000000000001 111.127 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.652 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -104.66 -6.73 20.17 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.087 -0.506 . . . . 16.469999999999999 111.347 -179.808 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 129' ' ' ASP . . . . . 0.409 ' OD1' ' N ' ' A' ' 132' ' ' GLY . 3.0 t0 -112.36 105.0 13.18 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.033 0.444 . . . . 20.399999999999999 111.431 -179.102 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 74.3 m-85 -71.51 -7.58 48.44 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.749 -0.659 . . . . 21.43 111.031 179.597 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -128.21 -7.62 5.35 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.091 -0.504 . . . . 23.370000000000001 110.718 179.914 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 132' ' ' GLY . . . . . 0.412 ' O ' ' N ' ' A' ' 134' ' ' GLY . . . 61.31 -84.93 0.03 OUTLIER Glycine 0 N--CA 1.447 -0.607 0 CA-C-N 115.703 -0.68 . . . . 24.32 112.049 -179.484 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 133' ' ' ASP . . . . . 0.474 ' O ' ' HG3' ' A' ' 135' ' ' MET . 0.8 OUTLIER 44.08 17.14 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 123.43 0.692 . . . . 23.879999999999999 111.809 -179.669 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 134' ' ' GLY . . . . . 0.412 ' N ' ' O ' ' A' ' 132' ' ' GLY . . . 53.33 23.56 19.01 Favored Glycine 0 CA--C 1.522 0.487 0 CA-C-N 115.923 -0.58 . . . . 22.670000000000002 114.085 179.547 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 135' ' ' MET . . . . . 0.474 ' HG3' ' O ' ' A' ' 133' ' ' ASP . 40.3 mtp -145.35 142.73 29.65 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 117.431 0.616 . . . . 22.91 110.828 179.408 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.61 HG23 ' HB2' ' A' ' 140' ' ' GLU . 29.9 mm -113.56 146.82 17.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 121.233 0.539 . . . . 18.41 111.586 -179.091 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -114.65 156.96 23.77 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.413 -0.812 . . . . 16.82 109.525 179.025 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 49.1 t80 -43.14 -21.48 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 111.789 0.292 . . . . 14.65 111.789 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -80.95 -56.35 4.17 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 120.949 0.404 . . . . 14.82 111.032 -179.517 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.61 ' HB2' HG23 ' A' ' 136' ' ' ILE . 58.6 mt-10 -61.9 -32.79 73.2 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.216 0.532 . . . . 17.460000000000001 110.104 179.797 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.455 ' CZ ' HG21 ' A' ' 145' ' ' ILE . 81.2 t80 -65.28 -54.15 33.48 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.586 -0.734 . . . . 12.93 109.854 178.951 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.524 HG13 ' SD ' ' A' ' 85' ' ' MET . 2.5 t -48.89 -35.21 6.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.39 -0.823 . . . . 10.699999999999999 111.555 179.265 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 143' ' ' TRP . . . . . 0.511 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 92.0 t90 -69.27 -55.94 9.03 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.588 0.588 . . . . 13.66 112.588 -179.066 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 144' ' ' MET . . . . . 0.652 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 21.9 ptt? -64.26 -24.93 67.84 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 113.324 0.861 . . . . 14.5 113.324 -177.674 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 145' ' ' ILE . . . . . 0.534 HG13 ' N ' ' A' ' 146' ' ' SER . 39.7 pt -80.61 -38.27 17.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 111.993 0.368 . . . . 11.25 111.993 -179.51 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 146' ' ' SER . . . . . 0.534 ' N ' HG13 ' A' ' 145' ' ' ILE . 39.9 t -59.67 -13.55 10.25 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.225 0.536 . . . . 8.5399999999999991 110.559 -179.883 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 147' ' ' GLN . . . . . 0.511 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 1.5 mm100 -94.51 -22.8 18.0 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.402 -0.817 . . . . 11.869999999999999 111.032 -179.152 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 99.1 mttt . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.223 -0.894 . . . . 13.68 111.003 179.808 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 149' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 151' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 35.5 t . . . . . 0 N--CA 1.485 1.316 0 CA-C-O 120.765 0.317 . . . . 4.8899999999999997 110.836 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 64.23 123.28 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.138 0 CA-C-N 115.974 -0.557 . . . . 3.2599999999999998 111.072 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 18.5 mt -56.29 98.44 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.182 -0.463 . . . . 1.27 110.684 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.55 HG22 ' H ' ' A' ' 6' ' ' GLU . 0.2 OUTLIER -84.87 176.17 8.66 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.006 -0.543 . . . . 1.1200000000000001 110.857 -179.813 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.55 ' H ' HG22 ' A' ' 5' ' ' THR . 33.6 tt0 -62.59 -37.75 87.42 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.251 0.548 . . . . 2.2000000000000002 110.32 179.883 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -75.38 -45.76 37.17 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.377 -0.829 . . . . 1.3500000000000001 110.923 -179.634 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -62.46 -45.73 91.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.056 -0.52 . . . . 2.2200000000000002 110.909 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.543 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 80.7 mt -57.46 -54.74 27.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.123 -0.49 . . . . 0.54000000000000004 111.096 179.926 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.78 -24.08 65.5 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.246 -0.434 . . . . 0.5 111.88 -179.525 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -72.54 -56.19 5.76 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 112.135 0.42 . . . . 2.27 112.135 -179.08 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.543 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 5.2 p90 -76.98 -24.29 52.26 Favored 'General case' 0 C--N 1.332 -0.158 0 C-N-CA 120.614 -0.434 . . . . 0.37 110.728 -179.591 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.429 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 18.6 tptp -65.62 -39.77 91.85 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.259 -0.645 . . . . 1.23 109.259 178.87 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.456 ' O ' HG22 ' A' ' 17' ' ' VAL . 17.9 t70 -68.1 -44.33 76.47 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 108.994 -0.743 . . . . 0.44 108.994 177.979 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.09 -15.11 62.8 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 115.249 -0.887 . . . . 0.28999999999999998 110.42 179.275 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.429 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 74.1 t80 -79.6 -48.28 14.04 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.821 -0.627 . . . . 0.47999999999999998 110.527 -179.734 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.456 HG22 ' O ' ' A' ' 14' ' ' ASP . 30.1 m -66.01 -23.1 31.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 121.0 0.428 . . . . 1.1100000000000001 110.253 179.822 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.45 ' HG2' ' O ' ' A' ' 14' ' ' ASP . 26.5 mm-40 -57.02 -45.79 82.82 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 115.791 -0.641 . . . . 1.6000000000000001 111.799 179.358 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -85.63 22.5 1.58 Allowed 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 112.053 0.39 . . . . 0.64000000000000001 112.053 -179.252 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -120.87 78.82 1.43 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.026 0.441 . . . . 0.44 110.815 179.646 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 11.4 mmmm -89.86 -24.71 21.33 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.854 -0.612 . . . . 2.1000000000000001 110.999 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -67.54 -35.66 79.48 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.963 -0.562 . . . . 1.8 111.23 -179.608 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 101.83 3.51 52.17 Favored Glycine 0 C--N 1.331 0.255 0 C-N-CA 120.686 -0.768 . . . . 0.46000000000000002 112.819 179.847 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 53.6 p -80.2 7.12 10.02 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.731 0.3 . . . . 0.40000000000000002 111.202 179.885 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 56.96 19.42 30.11 Favored Glycine 0 C--N 1.333 0.405 0 C-N-CA 120.746 -0.74 . . . . 0.33000000000000002 111.986 -179.611 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.467 ' C ' HE22 ' A' ' 62' ' ' GLN . 29.6 mtpt -126.34 155.7 41.64 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.696 0.284 . . . . 1.1000000000000001 111.104 -179.593 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.466 HG13 ' HB2' ' A' ' 63' ' ' LEU . 41.3 pt -114.69 130.12 69.64 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 CA-C-O 120.915 0.388 . . . . 0.5 111.591 -179.843 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -54.53 134.36 46.35 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.091 -0.504 . . . . 0.29999999999999999 111.161 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.486 ' HA ' HD11 ' A' ' 63' ' ' LEU . 6.1 t -66.82 -8.22 27.15 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.055 -0.52 . . . . 1.03 111.053 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 53.9 mtp180 -89.34 -1.19 57.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.912 -0.586 . . . . 3.0800000000000001 110.491 179.652 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -127.62 2.05 6.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.808 -0.633 . . . . 2.2599999999999998 110.971 -179.658 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.464 HD21 ' CD1' ' A' ' 68' ' ' PHE . 2.7 tm? -57.09 -51.8 67.82 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.396 -0.365 . . . . 1.3700000000000001 110.581 -179.791 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.466 ' O ' ' HG3' ' A' ' 37' ' ' ARG . . . -55.55 -44.22 85.75 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.376 -0.916 . . . . 0.32000000000000001 111.443 179.236 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 87.9 m -56.32 -36.17 68.41 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.105 0.478 . . . . 0.31 110.22 179.124 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.449 ' HB3' ' O ' ' A' ' 32' ' ' LEU . 42.2 tp -65.92 -32.4 73.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.635 -0.712 . . . . 1.24 110.347 179.483 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 16.6 mtp -80.91 -20.17 42.72 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.744 -0.662 . . . . 1.1000000000000001 110.812 179.793 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.466 ' HG3' ' O ' ' A' ' 33' ' ' GLY . 71.8 mtp180 -74.72 -43.36 55.47 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.344 -0.389 . . . . 2.6899999999999999 110.646 179.753 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.3 t -65.74 -14.0 60.45 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.168 -0.469 . . . . 1.0600000000000001 110.981 179.658 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.507 ' HB3' ' OE1' ' A' ' 41' ' ' GLN . 9.7 mp -113.9 156.14 24.5 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.028 -0.533 . . . . 1.26 110.539 179.491 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -55.15 -7.37 1.14 Allowed Glycine 0 CA--C 1.521 0.455 0 N-CA-C 114.931 0.732 . . . . 0.68999999999999995 114.931 -178.497 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.507 ' OE1' ' HB3' ' A' ' 39' ' ' LEU . 16.0 mp0 -59.44 -79.72 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 117.86 0.83 . . . . 1.97 110.998 179.697 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 53.69 74.24 0.79 Allowed Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.216 -0.447 . . . . 2.6600000000000001 111.118 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -71.42 -167.76 0.31 Allowed 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.509 2.14 . . . . 0.51000000000000001 112.442 179.79 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.9 m -86.27 157.16 19.99 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.125 -0.489 . . . . 0.72999999999999998 110.934 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -61.32 -55.05 36.1 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.677 0.275 . . . . 2.7000000000000002 111.056 -179.745 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.57 -53.09 56.66 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.216 -0.447 . . . . 0.46000000000000002 111.374 -179.843 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -54.87 -41.66 71.1 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.207 -0.451 . . . . 2.23 110.247 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.451 ' HA ' HD21 ' A' ' 51' ' ' LEU . 27.3 tp -60.61 -39.44 88.19 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.722 -0.672 . . . . 1.3600000000000001 110.641 179.68 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 86.2 mm-40 -70.49 -30.8 67.68 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.145 -0.48 . . . . 1.22 110.823 179.769 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 30.4 m-20 -67.08 -49.31 65.48 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.208 -0.451 . . . . 0.62 111.481 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.451 HD21 ' HA ' ' A' ' 48' ' ' LEU . 1.0 OUTLIER -71.06 -38.96 72.49 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.637 -0.256 . . . . 0.39000000000000001 111.401 -179.586 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 73.4 mt -65.88 -32.19 57.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 120.74 0.305 . . . . 0.5 110.636 179.607 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -68.66 -50.8 48.29 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.254 -0.43 . . . . 0.58999999999999997 110.839 179.695 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -65.24 -32.91 74.82 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.892 0.377 . . . . 2.54 110.277 179.526 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 0.45 ' HB1' HD21 ' A' ' 63' ' ' LEU . . . -79.85 -14.83 58.37 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.044 -0.525 . . . . 0.53000000000000003 110.838 179.415 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -70.09 -39.41 75.6 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.189 -0.459 . . . . 1.95 110.84 179.838 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -82.64 -22.83 34.53 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.145 -0.48 . . . . 2.48 110.969 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -91.42 136.74 32.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.201 -0.454 . . . . 2.48 111.015 -179.899 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ASN . . . . . 0.418 ' C ' ' H ' ' A' ' 61' ' ' GLY . 88.0 m-20 64.01 6.46 2.85 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.957 -0.565 . . . . 2.0499999999999998 111.362 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 12.4 m120 71.01 -27.03 0.17 Allowed 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 112.474 0.546 . . . . 1.47 112.474 179.244 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' GLY . . . . . 0.418 ' H ' ' C ' ' A' ' 59' ' ' ASN . . . 160.91 34.97 0.02 OUTLIER Glycine 0 C--N 1.33 0.23 0 C-N-CA 120.301 -0.952 . . . . 0.42999999999999999 112.933 -179.937 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.513 HE21 ' HA ' ' A' ' 62' ' ' GLN . 0.0 OUTLIER -141.65 154.69 45.52 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.929 0.395 . . . . 0.38 111.167 179.663 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.486 HD11 ' HA ' ' A' ' 29' ' ' THR . 17.9 mt -127.96 153.84 46.26 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.876 -0.602 . . . . 1.4299999999999999 110.332 179.908 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -113.43 156.99 22.5 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 110.288 -0.264 . . . . 1.1899999999999999 110.288 -179.91 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.494 ' O ' ' HB2' ' A' ' 69' ' ' CYS . 77.6 t80 -44.32 -34.6 2.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.813 0.34 . . . . 0.40000000000000002 110.44 179.339 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.97 -33.7 57.62 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.088 -0.505 . . . . 0.81000000000000005 111.926 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -64.67 -50.13 68.27 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.012 0.434 . . . . 1.3600000000000001 110.062 179.208 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.466 ' HE2' ' HB2' ' A' ' 12' ' ' PHE . 31.3 t80 -64.8 -53.54 45.26 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.902 -0.59 . . . . 0.51000000000000001 110.518 179.64 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.494 ' HB2' ' O ' ' A' ' 65' ' ' PHE . 0.1 OUTLIER -55.13 -41.38 71.65 Favored 'General case' 0 CA--C 1.521 -0.168 0 CA-C-O 120.827 0.346 . . . . 0.75 110.429 179.691 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -53.06 -46.56 61.58 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.791 -0.718 . . . . 0.40999999999999998 111.392 179.375 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.492 HG23 ' CE ' ' A' ' 74' ' ' LYS . 11.3 mt -65.15 -38.53 82.91 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.421 0 CA-C-O 120.936 0.398 . . . . 0.51000000000000001 110.314 178.979 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' MET . . . . . 0.5 ' O ' ' HG3' ' A' ' 76' ' ' MET . 79.4 mmm -61.99 -30.58 71.04 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.075 -0.511 . . . . 1.01 109.796 179.282 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -67.82 -43.31 79.9 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.807 -0.633 . . . . 0.69999999999999996 110.278 179.512 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.492 ' CE ' HG23 ' A' ' 71' ' ' ILE . 64.1 pttt -75.63 -29.83 59.3 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.32 -0.4 . . . . 1.3799999999999999 110.762 179.572 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 4.6 tt0 -73.0 -55.95 5.82 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.306 -0.406 . . . . 1.98 110.794 179.426 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' MET . . . . . 0.5 ' HG3' ' O ' ' A' ' 72' ' ' MET . 43.1 mtt -58.6 -31.95 68.53 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-O 120.933 0.397 . . . . 1.2 110.584 179.375 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 16.1 tpp180 -60.22 -27.86 67.53 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-N 115.794 -0.639 . . . . 4.6900000000000004 111.232 -179.848 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -47.94 -23.24 0.73 Allowed 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 121.041 0.448 . . . . 4.0099999999999998 111.389 179.94 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 6.7 t -62.65 -0.91 0.7 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.924 -0.58 . . . . 5.2800000000000002 112.377 -179.185 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -162.52 -29.71 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.846 -0.161 . . . . 5.5999999999999996 111.254 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.474 ' O ' ' HG3' ' A' ' 85' ' ' MET . 2.6 t 36.92 84.12 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 116.082 -0.508 . . . . 7.29 111.736 -179.558 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.49 ' HA ' ' SD ' ' A' ' 85' ' ' MET . 11.7 pt-20 -80.16 -15.85 56.16 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.044 -0.526 . . . . 9.7400000000000002 112.29 -178.895 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -59.74 -55.71 30.87 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 120.988 0.423 . . . . 12.109999999999999 110.991 -179.829 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -67.99 -15.76 63.75 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.976 -0.556 . . . . 10.869999999999999 110.558 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' MET . . . . . 0.555 ' SD ' HG13 ' A' ' 142' ' ' VAL . 8.5 mtt -80.4 -34.44 36.29 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.089 -0.505 . . . . 11.09 110.302 -179.875 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 37.3 ttt180 -68.78 -46.76 67.89 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.747 -0.66 . . . . 15.52 109.875 179.454 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.464 ' O ' HG12 ' A' ' 91' ' ' ILE . 38.3 tt0 -59.45 -45.19 92.3 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.886 -0.597 . . . . 14.85 109.818 178.981 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.88 -35.28 80.64 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.832 -0.622 . . . . 14.109999999999999 111.074 179.755 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -58.55 -39.2 79.57 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.099 0.476 . . . . 15.73 110.237 179.637 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 58.7 mttp -68.41 -40.1 81.4 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.665 -0.698 . . . . 17.66 110.682 179.497 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.464 HG12 ' O ' ' A' ' 87' ' ' GLU . 42.0 mm -60.06 -38.54 77.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.086 -0.506 . . . . 18.149999999999999 111.287 -179.826 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.573 ' HA ' HG21 ' A' ' 108' ' ' VAL . 12.8 m-85 -79.21 -35.37 41.78 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.386 -0.37 . . . . 18.34 111.333 -179.798 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 46.4 t0 -79.22 108.16 12.51 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.9 0.381 . . . . 19.289999999999999 110.946 -179.64 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.13 -9.55 58.82 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.979 -0.555 . . . . 22.25 111.313 -179.639 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.433 ' HB2' ' OD1' ' A' ' 97' ' ' ASP . 22.0 m-20 -117.18 168.08 10.62 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.888 0.375 . . . . 23.34 110.85 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -99.76 5.28 58.19 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.781 -0.723 . . . . 22.0 112.081 179.659 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.453 ' OD2' ' HB2' ' A' ' 99' ' ' PHE . 6.0 p-10 -63.27 -39.66 95.23 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.726 0.298 . . . . 22.280000000000001 111.061 -179.612 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 110.99 15.71 10.51 Favored Glycine 0 C--N 1.332 0.324 0 C-N-CA 120.659 -0.781 . . . . 19.93 112.921 179.727 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' PHE . . . . . 0.453 ' HB2' ' OD2' ' A' ' 97' ' ' ASP . 82.3 m-85 -139.69 152.12 46.45 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.892 0.377 . . . . 20.300000000000001 111.263 179.795 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.449 ' HB ' ' HB ' ' A' ' 136' ' ' ILE . 63.5 mt -114.68 132.13 64.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 115.964 -0.562 . . . . 19.370000000000001 110.8 179.71 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 35.2 p -114.35 155.96 45.06 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.206 -0.452 . . . . 22.489999999999998 110.756 -179.841 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_exo -40.54 -37.6 2.2 Favored 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 122.586 2.191 . . . . 23.0 112.567 -179.842 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.07 -49.52 77.02 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.131 0.491 . . . . 24.559999999999999 110.59 179.461 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.432 ' O ' HG23 ' A' ' 108' ' ' VAL . 40.8 mt-10 -69.46 -32.75 71.88 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.612 -0.722 . . . . 22.23 110.694 179.922 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.55 HD12 HD12 ' A' ' 121' ' ' ILE . 3.4 tm? -62.24 -56.03 22.56 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.018 -0.537 . . . . 20.359999999999999 110.359 -179.775 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 3.2 ttp180 -56.06 -40.59 73.77 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.193 -0.458 . . . . 27.190000000000001 111.03 179.712 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -58.38 -46.9 85.47 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.189 0.44 . . . . 25.359999999999999 112.189 -179.316 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.573 HG21 ' HA ' ' A' ' 92' ' ' PHE . 17.6 t -78.77 -54.06 12.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 N-CA-C 111.967 0.358 . . . . 21.059999999999999 111.967 -179.1 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.495 ' HG3' ' CD1' ' A' ' 105' ' ' LEU . 1.1 mmt -47.03 -22.22 0.31 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 120.706 0.289 . . . . 20.93 111.4 -179.77 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 78.1 mt -95.26 -38.83 9.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 121.023 0.439 . . . . 25.129999999999999 110.354 178.88 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -58.57 -33.16 69.63 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.681 -0.69 . . . . 23.32 110.893 179.858 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.534 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 19.1 mt -66.7 -24.93 66.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.139 -0.482 . . . . 21.07 110.832 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 117.34 -7.99 15.92 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.945 -0.645 . . . . 23.050000000000001 112.49 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -82.54 127.43 33.32 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.718 0.294 . . . . 22.59 110.918 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -87.17 104.38 16.3 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.229 -0.441 . . . . 27.960000000000001 110.713 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 116' ' ' VAL . . . . . 0.483 ' HB ' HG23 ' A' ' 121' ' ' ILE . 3.2 m -123.42 149.94 27.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.158 -0.474 . . . . 24.75 111.504 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 117' ' ' THR . . . . . 0.453 ' O ' HG12 ' A' ' 121' ' ' ILE . 67.5 p -98.73 144.54 27.86 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.791 -0.64 . . . . 27.239999999999998 110.061 179.182 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 118' ' ' ASP . . . . . 0.464 ' HA ' HD11 ' A' ' 121' ' ' ILE . 5.7 m-20 -48.65 -23.08 0.9 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.051 -0.522 . . . . 26.629999999999999 111.775 -179.492 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -77.31 -55.74 5.15 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 111.743 0.275 . . . . 29.140000000000001 111.743 -179.394 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.406 ' OE1' HG12 ' A' ' 116' ' ' VAL . 13.2 pt-20 -59.52 -38.43 80.96 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.624 -0.262 . . . . 24.190000000000001 111.588 -179.19 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.55 HD12 HD12 ' A' ' 105' ' ' LEU . 33.5 pt -73.15 -34.53 45.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 C-N-CA 120.996 -0.282 . . . . 22.329999999999998 111.515 -179.946 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.415 ' N ' HG13 ' A' ' 121' ' ' ILE . 15.5 t70 -57.05 -46.23 82.61 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.91 -0.404 . . . . 24.289999999999999 109.91 179.513 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.86 -37.69 88.47 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.068 -0.515 . . . . 24.739999999999998 110.119 179.038 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 5.2 ttp -53.16 -48.41 68.01 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.034 -0.53 . . . . 19.710000000000001 110.676 179.237 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.418 HG23 HD11 ' A' ' 136' ' ' ILE . 76.8 mt -61.05 -43.13 95.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.026 -0.534 . . . . 19.949999999999999 110.449 179.711 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 29.3 ttm180 -61.76 -33.82 74.76 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.957 -0.565 . . . . 24.949999999999999 110.87 179.841 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -69.06 -19.17 64.08 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.983 -0.553 . . . . 18.690000000000001 111.171 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.634 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -113.5 -5.06 13.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.228 -0.442 . . . . 16.469999999999999 111.217 -179.922 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 18.9 t0 -107.02 101.61 11.02 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.071 0.462 . . . . 20.399999999999999 110.903 -179.679 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 85.6 m-85 -86.77 -42.72 13.1 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.797 -0.638 . . . . 21.43 111.374 -179.784 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -59.69 -23.72 63.35 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.314 -0.403 . . . . 23.370000000000001 110.909 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 64.25 78.21 0.21 Allowed Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.857 -0.687 . . . . 24.32 112.739 179.632 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -143.38 6.56 1.49 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.844 0.354 . . . . 23.879999999999999 110.794 179.568 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 67.58 20.06 71.58 Favored Glycine 0 C--N 1.331 0.289 0 C-N-CA 120.87 -0.681 . . . . 22.670000000000002 112.698 179.888 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 72.8 mtp -136.76 155.24 50.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.805 0.336 . . . . 22.91 110.636 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.715 HG23 ' HB2' ' A' ' 140' ' ' GLU . 43.6 mm -114.7 144.76 21.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 121.163 0.506 . . . . 18.41 111.51 -179.566 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 137' ' ' ASN . . . . . 0.412 ' O ' ' N ' ' A' ' 139' ' ' GLU . 43.4 t30 -114.58 156.59 24.39 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.44 -0.8 . . . . 16.82 109.031 178.744 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 34.1 t80 -41.8 -24.07 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 120.864 0.364 . . . . 14.65 111.141 179.82 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.412 ' N ' ' O ' ' A' ' 137' ' ' ASN . 47.3 mt-10 -81.02 -55.35 4.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.113 -0.494 . . . . 14.82 110.632 179.928 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.715 ' HB2' HG23 ' A' ' 136' ' ' ILE . 36.9 mt-10 -57.38 -29.22 63.89 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.905 -0.589 . . . . 17.460000000000001 110.487 179.786 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.648 ' HA ' ' HE2' ' A' ' 144' ' ' MET . 86.0 t80 -71.68 -55.57 7.45 Favored 'General case' 0 C--N 1.334 -0.108 0 CA-C-N 116.06 -0.518 . . . . 12.93 110.122 179.322 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.555 HG13 ' SD ' ' A' ' 85' ' ' MET . 6.7 t -46.69 -35.13 2.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 CA-C-N 115.748 -0.66 . . . . 10.699999999999999 111.507 179.217 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 143' ' ' TRP . . . . . 0.569 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 84.1 t90 -73.35 -55.82 5.89 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.215 0.45 . . . . 13.66 112.215 -179.092 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 144' ' ' MET . . . . . 0.648 ' HE2' ' HA ' ' A' ' 141' ' ' PHE . 20.1 ptt? -63.11 -19.97 64.93 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.916 0.709 . . . . 14.5 112.916 -177.884 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 145' ' ' ILE . . . . . 0.57 HG13 ' N ' ' A' ' 146' ' ' SER . 33.3 pt -81.44 -48.73 18.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 N-CA-C 112.02 0.378 . . . . 11.25 112.02 179.851 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 146' ' ' SER . . . . . 0.57 ' N ' HG13 ' A' ' 145' ' ' ILE . 29.3 t -63.95 -14.29 52.66 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-O 121.264 0.554 . . . . 8.5399999999999991 109.999 -179.711 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 147' ' ' GLN . . . . . 0.569 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 2.1 mm100 -124.67 18.25 8.74 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.188 -0.915 . . . . 11.869999999999999 110.268 -179.235 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 148' ' ' LYS . . . . . 0.549 ' HB2' ' HA ' ' A' ' 145' ' ' ILE . 14.8 ttpp . . . . . 0 C--O 1.249 1.043 0 CA-C-N 115.289 -0.869 . . . . 13.68 111.053 -179.684 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 149' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 151' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 55.1 m . . . . . 0 N--CA 1.485 1.303 0 CA-C-O 120.769 0.318 . . . . 4.8899999999999997 110.854 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -102.81 153.18 20.43 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.23 -0.441 . . . . 3.2599999999999998 110.894 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.499 HD13 ' SG ' ' A' ' 69' ' ' CYS . 72.5 mt -68.57 96.61 0.72 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.126 -0.488 . . . . 1.27 110.631 179.719 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -77.79 166.62 22.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.986 -0.552 . . . . 1.1200000000000001 111.008 -179.653 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -52.52 -52.31 55.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.512 -0.313 . . . . 2.2000000000000002 111.677 179.822 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -68.58 -40.16 80.65 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.049 0.452 . . . . 1.3500000000000001 110.838 -179.374 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -60.63 -40.88 93.54 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.644 -0.707 . . . . 2.2200000000000002 111.014 -179.837 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.518 ' HA ' ' CZ ' ' A' ' 12' ' ' PHE . 72.7 mt -63.58 -49.4 82.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.264 -0.426 . . . . 0.54000000000000004 110.414 179.821 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.98 -18.96 65.63 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.949 -0.569 . . . . 0.5 110.849 179.658 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -71.76 -56.96 4.81 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 116.06 -0.518 . . . . 2.27 111.646 -179.117 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.518 ' CZ ' ' HA ' ' A' ' 9' ' ' ILE . 9.3 p90 -77.76 -26.65 49.97 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.595 -0.442 . . . . 0.37 110.751 -179.714 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.419 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 20.0 tptm -64.23 -36.71 84.97 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.234 -0.654 . . . . 1.23 109.234 178.639 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.423 ' O ' HG22 ' A' ' 17' ' ' VAL . 19.7 t70 -67.46 -48.18 67.95 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.772 -0.649 . . . . 0.44 109.393 178.374 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.18 -14.81 61.5 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.884 -0.598 . . . . 0.28999999999999998 110.952 179.002 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.419 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 36.9 t80 -79.16 -47.49 15.96 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.866 -0.606 . . . . 0.47999999999999998 110.807 -179.4 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.423 HG22 ' O ' ' A' ' 14' ' ' ASP . 31.6 m -70.18 -24.75 26.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.135 -0.484 . . . . 1.1100000000000001 110.849 -179.916 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.415 ' HG2' ' O ' ' A' ' 14' ' ' ASP . 76.6 mm-40 -60.58 -32.14 71.24 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.96 -0.564 . . . . 1.6000000000000001 111.365 179.816 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 20.5 m-85 -85.93 -20.96 28.2 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.569 -0.287 . . . . 0.64000000000000001 111.537 -179.57 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -80.19 90.13 5.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.934 0.397 . . . . 0.44 110.855 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 12.3 mmmm -100.18 4.49 44.43 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.03 -0.532 . . . . 2.1000000000000001 111.218 -179.688 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -99.41 -36.72 9.49 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.225 -0.443 . . . . 1.8 111.233 -179.434 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 96.85 30.06 7.75 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.774 -0.727 . . . . 0.46000000000000002 112.811 179.614 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 31.1 p -103.57 10.79 36.85 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.655 0.264 . . . . 0.40000000000000002 111.166 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.93 15.96 30.12 Favored Glycine 0 C--N 1.331 0.282 0 C-N-CA 120.715 -0.755 . . . . 0.33000000000000002 112.045 -179.67 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.508 ' HE3' ' HB3' ' A' ' 62' ' ' GLN . 5.1 mtmt -139.79 151.95 46.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.661 0.267 . . . . 1.1000000000000001 110.712 -179.769 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.418 ' N ' HE22 ' A' ' 62' ' ' GLN . 50.3 pt -119.28 136.25 57.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.49 -0.323 . . . . 0.5 111.251 -179.839 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -50.39 125.9 13.81 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.356 -0.384 . . . . 0.29999999999999999 110.949 179.891 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 6.9 t -62.62 -16.15 55.23 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.119 -0.491 . . . . 1.03 111.036 -179.869 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 65.8 mtp180 -75.99 -18.79 59.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.082 -0.508 . . . . 3.0800000000000001 110.353 179.701 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -104.28 0.57 29.45 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.707 -0.678 . . . . 2.2599999999999998 110.478 179.621 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.419 ' O ' ' HG2' ' A' ' 36' ' ' MET . 0.9 OUTLIER -60.85 -49.49 77.26 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.025 -0.534 . . . . 1.3700000000000001 110.311 179.936 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.584 ' HA2' HD11 ' A' ' 48' ' ' LEU . . . -54.18 -39.17 63.24 Favored Glycine 0 C--N 1.332 0.343 0 C-N-CA 120.502 -0.856 . . . . 0.32000000000000001 111.347 179.077 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 94.2 m -66.24 -33.03 74.83 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.243 0.544 . . . . 0.31 109.963 178.882 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 65.6 tp -70.96 -20.68 62.42 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.536 -0.756 . . . . 1.24 110.701 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.419 ' HG2' ' O ' ' A' ' 32' ' ' LEU . 90.8 mmm -80.29 -49.64 11.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.259 -0.428 . . . . 1.1000000000000001 111.104 179.757 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 10.6 ptm180 -60.62 -34.39 74.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.446 -0.343 . . . . 2.6899999999999999 110.983 179.905 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 14.5 t -72.25 -13.16 61.45 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.065 0.46 . . . . 1.0600000000000001 110.611 179.295 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 86.1 mt -113.11 156.91 22.34 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.581 -0.736 . . . . 1.26 110.487 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -44.35 -31.73 2.42 Favored Glycine 0 CA--C 1.52 0.345 0 C-N-CA 120.686 -0.769 . . . . 0.68999999999999995 112.689 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -64.14 160.07 19.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.827 0.346 . . . . 1.97 110.965 179.762 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 17.6 p-10 -164.28 76.23 1.59 Allowed Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.153 -0.476 . . . . 2.6600000000000001 110.739 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -66.19 150.18 85.07 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.642 2.228 . . . . 0.51000000000000001 112.562 -179.712 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 19.6 m -71.29 157.06 38.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.04 -0.527 . . . . 0.72999999999999998 110.469 179.588 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.425 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 0.9 OUTLIER -48.48 -54.76 13.01 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 111.608 0.225 . . . . 2.7000000000000002 111.608 -179.703 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -48.16 -55.49 10.23 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.569 -0.287 . . . . 0.46000000000000002 111.749 -179.496 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -56.74 -48.44 77.78 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.318 -0.401 . . . . 2.23 110.564 -179.785 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.584 HD11 ' HA2' ' A' ' 33' ' ' GLY . 14.3 tp -57.26 -35.65 70.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.116 -0.493 . . . . 1.3600000000000001 110.888 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.425 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 37.0 mm-40 -72.57 -33.33 66.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.386 -0.37 . . . . 1.22 110.509 179.663 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 63.1 m-20 -69.31 -54.11 16.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.083 -0.508 . . . . 0.62 111.707 -179.725 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.54 HD21 ' HA ' ' A' ' 48' ' ' LEU . 1.2 pp -63.78 -44.08 94.44 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 112.077 0.399 . . . . 0.39000000000000001 112.077 -179.123 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 76.8 mt -64.1 -44.94 97.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.742 0.306 . . . . 0.5 111.081 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.77 -52.42 63.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.322 -0.399 . . . . 0.58999999999999997 111.152 -179.821 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -60.38 -34.05 73.34 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.423 -0.353 . . . . 2.54 110.637 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -77.78 -15.8 58.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.366 -0.379 . . . . 0.53000000000000003 110.914 179.553 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -80.3 -51.3 9.07 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.252 -0.431 . . . . 1.95 111.309 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 9.5 p30 -88.44 30.4 0.89 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.423 -0.353 . . . . 2.48 111.504 -179.416 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -149.34 -18.09 0.28 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.39 -0.368 . . . . 2.48 110.971 179.534 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -135.79 21.38 3.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.217 -0.447 . . . . 2.0499999999999998 110.731 179.887 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 65.7 m-20 61.49 -86.38 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.928 -0.578 . . . . 1.47 111.522 179.821 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -146.53 4.28 1.07 Allowed Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.564 -0.827 . . . . 0.42999999999999999 112.833 -179.683 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.508 ' HB3' ' HE3' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -114.96 150.41 35.79 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.03 0.443 . . . . 0.38 111.093 179.863 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.434 ' HG ' ' HB2' ' A' ' 67' ' ' GLU . 0.5 OUTLIER -118.02 153.02 34.38 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.603 -0.726 . . . . 1.4299999999999999 109.96 -179.939 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ASN . . . . . 0.454 ' OD1' ' N ' ' A' ' 64' ' ' ASN . 0.6 OUTLIER -112.59 156.49 22.59 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.648 0.261 . . . . 1.1899999999999999 111.304 -178.388 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -48.54 -38.93 21.71 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.142 -0.481 . . . . 0.40000000000000002 110.919 179.862 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.22 -33.07 71.23 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.502 -0.317 . . . . 0.81000000000000005 111.065 179.779 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.434 ' HB2' ' HG ' ' A' ' 63' ' ' LEU . 12.9 mm-40 -66.32 -47.42 73.57 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.312 0.577 . . . . 1.3600000000000001 109.547 178.616 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.42 ' HE2' ' HB2' ' A' ' 12' ' ' PHE . 27.1 t80 -63.3 -55.35 25.45 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.297 -0.865 . . . . 0.51000000000000001 110.504 179.282 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.499 ' SG ' HD13 ' A' ' 4' ' ' LEU . 0.5 OUTLIER -56.18 -39.1 71.86 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.001 -0.545 . . . . 0.75 110.222 179.609 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -53.27 -50.25 53.02 Favored Glycine 0 N--CA 1.451 -0.343 0 CA-C-N 115.637 -0.711 . . . . 0.40999999999999998 112.148 179.682 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.546 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 11.6 mt -65.48 -44.09 94.29 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.36 0 CA-C-O 121.136 0.494 . . . . 0.51000000000000001 110.66 179.632 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' MET . . . . . 0.456 ' O ' ' HB2' ' A' ' 76' ' ' MET . 21.4 mtp -53.27 -33.07 51.63 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.9 -0.591 . . . . 1.01 109.654 179.613 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.11 -44.63 68.6 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.99 -0.55 . . . . 0.69999999999999996 110.791 179.479 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.546 ' HG2' ' O ' ' A' ' 71' ' ' ILE . 0.0 OUTLIER -65.96 -33.25 75.38 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.394 -0.366 . . . . 1.3799999999999999 111.58 -179.355 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 75' ' ' GLN . . . . . 0.419 ' O ' ' HG2' ' A' ' 78' ' ' GLU . 58.0 tt0 -83.16 -55.42 4.36 Favored 'General case' 0 CA--C 1.521 -0.135 0 CA-C-O 121.235 0.541 . . . . 1.98 111.14 -179.153 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' MET . . . . . 0.456 ' HB2' ' O ' ' A' ' 72' ' ' MET . 84.0 mtp -58.23 -20.96 46.12 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.12 -0.946 . . . . 1.2 112.633 -178.82 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 53.5 mtt180 -63.24 -13.91 43.26 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.371 0.508 . . . . 4.6900000000000004 112.371 -179.585 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.444 ' O ' ' HG3' ' A' ' 78' ' ' GLU . 11.9 pt-20 -63.48 77.97 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 121.094 0.473 . . . . 4.0099999999999998 111.555 -179.688 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 95.6 m -166.38 -47.18 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.22 -0.445 . . . . 5.2800000000000002 110.94 -179.72 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -118.75 -0.63 11.23 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.027 -0.533 . . . . 5.5999999999999996 111.25 -179.441 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.507 ' O ' ' HG2' ' A' ' 85' ' ' MET . 5.2 t 32.89 61.82 0.37 Allowed 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 121.039 0.447 . . . . 7.29 111.64 179.971 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -41.33 -41.84 2.05 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.552 -0.749 . . . . 9.7400000000000002 112.743 -179.025 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -55.52 -53.37 57.25 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 111.861 0.319 . . . . 12.109999999999999 111.861 -179.171 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -64.26 -15.64 60.52 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.36 -0.382 . . . . 10.869999999999999 111.572 -179.308 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' MET . . . . . 0.507 ' HG2' ' O ' ' A' ' 81' ' ' THR . 13.3 mmm -81.02 -36.6 30.39 Favored 'General case' 0 CA--C 1.511 -0.537 0 CA-C-O 121.738 0.78 . . . . 11.09 109.304 -178.837 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 6.2 tpt180 -64.2 -52.67 57.75 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.246 -1.343 . . . . 15.52 110.353 179.351 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -58.6 -36.11 73.48 Favored 'General case' 0 C--O 1.233 0.187 0 N-CA-C 109.754 -0.462 . . . . 14.85 109.754 178.99 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.75 -36.47 80.6 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.049 -0.523 . . . . 14.109999999999999 110.589 178.688 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 94.7 t80 -72.3 -16.82 61.9 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 116.014 -0.539 . . . . 15.73 110.465 179.711 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 16.8 tttt -79.46 -49.03 12.92 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 115.572 -0.74 . . . . 17.66 110.684 -179.625 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 65.7 mt -71.71 -44.79 68.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.809 -0.632 . . . . 18.149999999999999 111.517 -179.708 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.566 ' HD1' HG11 ' A' ' 108' ' ' VAL . 2.5 m-85 -61.11 -44.29 97.58 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.396 -0.365 . . . . 18.34 111.314 -179.656 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 45.7 t0 -72.33 105.03 3.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.386 -0.37 . . . . 19.289999999999999 110.354 179.766 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.543 ' HG2' ' HB3' ' A' ' 104' ' ' GLU . 19.7 mmm180 -59.42 -53.79 54.07 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.007 -0.542 . . . . 22.25 110.933 -179.561 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.43 ' HB2' ' OD1' ' A' ' 97' ' ' ASP . 0.6 OUTLIER -86.24 170.82 11.76 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.068 -0.515 . . . . 23.34 110.722 -179.88 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -97.74 5.53 62.06 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.901 -0.666 . . . . 22.0 112.155 179.866 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.43 ' OD1' ' HB2' ' A' ' 95' ' ' ASP . 6.5 p-10 -56.97 -43.82 82.02 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.734 0.302 . . . . 22.280000000000001 111.109 -179.777 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 114.61 20.84 5.65 Favored Glycine 0 CA--C 1.518 0.241 0 C-N-CA 120.837 -0.697 . . . . 19.93 112.869 179.633 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' PHE . . . . . 0.408 ' HA ' ' O ' ' A' ' 136' ' ' ILE . 98.5 m-85 -144.98 145.76 31.66 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.785 0.326 . . . . 20.300000000000001 111.071 179.861 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 56.2 mt -114.6 130.4 69.03 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 CA-C-N 116.208 -0.451 . . . . 19.370000000000001 110.679 179.429 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 68.6 m -114.41 156.06 45.0 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-N 116.148 -0.478 . . . . 22.489999999999998 110.684 -179.666 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_exo -43.59 -37.55 8.2 Favored 'Trans proline' 0 C--N 1.349 0.564 0 C-N-CA 122.38 2.053 . . . . 23.0 112.492 -179.807 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -62.21 -43.5 98.68 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.096 0.474 . . . . 24.559999999999999 110.657 179.569 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.543 ' HB3' ' HG2' ' A' ' 94' ' ' ARG . 43.8 mt-10 -73.82 -35.91 64.91 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.636 -0.711 . . . . 22.23 110.545 179.827 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.693 HD23 ' HB ' ' A' ' 121' ' ' ILE . 35.7 tp -60.75 -40.6 93.06 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.625 -0.716 . . . . 20.359999999999999 110.873 -179.606 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 8.7 ttm180 -69.98 -46.57 64.9 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.28 -0.418 . . . . 27.190000000000001 110.449 179.16 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -56.18 -41.83 76.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.992 -0.549 . . . . 25.359999999999999 111.58 -179.511 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.566 HG11 ' HD1' ' A' ' 92' ' ' PHE . 5.3 p -73.2 -49.23 39.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 C-N-CA 121.057 -0.257 . . . . 21.059999999999999 111.627 -179.516 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.464 ' N ' HG13 ' A' ' 108' ' ' VAL . 0.4 OUTLIER -50.5 -45.75 56.65 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.804 0.335 . . . . 20.93 110.667 179.936 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 42.4 mt -70.06 -30.16 42.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.174 -0.467 . . . . 25.129999999999999 110.185 179.31 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -68.18 -29.71 68.64 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.735 -0.666 . . . . 23.32 110.538 179.475 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.531 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 62.6 mt -72.97 -40.63 65.13 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.02 -0.536 . . . . 21.07 110.451 179.829 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 136.8 -1.59 3.21 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.941 -0.647 . . . . 23.050000000000001 112.331 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -117.02 130.73 56.87 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.926 0.393 . . . . 22.59 111.298 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 9.8 ptpp? -88.18 153.3 21.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.136 -0.484 . . . . 27.960000000000001 110.928 179.933 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 116' ' ' VAL . . . . . 0.435 ' HB ' HG23 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -152.1 155.6 6.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.03 -0.532 . . . . 24.75 111.314 -179.814 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 117' ' ' THR . . . . . 0.467 ' O ' HG12 ' A' ' 121' ' ' ILE . 73.0 p -94.42 138.41 32.39 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.935 -0.575 . . . . 27.239999999999998 110.186 179.671 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 118' ' ' ASP . . . . . 0.414 ' HA ' HD11 ' A' ' 121' ' ' ILE . 22.2 m-20 -50.0 -19.63 0.76 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.017 -0.538 . . . . 26.629999999999999 111.571 -179.49 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -77.48 -55.24 5.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.47 -0.332 . . . . 29.140000000000001 111.842 -179.414 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -62.48 -41.15 98.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.479 -0.328 . . . . 24.190000000000001 111.773 -179.091 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.693 ' HB ' HD23 ' A' ' 105' ' ' LEU . 15.1 pt -70.35 -38.14 73.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 C-N-CA 120.982 -0.287 . . . . 22.329999999999998 111.412 -179.431 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.421 ' N ' HG13 ' A' ' 121' ' ' ILE . 17.0 t70 -63.16 -32.87 74.36 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.928 0.394 . . . . 24.289999999999999 110.27 179.303 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 22.3 mm-40 -65.79 -46.97 76.7 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.012 -0.54 . . . . 24.739999999999998 110.53 179.541 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 55.5 ttp -56.73 -39.14 73.4 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.084 -0.507 . . . . 19.710000000000001 110.853 179.526 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.42 HD11 HD22 ' A' ' 105' ' ' LEU . 66.6 mt -64.92 -42.05 93.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.983 0.421 . . . . 19.949999999999999 110.301 179.61 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 35.2 ttp180 -59.14 -46.12 89.18 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.745 -0.662 . . . . 24.949999999999999 110.875 179.517 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -63.43 -29.73 70.97 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.832 -0.622 . . . . 18.690000000000001 111.237 -179.551 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.603 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -91.48 -13.84 31.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.852 0.358 . . . . 16.469999999999999 111.079 179.829 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 129' ' ' ASP . . . . . 0.42 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 5.9 t70 -101.04 105.86 17.1 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.123 -0.49 . . . . 20.399999999999999 110.924 -179.723 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -89.6 -41.36 12.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.951 -0.568 . . . . 21.43 111.609 -179.6 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -59.95 -26.14 65.75 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.867 0.365 . . . . 23.370000000000001 110.769 -179.614 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 72.05 79.34 0.44 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.804 -0.712 . . . . 24.32 112.87 179.782 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 13.3 p-10 -138.83 -33.28 0.65 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.651 0.263 . . . . 23.879999999999999 111.031 179.641 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 108.21 7.91 29.99 Favored Glycine 0 N--CA 1.452 -0.233 0 C-N-CA 120.799 -0.715 . . . . 22.670000000000002 112.669 179.892 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 63.9 mtp -130.71 155.53 46.46 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.622 0.249 . . . . 22.91 110.508 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.566 HG23 ' HB2' ' A' ' 140' ' ' GLU . 46.6 mm -114.69 143.34 24.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 121.207 0.527 . . . . 18.41 111.973 -179.501 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 137' ' ' ASN . . . . . 0.443 ' O ' ' N ' ' A' ' 139' ' ' GLU . 28.9 p-10 -115.71 157.94 23.54 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.282 -0.872 . . . . 16.82 108.749 178.257 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.669 ' O ' HG23 ' A' ' 142' ' ' VAL . 48.7 t80 -39.33 -24.23 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 112.312 0.486 . . . . 14.65 112.312 -179.358 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.443 ' N ' ' O ' ' A' ' 137' ' ' ASN . 12.8 mm-40 -80.77 -56.29 4.24 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 120.742 0.306 . . . . 14.82 111.45 -179.55 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.566 ' HB2' HG23 ' A' ' 136' ' ' ILE . 44.0 mt-10 -62.1 -25.57 67.79 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.149 0.499 . . . . 17.460000000000001 110.015 179.788 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.549 ' CE2' HD13 ' A' ' 145' ' ' ILE . 63.7 t80 -70.13 -55.29 9.78 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.618 -0.719 . . . . 12.93 110.111 179.235 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.669 HG23 ' O ' ' A' ' 138' ' ' TYR . 43.6 t -47.83 -44.21 10.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.697 -0.683 . . . . 10.699999999999999 111.463 179.736 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 84.2 t90 -63.77 -55.34 23.89 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.406 0.521 . . . . 13.66 112.406 -178.883 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 144' ' ' MET . . . . . 0.603 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 18.8 ptt? -61.31 -35.48 77.49 Favored 'General case' 0 N--CA 1.463 0.191 0 N-CA-C 112.726 0.639 . . . . 14.5 112.726 -177.921 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 145' ' ' ILE . . . . . 0.549 HD13 ' CE2' ' A' ' 141' ' ' PHE . 13.9 pt -76.53 -23.07 15.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 C-N-CA 120.809 -0.357 . . . . 11.25 111.721 -179.388 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 146' ' ' SER . . . . . 0.418 ' HB3' ' NE2' ' A' ' 147' ' ' GLN . 48.0 t -67.64 -29.84 69.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.99 0.424 . . . . 8.5399999999999991 110.245 179.945 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 147' ' ' GLN . . . . . 0.418 ' NE2' ' HB3' ' A' ' 146' ' ' SER . 13.9 mm-40 -91.61 -21.9 20.57 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.728 -0.669 . . . . 11.869999999999999 111.38 -179.759 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 148' ' ' LYS . . . . . 0.446 ' HG3' ' O ' ' A' ' 144' ' ' MET . 88.1 mttt . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.264 -0.874 . . . . 13.68 111.098 179.653 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 149' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 151' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 81.0 p . . . . . 0 N--CA 1.486 1.344 0 CA-C-O 120.656 0.265 . . . . 4.8899999999999997 110.943 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 65.26 148.18 0.04 OUTLIER 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 116.053 -0.522 . . . . 3.2599999999999998 111.268 179.863 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.9 mp -79.01 66.35 4.43 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.202 -0.454 . . . . 1.27 110.624 179.448 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -66.19 -153.71 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.846 0.355 . . . . 1.1200000000000001 111.242 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -80.3 -54.95 5.26 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.116 0.484 . . . . 2.2000000000000002 110.537 -179.561 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -70.29 -28.59 65.31 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.722 -0.672 . . . . 1.3500000000000001 110.199 179.812 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -66.57 -48.17 70.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.675 -0.693 . . . . 2.2200000000000002 110.565 179.575 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.541 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 64.5 mt -60.28 -40.68 84.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.08 -0.509 . . . . 0.54000000000000004 110.885 179.831 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -77.12 -18.79 57.66 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.979 0.418 . . . . 0.5 110.673 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -72.24 -56.26 5.83 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.865 -0.607 . . . . 2.27 111.751 -179.154 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.541 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 8.3 p90 -75.99 -26.83 57.1 Favored 'General case' 0 C--N 1.333 -0.152 0 C-N-CA 120.577 -0.449 . . . . 0.37 110.758 -179.843 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 26.1 tptp -64.12 -37.05 86.04 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 109.467 -0.568 . . . . 1.23 109.467 178.74 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -70.12 -46.79 64.06 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.857 -0.61 . . . . 0.44 109.691 178.666 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.69 -19.9 66.01 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.903 -0.59 . . . . 0.28999999999999998 110.392 179.246 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -79.4 -39.15 33.16 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.573 -0.739 . . . . 0.47999999999999998 110.522 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -71.57 -26.04 25.63 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.701 0 CA-C-N 115.939 -0.573 . . . . 1.1100000000000001 111.05 -179.888 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 82.2 mm-40 -61.13 -29.48 69.8 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.793 -0.64 . . . . 1.6000000000000001 111.357 -179.752 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 47.9 m-85 -93.16 -6.95 46.71 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.596 -0.275 . . . . 0.64000000000000001 111.338 -179.792 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -97.85 89.62 4.66 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.889 0.376 . . . . 0.44 110.697 179.395 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -99.52 -21.18 16.03 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.042 -0.526 . . . . 2.1000000000000001 111.266 -179.759 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -78.05 -11.08 59.88 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.262 -0.426 . . . . 1.8 111.193 -179.711 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.5 7.45 87.1 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.765 -0.731 . . . . 0.46000000000000002 112.814 179.702 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 76.2 p -76.67 5.36 7.68 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.674 0.273 . . . . 0.40000000000000002 111.146 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 56.15 23.84 41.58 Favored Glycine 0 C--N 1.332 0.331 0 C-N-CA 120.811 -0.709 . . . . 0.33000000000000002 111.73 -179.608 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.675 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 36.1 mtpt -136.09 155.87 49.56 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.725 0.298 . . . . 1.1000000000000001 111.346 -179.244 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.493 HG13 HD12 ' A' ' 63' ' ' LEU . 44.3 pt -117.93 129.8 73.77 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.2 0 CA-C-O 120.951 0.405 . . . . 0.5 111.367 179.876 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -52.47 141.3 20.33 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.186 -0.461 . . . . 0.29999999999999999 111.29 -179.732 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.511 ' HA ' HD11 ' A' ' 63' ' ' LEU . 38.7 p -66.69 -12.84 60.09 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.852 -0.613 . . . . 1.03 111.254 -179.896 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 39.0 mtp180 -89.43 5.34 45.73 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.974 -0.557 . . . . 3.0800000000000001 110.676 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -124.57 -7.92 7.43 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.081 -0.509 . . . . 2.2599999999999998 111.296 -179.537 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.669 HD23 HD13 ' A' ' 63' ' ' LEU . 1.2 tm? -56.15 -52.73 63.31 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.553 -0.294 . . . . 1.3700000000000001 110.746 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -53.95 -44.9 72.16 Favored Glycine 0 C--N 1.33 0.244 0 C-N-CA 120.598 -0.81 . . . . 0.32000000000000001 111.979 179.701 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 45.2 m -60.55 -32.52 71.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.037 0.446 . . . . 0.31 110.512 179.432 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -69.06 -31.36 70.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.815 -0.63 . . . . 1.24 110.701 -179.99 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.401 ' HG2' ' O ' ' A' ' 32' ' ' LEU . 69.7 mmm -76.96 -24.86 52.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.205 -0.452 . . . . 1.1000000000000001 110.325 179.766 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -71.32 -48.43 50.52 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.256 -0.429 . . . . 2.6899999999999999 110.581 179.319 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.2 t -64.52 -13.81 54.28 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.037 -0.529 . . . . 1.0600000000000001 111.21 179.847 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 10.4 mp -113.54 156.38 23.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.187 -0.46 . . . . 1.26 110.441 179.778 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -50.2 -18.32 2.14 Favored Glycine 0 CA--C 1.52 0.38 0 CA-C-N 115.827 -0.624 . . . . 0.68999999999999995 114.175 -179.014 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 11.8 mp0 -64.61 163.09 14.35 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 117.42 0.61 . . . . 1.97 111.105 -179.881 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -165.21 72.27 1.41 Allowed Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 115.932 -0.576 . . . . 2.6600000000000001 110.834 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -66.61 164.22 29.81 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.648 2.232 . . . . 0.51000000000000001 112.437 -179.833 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 44.2 m -82.58 152.05 26.12 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.028 -0.533 . . . . 0.72999999999999998 110.752 179.757 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -45.47 -52.52 10.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.441 -0.345 . . . . 2.7000000000000002 111.344 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.95 -47.82 70.9 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.215 -0.448 . . . . 0.46000000000000002 111.592 -179.738 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -53.38 -55.0 28.54 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.391 -0.368 . . . . 2.23 111.282 -179.851 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.408 HD23 HD21 ' A' ' 51' ' ' LEU . 39.6 mt -57.98 -44.86 87.35 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.537 -0.302 . . . . 1.3600000000000001 110.955 -179.998 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 83.5 mm-40 -62.56 -29.88 70.91 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.728 0.299 . . . . 1.22 111.288 -179.788 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -76.09 -52.59 9.83 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.345 -0.389 . . . . 0.62 111.903 -179.285 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.408 HD21 HD23 ' A' ' 48' ' ' LEU . 2.2 pp -68.94 -38.19 79.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.567 -0.288 . . . . 0.39000000000000001 111.602 -179.133 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 85.0 mt -65.06 -53.28 43.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.628 -0.26 . . . . 0.5 110.969 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.5 -35.47 79.47 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.799 0.333 . . . . 0.58999999999999997 111.145 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -62.92 -55.16 28.48 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.319 -0.401 . . . . 2.54 110.535 179.734 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -71.18 -14.83 62.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.076 -0.511 . . . . 0.53000000000000003 111.348 179.777 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -65.98 -51.93 54.01 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.435 -0.348 . . . . 1.95 110.979 -179.876 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 28.7 p-10 -94.58 22.22 6.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.215 -0.448 . . . . 2.48 111.352 -179.649 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 -134.36 -5.26 2.62 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.371 -0.377 . . . . 2.48 110.979 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 17.0 m120 -146.4 14.35 1.26 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.34 -0.391 . . . . 2.0499999999999998 111.046 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 28.4 m-80 62.96 7.69 2.79 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.027 -0.533 . . . . 1.47 111.845 179.578 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 108.0 38.66 1.97 Allowed Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.617 -0.801 . . . . 0.42999999999999999 112.945 179.49 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.675 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -144.21 155.51 43.92 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.974 0.416 . . . . 0.38 111.195 179.749 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.669 HD13 HD23 ' A' ' 32' ' ' LEU . 8.4 mt -128.37 153.99 46.47 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-N 116.033 -0.53 . . . . 1.4299999999999999 110.395 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -112.43 156.38 22.64 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 121.143 -0.223 . . . . 1.1899999999999999 110.696 -179.633 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -42.74 -32.44 0.6 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.285 -0.416 . . . . 0.40000000000000002 111.074 179.646 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.49 -41.27 55.82 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.209 -0.45 . . . . 0.81000000000000005 112.012 -179.727 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -63.36 -52.76 60.38 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.323 -0.399 . . . . 1.3600000000000001 110.493 -179.949 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.488 ' HD1' HD21 ' A' ' 32' ' ' LEU . 17.8 t80 -59.69 -55.16 37.87 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.933 -0.576 . . . . 0.51000000000000001 110.478 179.312 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 8.4 t -55.72 -41.96 74.61 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-N 116.077 -0.51 . . . . 0.75 110.468 179.902 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -48.81 -55.36 11.5 Favored Glycine 0 N--CA 1.45 -0.378 0 CA-C-N 115.462 -0.79 . . . . 0.40999999999999998 111.952 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.424 ' HA ' ' HG2' ' A' ' 74' ' ' LYS . 9.3 mt -64.41 -36.9 78.57 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 CA-C-O 120.897 0.379 . . . . 0.51000000000000001 110.422 179.386 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' MET . . . . . 0.471 ' HG3' ' O ' ' A' ' 68' ' ' PHE . 42.4 mtp -60.57 -28.67 68.64 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.87 -0.604 . . . . 1.01 110.055 179.27 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.31 -47.23 62.06 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.672 -0.694 . . . . 0.69999999999999996 110.433 179.788 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.424 ' HG2' ' HA ' ' A' ' 71' ' ' ILE . 54.2 pttt -75.14 -24.71 58.02 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.196 -0.457 . . . . 1.3799999999999999 111.203 179.671 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 19.8 tp60 -80.13 -55.39 4.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.18 -0.464 . . . . 1.98 111.452 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 11.5 mtm -63.36 -29.78 71.03 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 116.296 -0.411 . . . . 1.2 111.16 -179.754 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 63.6 ttt180 -69.64 -19.93 63.6 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.026 0.441 . . . . 4.6900000000000004 110.598 179.409 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 -86.29 -49.41 7.7 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.942 -0.572 . . . . 4.0099999999999998 111.29 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 96.3 m -76.51 87.65 3.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.294 -0.412 . . . . 5.2800000000000002 111.567 -179.396 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.4 p-10 -178.61 -65.98 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.974 -0.557 . . . . 5.5999999999999996 111.021 179.634 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.622 ' O ' ' HG3' ' A' ' 85' ' ' MET . 96.7 m 58.11 90.26 0.05 OUTLIER 'General case' 0 C--O 1.226 -0.156 0 CA-C-N 116.388 -0.369 . . . . 7.29 110.249 -179.322 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.512 ' HA ' ' SD ' ' A' ' 85' ' ' MET . 11.8 pt-20 -76.9 -20.65 55.97 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 113.362 0.875 . . . . 9.7400000000000002 113.362 -177.895 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.421 ' HG3' ' N ' ' A' ' 84' ' ' GLU . 10.9 pt-20 -59.61 -54.8 42.31 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.949 -0.3 . . . . 12.109999999999999 111.579 -179.245 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.499 ' HG2' HG22 ' A' ' 81' ' ' THR . 13.0 pt-20 -68.21 -14.39 62.95 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.772 0.32 . . . . 10.869999999999999 111.099 -179.678 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' MET . . . . . 0.622 ' HG3' ' O ' ' A' ' 81' ' ' THR . 20.2 mtt -77.66 -52.66 8.62 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.224 -0.444 . . . . 11.09 110.75 -179.5 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.403 ' O ' ' HG3' ' A' ' 90' ' ' LYS . 28.2 ttp180 -58.48 -46.92 85.65 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.961 -0.563 . . . . 15.52 110.402 179.862 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.46 ' HA ' ' HE2' ' A' ' 90' ' ' LYS . 1.4 tm-20 -55.78 -48.97 74.41 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 121.146 0.498 . . . . 14.85 109.976 178.917 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -63.76 -28.3 69.78 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.823 -0.626 . . . . 14.109999999999999 110.984 179.631 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 70.6 t80 -67.97 -38.02 82.24 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.018 0.437 . . . . 15.73 110.315 179.586 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.46 ' HE2' ' HA ' ' A' ' 87' ' ' GLU . 44.1 mtmt -64.05 -43.77 94.53 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.837 -0.62 . . . . 17.66 110.496 179.583 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 58.2 mt -63.76 -45.59 96.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.172 -0.467 . . . . 18.149999999999999 111.254 -179.922 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.606 ' HA ' HG21 ' A' ' 108' ' ' VAL . 6.3 m-85 -70.82 -14.7 62.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.473 -0.33 . . . . 18.34 111.449 -179.688 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -105.8 106.3 16.73 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.897 0.379 . . . . 19.289999999999999 110.868 179.791 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.67 -49.56 18.0 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.006 -0.543 . . . . 22.25 111.106 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -74.36 167.52 21.49 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.206 -0.452 . . . . 23.34 110.907 -179.884 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -94.19 5.16 71.42 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.886 -0.673 . . . . 22.0 112.033 179.609 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -67.89 -27.23 66.48 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.757 0.313 . . . . 22.280000000000001 111.189 -179.914 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 87.43 34.41 10.49 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.796 -0.716 . . . . 19.93 112.506 179.658 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' PHE . . . . . 0.502 ' HA ' ' O ' ' A' ' 136' ' ' ILE . 96.4 m-85 -141.08 147.46 38.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.663 0.268 . . . . 20.300000000000001 110.982 -179.954 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.523 ' HB ' ' HB ' ' A' ' 136' ' ' ILE . 58.3 mt -114.48 122.44 68.6 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 CA-C-N 116.24 -0.436 . . . . 19.370000000000001 111.265 -179.904 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 23.3 m -115.04 156.7 44.93 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 115.781 -0.645 . . . . 22.489999999999998 110.338 179.796 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 92.1 Cg_exo -41.18 -33.16 1.26 Allowed 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.408 2.072 . . . . 23.0 112.764 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.76 -41.73 87.29 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.249 -0.432 . . . . 24.559999999999999 111.498 -179.776 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.435 ' O ' HG23 ' A' ' 108' ' ' VAL . 44.4 mt-10 -79.87 -49.53 11.81 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.863 -0.608 . . . . 22.23 110.114 -179.482 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.526 HD11 ' HE3' ' A' ' 109' ' ' MET . 49.3 tp -51.95 -32.56 33.78 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.274 -0.875 . . . . 20.359999999999999 110.922 179.515 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 7.3 tmm_? -77.39 -48.23 17.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.754 -0.657 . . . . 27.190000000000001 110.987 -179.747 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 66.2 t80 -58.82 -34.41 71.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.215 -0.448 . . . . 25.359999999999999 111.557 -179.636 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.606 HG21 ' HA ' ' A' ' 92' ' ' PHE . 46.5 t -80.26 -53.71 12.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 N-CA-C 112.352 0.501 . . . . 21.059999999999999 112.352 -178.719 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.526 ' HE3' HD11 ' A' ' 105' ' ' LEU . 1.5 mtt -47.06 -37.44 9.47 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 111.858 0.318 . . . . 20.93 111.858 -179.333 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 89.2 mt -64.7 -35.02 73.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.773 0.32 . . . . 25.129999999999999 110.928 179.919 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 -67.61 -39.1 84.77 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.185 -0.461 . . . . 23.32 110.598 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.411 HD12 ' N ' ' A' ' 112' ' ' LEU . 8.6 mp -67.29 -43.25 82.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.987 -0.551 . . . . 21.07 110.822 -179.971 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 117.98 21.16 4.26 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.771 -0.728 . . . . 23.050000000000001 112.617 179.636 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -83.16 -23.01 33.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.566 0.222 . . . . 22.59 111.352 -179.841 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp 50.21 85.39 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.278 -0.419 . . . . 27.960000000000001 110.994 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 116' ' ' VAL . . . . . 0.434 HG12 ' OE1' ' A' ' 120' ' ' GLU . 8.8 m -129.17 155.79 41.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.138 -0.483 . . . . 24.75 111.844 -179.545 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 117' ' ' THR . . . . . 0.471 ' O ' HG12 ' A' ' 121' ' ' ILE . 57.8 p -100.62 148.48 24.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.673 -0.694 . . . . 27.239999999999998 110.084 179.072 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 118' ' ' ASP . . . . . 0.455 ' HA ' HD11 ' A' ' 121' ' ' ILE . 9.2 m-20 -51.83 -19.48 1.72 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.363 -0.38 . . . . 26.629999999999999 111.727 -179.37 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -78.95 -55.43 5.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.441 -0.345 . . . . 29.140000000000001 111.755 -179.443 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.434 ' OE1' HG12 ' A' ' 116' ' ' VAL . 14.5 pt-20 -60.84 -39.33 88.7 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.569 -0.287 . . . . 24.190000000000001 111.754 -179.245 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.564 HG13 ' N ' ' A' ' 122' ' ' ASP . 9.5 pt -69.86 -46.69 73.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 120.918 -0.313 . . . . 22.329999999999998 111.517 -179.69 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.564 ' N ' HG13 ' A' ' 121' ' ' ILE . 13.7 t70 -50.95 -41.11 58.83 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.835 0.35 . . . . 24.289999999999999 110.529 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -61.84 -54.37 43.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.045 -0.525 . . . . 24.739999999999998 110.131 179.189 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.431 ' CE ' HD21 ' A' ' 105' ' ' LEU . 5.4 tmm? -51.2 -34.26 31.04 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 115.817 -0.629 . . . . 19.710000000000001 110.745 179.357 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.46 HG13 ' O ' ' A' ' 121' ' ' ILE . 69.9 mt -65.01 -41.3 91.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.0 -0.546 . . . . 19.949999999999999 110.448 179.519 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 55.3 ttt180 -57.62 -38.26 74.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.745 -0.661 . . . . 24.949999999999999 110.402 179.888 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -61.69 -48.21 81.81 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.647 -0.706 . . . . 18.690000000000001 111.186 179.622 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.57 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -81.73 -7.38 59.59 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.097 -0.502 . . . . 16.469999999999999 111.167 -179.674 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -100.42 107.23 18.92 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.221 -0.445 . . . . 20.399999999999999 110.857 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 68.9 m-85 -94.06 -42.76 8.84 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.684 -0.689 . . . . 21.43 111.128 -179.748 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -55.9 -34.48 65.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.053 -0.521 . . . . 23.370000000000001 111.048 -179.627 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 81.17 72.24 1.24 Allowed Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.858 -0.686 . . . . 24.32 112.589 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -143.08 -5.54 0.87 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.717 0.294 . . . . 23.879999999999999 111.305 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 77.47 8.8 87.1 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.795 -0.717 . . . . 22.670000000000002 112.536 179.839 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 61.9 mtp -121.34 155.33 34.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.752 0.311 . . . . 22.91 110.516 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.712 HG23 ' HB2' ' A' ' 140' ' ' GLU . 38.7 mm -115.61 142.33 29.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 121.217 0.532 . . . . 18.41 112.092 -179.434 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 137' ' ' ASN . . . . . 0.443 ' O ' ' N ' ' A' ' 139' ' ' GLU . 54.3 t30 -115.71 157.54 24.12 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.323 -0.853 . . . . 16.82 108.985 178.431 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 45.7 t80 -39.7 -24.62 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 120.628 0.251 . . . . 14.65 111.604 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.443 ' N ' ' O ' ' A' ' 137' ' ' ASN . 46.7 mt-10 -80.79 -55.42 4.82 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.724 0.297 . . . . 14.82 110.803 -179.871 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.712 ' HB2' HG23 ' A' ' 136' ' ' ILE . 29.6 mt-10 -58.66 -35.64 72.87 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.152 0.501 . . . . 17.460000000000001 110.256 179.614 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.473 ' CE2' HD13 ' A' ' 145' ' ' ILE . 86.9 t80 -65.39 -55.43 18.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.658 -0.701 . . . . 12.93 110.296 179.484 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.587 HG13 ' SD ' ' A' ' 85' ' ' MET . 2.6 t -48.53 -34.18 5.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.55 -0.75 . . . . 10.699999999999999 111.78 179.366 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 143' ' ' TRP . . . . . 0.515 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 92.5 t90 -71.53 -55.51 7.69 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.577 0.584 . . . . 13.66 112.577 -178.79 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 144' ' ' MET . . . . . 0.57 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 21.5 ptt? -63.33 -26.53 68.8 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 112.819 0.674 . . . . 14.5 112.819 -177.675 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 145' ' ' ILE . . . . . 0.525 HG13 ' N ' ' A' ' 146' ' ' SER . 47.4 pt -81.01 -37.67 16.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 112.318 0.488 . . . . 11.25 112.318 -179.525 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 146' ' ' SER . . . . . 0.525 ' N ' HG13 ' A' ' 145' ' ' ILE . 33.2 t -59.32 -14.25 10.92 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.32 0.581 . . . . 8.5399999999999991 110.583 -179.537 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 147' ' ' GLN . . . . . 0.515 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 1.5 mm100 -100.58 -20.5 15.66 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.298 -0.865 . . . . 11.869999999999999 111.245 -178.993 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 68.5 mttm . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.179 -0.915 . . . . 13.68 110.87 179.744 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 149' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 151' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 88.2 p . . . . . 0 N--CA 1.486 1.356 0 CA-C-O 120.835 0.35 . . . . 4.8899999999999997 110.995 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -164.92 50.85 0.11 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.134 -0.484 . . . . 3.2599999999999998 110.496 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.53 HD12 ' SG ' ' A' ' 69' ' ' CYS . 15.6 mt -58.45 119.45 7.0 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.846 -0.615 . . . . 1.27 111.051 -179.756 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 75.0 p -69.41 -169.11 0.19 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.103 -0.499 . . . . 1.1200000000000001 111.44 -179.65 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -76.25 -38.26 56.54 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.35 -0.386 . . . . 2.2000000000000002 111.025 -179.565 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -72.75 -42.45 64.04 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.143 -0.48 . . . . 1.3500000000000001 110.928 -179.837 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -60.16 -47.81 84.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.144 -0.48 . . . . 2.2200000000000002 110.645 179.758 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.571 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 82.4 mt -57.38 -52.23 59.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.863 -0.608 . . . . 0.54000000000000004 111.195 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.91 -23.67 65.41 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.276 -0.42 . . . . 0.5 112.024 -179.411 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -71.42 -57.36 4.51 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 111.865 0.32 . . . . 2.27 111.865 -179.124 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.571 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 17.2 p90 -77.52 -23.43 50.19 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 120.47 -0.492 . . . . 0.37 110.645 -179.546 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.452 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 19.9 tptm -66.94 -36.07 81.4 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 109.229 -0.656 . . . . 1.23 109.229 178.528 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -67.89 -46.3 72.02 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 108.75 -0.833 . . . . 0.44 108.75 178.081 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.03 -14.46 61.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.488 -0.778 . . . . 0.28999999999999998 110.188 178.628 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.452 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 49.9 t80 -80.0 -52.16 8.18 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.819 -0.628 . . . . 0.47999999999999998 110.683 -179.839 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 24.6 m -63.43 -24.95 37.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.118 -0.492 . . . . 1.1100000000000001 110.516 -179.968 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 61.3 mm-40 -57.7 -28.67 64.04 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.671 -0.695 . . . . 1.6000000000000001 111.331 179.544 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -105.23 36.53 2.45 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.665 0.269 . . . . 0.64000000000000001 111.472 -179.692 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -129.69 68.9 1.42 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.157 0.503 . . . . 0.44 110.396 179.398 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -83.07 5.14 23.4 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.655 -0.702 . . . . 2.1000000000000001 111.222 -179.727 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -103.0 -2.77 27.03 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.367 -0.379 . . . . 1.8 111.193 -179.519 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 63.23 17.89 59.85 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.828 -0.701 . . . . 0.46000000000000002 112.812 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 37.5 p -92.18 8.39 38.24 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.71 0.291 . . . . 0.40000000000000002 111.242 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 54.14 21.45 18.26 Favored Glycine 0 C--N 1.333 0.383 0 C-N-CA 120.732 -0.747 . . . . 0.33000000000000002 111.79 -179.445 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.664 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 36.5 mtpt -133.96 155.76 49.37 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.549 -0.326 . . . . 1.1000000000000001 110.551 -179.295 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.508 ' N ' HE22 ' A' ' 62' ' ' GLN . 49.1 pt -118.73 130.89 72.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 120.901 0.382 . . . . 0.5 111.684 -179.781 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -54.1 135.68 43.1 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.226 -0.443 . . . . 0.29999999999999999 111.025 179.897 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.505 ' HA ' HD11 ' A' ' 63' ' ' LEU . 7.3 t -63.11 -22.2 66.7 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.047 -0.524 . . . . 1.03 111.223 -179.851 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 41.1 mtp180 -77.74 -3.89 43.56 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.082 -0.508 . . . . 3.0800000000000001 110.459 179.774 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -113.53 -5.43 13.45 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.942 -0.572 . . . . 2.2599999999999998 111.142 -179.804 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.57 -44.76 95.84 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 110.15 -0.315 . . . . 1.3700000000000001 110.15 179.65 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -58.43 -43.39 95.86 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.332 -0.937 . . . . 0.32000000000000001 110.976 178.828 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 44.8 m -65.16 -30.72 71.66 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.494 -0.558 . . . . 0.31 109.494 178.544 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 13.7 tp -64.21 -35.4 80.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.382 -0.826 . . . . 1.24 109.506 179.247 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.529 ' HG3' ' HG3' ' A' ' 43' ' ' PRO . 20.3 mmt -66.4 -41.28 89.56 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 115.535 -0.757 . . . . 1.1000000000000001 109.895 178.852 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 59.8 mtp180 -63.5 -26.95 68.95 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.628 -0.715 . . . . 2.6899999999999999 109.93 179.075 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.521 HG22 HD12 ' A' ' 39' ' ' LEU . 2.5 m -79.32 -16.56 56.16 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.536 -0.757 . . . . 1.0600000000000001 110.025 179.322 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.521 HD12 HG22 ' A' ' 38' ' ' THR . 10.3 mp -113.99 157.74 22.07 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.261 -0.881 . . . . 1.26 110.225 179.861 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -74.03 36.33 0.91 Allowed Glycine 0 CA--C 1.519 0.319 0 C-N-CA 120.498 -0.858 . . . . 0.68999999999999995 112.439 179.485 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.427 ' HG2' ' HB3' ' A' ' 39' ' ' LEU . 4.5 mm100 -89.29 -70.57 0.65 Allowed 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.831 0.348 . . . . 1.97 111.306 -179.88 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 60.24 67.48 1.64 Allowed Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 115.945 -0.57 . . . . 2.6600000000000001 110.488 -179.189 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.529 ' HG3' ' HG3' ' A' ' 36' ' ' MET . 69.3 Cg_endo -72.8 -172.86 1.04 Allowed 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.68 2.253 . . . . 0.51000000000000001 112.466 -179.88 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -93.01 150.35 20.6 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.936 -0.574 . . . . 0.72999999999999998 111.003 179.684 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.482 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 15.6 mt-10 -54.6 -46.13 73.77 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.524 -0.307 . . . . 2.7000000000000002 110.645 179.685 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -55.69 -52.94 62.16 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.302 -0.408 . . . . 0.46000000000000002 111.067 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -54.62 -47.26 73.65 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.182 -0.463 . . . . 2.23 110.893 -179.884 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.478 HD22 HD11 ' A' ' 52' ' ' ILE . 15.3 mt -60.39 -45.29 94.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.323 -0.399 . . . . 1.3600000000000001 110.971 179.746 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.482 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 33.0 mm-40 -63.08 -33.67 75.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.693 0.282 . . . . 1.22 111.145 -179.717 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -72.12 -54.03 10.97 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.214 0.45 . . . . 0.62 112.214 -179.299 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 3.2 pp -69.99 -41.26 74.63 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.127 0.417 . . . . 0.39000000000000001 112.127 -178.768 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.478 HD11 HD22 ' A' ' 48' ' ' LEU . 86.6 mt -65.3 -38.72 83.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-O 120.485 0.183 . . . . 0.5 111.093 -179.654 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.65 -37.91 83.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.89 0.376 . . . . 0.58999999999999997 110.516 179.487 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -64.38 -40.89 96.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.069 -0.514 . . . . 2.54 109.994 179.164 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -80.16 -14.76 58.22 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.968 -0.56 . . . . 0.53000000000000003 111.021 179.241 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -66.57 -49.96 64.69 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.262 -0.426 . . . . 1.95 110.948 -179.885 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 34.9 m-80 -85.88 34.85 0.61 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.151 -0.477 . . . . 2.48 110.806 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -157.41 151.57 24.73 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.165 -0.47 . . . . 2.48 110.757 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 4.1 m120 63.25 10.3 4.57 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.981 -0.554 . . . . 2.0499999999999998 111.404 179.847 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 88.3 m-20 62.74 13.33 6.34 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.336 -0.393 . . . . 1.47 111.845 179.702 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 104.67 38.5 2.55 Favored Glycine 0 C--N 1.33 0.247 0 C-N-CA 120.551 -0.833 . . . . 0.42999999999999999 112.763 179.419 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.664 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -142.5 155.61 45.06 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.991 0.424 . . . . 0.38 110.886 179.688 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.505 HD11 ' HA ' ' A' ' 29' ' ' THR . 29.0 mt -127.19 154.22 45.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.233 -0.44 . . . . 1.4299999999999999 110.92 -179.805 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ASN . . . . . 0.501 ' OD1' ' HE3' ' A' ' 26' ' ' LYS . 0.3 OUTLIER -114.37 157.33 22.98 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.665 -0.494 . . . . 1.1899999999999999 109.665 179.113 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 90.6 t80 -41.19 -33.88 0.41 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.578 0.228 . . . . 0.40000000000000002 111.361 179.871 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 8.2 m -70.78 -39.84 72.95 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.505 -0.316 . . . . 0.81000000000000005 111.622 -179.766 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.468 ' HG2' HD22 ' A' ' 64' ' ' ASN . 13.6 mm-40 -59.71 -55.75 30.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.126 0.489 . . . . 1.3600000000000001 110.804 179.668 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 25.3 t80 -63.77 -52.26 61.15 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.649 -0.705 . . . . 0.51000000000000001 111.145 -179.646 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.53 ' SG ' HD12 ' A' ' 4' ' ' LEU . 19.4 t -53.87 -40.85 66.92 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-O 121.378 0.609 . . . . 0.75 109.886 179.577 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -53.38 -46.6 64.09 Favored Glycine 0 CA--C 1.503 -0.704 0 CA-C-N 114.909 -1.041 . . . . 0.40999999999999998 111.719 179.523 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.537 ' HA ' ' HG2' ' A' ' 74' ' ' LYS . 44.8 mt -73.42 -45.86 50.89 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.93 0 CA-C-O 120.863 0.364 . . . . 0.51000000000000001 111.44 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' MET . . . . . 0.442 ' HB3' ' HE2' ' A' ' 76' ' ' MET . 0.1 OUTLIER -52.18 -33.45 40.73 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.816 -0.629 . . . . 1.01 110.181 179.235 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.91 -51.07 43.88 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.729 -0.669 . . . . 0.69999999999999996 110.874 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.537 ' HG2' ' HA ' ' A' ' 71' ' ' ILE . 63.6 pttt -69.63 -27.27 64.92 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 120.85 0.357 . . . . 1.3799999999999999 111.622 -179.82 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' GLN . . . . . 0.468 ' NE2' ' HB3' ' A' ' 43' ' ' PRO . 30.8 tt0 -80.63 -55.11 5.07 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.24 -0.436 . . . . 1.98 111.816 -179.141 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' MET . . . . . 0.442 ' HE2' ' HB3' ' A' ' 72' ' ' MET . 31.6 mtm -53.94 -47.39 71.32 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.313 -0.403 . . . . 1.2 111.166 -179.514 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 40.8 mmt180 -70.12 -34.17 72.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.535 -0.302 . . . . 4.6900000000000004 110.525 179.704 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.516 ' HG2' HG23 ' A' ' 79' ' ' THR . 41.3 tt0 57.87 -85.79 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.928 -0.578 . . . . 4.0099999999999998 111.254 179.83 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.516 HG23 ' HG2' ' A' ' 78' ' ' GLU . 63.7 p -130.06 130.28 44.69 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.411 -0.359 . . . . 5.2800000000000002 111.052 -179.917 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' ASP . . . . . 0.41 ' O ' ' HE3' ' A' ' 85' ' ' MET . 0.3 OUTLIER -104.23 22.23 15.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.146 -0.479 . . . . 5.5999999999999996 111.239 -179.975 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.422 ' O ' ' HG3' ' A' ' 85' ' ' MET . 75.4 m 60.03 89.39 0.07 Allowed 'General case' 0 N--CA 1.461 0.105 0 CA-C-N 116.323 -0.398 . . . . 7.29 110.571 -179.717 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.55 ' HA ' ' SD ' ' A' ' 85' ' ' MET . 44.9 mt-10 -79.78 -16.69 55.07 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 112.534 0.568 . . . . 9.7400000000000002 112.534 -178.713 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -69.18 -55.85 9.38 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.697 0.284 . . . . 12.109999999999999 111.638 -179.402 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -63.42 -15.23 56.99 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.922 0.392 . . . . 10.869999999999999 111.061 -179.798 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' MET . . . . . 0.657 ' SD ' HG13 ' A' ' 142' ' ' VAL . 19.0 mtt -80.18 -53.81 6.33 Favored 'General case' 0 CA--C 1.514 -0.405 0 CA-C-N 116.087 -0.506 . . . . 11.09 110.224 -179.65 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.449 ' O ' ' HG3' ' A' ' 90' ' ' LYS . 38.4 ttt180 -51.56 -41.04 60.84 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.28 -0.873 . . . . 15.52 110.378 179.362 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -72.15 -35.17 69.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.122 -0.49 . . . . 14.85 110.423 179.274 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -69.17 -28.3 66.29 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.123 -0.49 . . . . 14.109999999999999 111.051 179.713 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 86.3 t80 -73.82 -46.21 46.6 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.322 -0.399 . . . . 15.73 110.445 179.904 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.449 ' HG3' ' O ' ' A' ' 86' ' ' ARG . 90.5 mttt -58.25 -38.14 76.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.015 -0.539 . . . . 17.66 110.309 179.32 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 86.2 mt -75.69 -38.63 38.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.697 -0.683 . . . . 18.149999999999999 111.314 -179.782 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.4 ' O ' ' NE ' ' A' ' 94' ' ' ARG . 0.2 OUTLIER -66.14 -56.85 9.37 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.494 -0.321 . . . . 18.34 111.108 -179.621 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.571 ' HA ' HH21 ' A' ' 94' ' ' ARG . 44.1 t0 -49.11 123.44 7.25 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-O 120.789 0.328 . . . . 19.289999999999999 110.253 -179.884 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.687 ' HE ' ' N ' ' A' ' 94' ' ' ARG . 0.0 OUTLIER -91.84 -7.44 49.41 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.209 -0.45 . . . . 22.25 111.848 -178.513 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -126.55 -176.68 3.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.921 0.391 . . . . 23.34 110.904 179.788 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.45 0.7 55.71 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.916 -0.659 . . . . 22.0 112.229 179.643 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.93 -37.98 89.44 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.758 0.313 . . . . 22.280000000000001 111.239 -179.86 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 95.55 20.53 26.71 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.853 -0.689 . . . . 19.93 112.6 179.899 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' PHE . . . . . 0.42 ' HA ' ' O ' ' A' ' 136' ' ' ILE . 95.7 m-85 -136.32 151.77 49.96 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.702 0.286 . . . . 20.300000000000001 110.803 179.855 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.497 ' HB ' ' HB ' ' A' ' 136' ' ' ILE . 45.7 mt -114.96 133.04 62.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-O 121.096 0.474 . . . . 19.370000000000001 111.66 -179.606 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 75.7 m -114.57 156.06 45.19 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 115.576 -0.738 . . . . 22.489999999999998 110.119 179.2 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_exo -42.45 -47.53 7.38 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.529 2.153 . . . . 23.0 112.699 -179.454 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -59.61 -42.89 93.66 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.199 0.523 . . . . 24.559999999999999 111.045 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -65.51 -55.13 19.49 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.655 -0.702 . . . . 22.23 109.796 -179.947 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.449 ' CD2' ' HB ' ' A' ' 121' ' ' ILE . 40.6 tp -49.26 -34.63 15.6 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.002 -0.999 . . . . 20.359999999999999 110.325 179.443 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.405 ' HD3' HH11 ' A' ' 106' ' ' ARG . 2.4 tmm_? -69.86 -35.99 75.15 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.591 -0.732 . . . . 27.190000000000001 110.873 -179.781 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 68.0 t80 -67.0 -48.53 68.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.064 -0.516 . . . . 25.359999999999999 112.213 -179.389 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.446 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 99.3 t -67.92 -48.79 73.65 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 N-CA-C 112.103 0.408 . . . . 21.059999999999999 112.103 -179.045 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 2.2 mmt -45.23 -33.92 2.57 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 120.839 0.352 . . . . 20.93 110.833 179.987 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 67.2 mt -74.05 -44.38 50.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.105 -0.498 . . . . 25.129999999999999 110.766 179.501 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 81.2 m-20 -59.56 -24.97 64.16 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.947 -0.57 . . . . 23.32 110.699 179.641 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 64.0 mt -75.67 -32.52 60.19 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.94 -0.573 . . . . 21.07 110.626 179.997 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 121.71 -2.77 11.03 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.821 -0.704 . . . . 23.050000000000001 112.847 179.596 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -109.87 122.5 47.67 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.896 0.379 . . . . 22.59 111.379 -179.76 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 63.8 tttm -80.24 142.71 34.37 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.073 -0.512 . . . . 27.960000000000001 110.601 179.65 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' VAL . . . . . 0.468 ' HB ' HG23 ' A' ' 121' ' ' ILE . 1.9 m -150.09 155.51 7.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 121.074 0.464 . . . . 24.75 111.791 -179.697 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 117' ' ' THR . . . . . 0.432 ' O ' HG12 ' A' ' 121' ' ' ILE . 61.5 p -100.03 144.13 29.43 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.706 -0.679 . . . . 27.239999999999998 110.153 179.169 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -51.38 -18.98 1.16 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.265 -0.425 . . . . 26.629999999999999 111.698 -179.449 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -78.23 -54.08 6.63 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.575 -0.284 . . . . 29.140000000000001 111.647 -179.579 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -63.86 -40.34 96.35 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 111.808 0.299 . . . . 24.190000000000001 111.808 -179.146 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.532 HG13 ' N ' ' A' ' 122' ' ' ASP . 11.4 pt -70.64 -41.65 77.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 C-N-CA 121.025 -0.27 . . . . 22.329999999999998 111.588 -179.524 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.532 ' N ' HG13 ' A' ' 121' ' ' ILE . 21.4 t70 -58.7 -37.36 75.92 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.975 0.417 . . . . 24.289999999999999 110.161 179.568 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -65.82 -41.87 91.32 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.973 -0.558 . . . . 24.739999999999998 110.067 179.285 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 67.7 ttp -57.97 -36.56 72.76 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.069 -0.514 . . . . 19.710000000000001 110.057 178.969 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.457 HG23 HD11 ' A' ' 136' ' ' ILE . 84.1 mt -63.21 -42.64 97.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.799 -0.637 . . . . 19.949999999999999 109.822 179.203 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 1.8 tmm_? -58.06 -52.0 67.35 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.512 -0.767 . . . . 24.949999999999999 110.335 179.406 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -54.59 -23.57 17.5 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.124 -0.944 . . . . 18.690000000000001 111.78 -179.894 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.644 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -107.53 -10.58 15.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.839 0.352 . . . . 16.469999999999999 111.497 -179.776 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 27.6 t0 -98.36 106.14 18.38 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.218 -0.446 . . . . 20.399999999999999 110.932 -179.529 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 34.5 m-85 -85.41 -48.47 8.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.845 -0.616 . . . . 21.43 111.287 -179.59 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -60.14 -21.9 62.17 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.174 -0.466 . . . . 23.370000000000001 111.38 -179.656 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 60.75 77.01 0.2 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.654 -0.784 . . . . 24.32 112.614 179.929 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 13.1 p-10 -133.82 -15.83 2.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.848 0.356 . . . . 23.879999999999999 110.786 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 93.14 10.43 59.67 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.854 -0.688 . . . . 22.670000000000002 112.391 -179.887 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 38.1 mtp -131.31 154.52 48.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.606 0.241 . . . . 22.91 110.551 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.715 HG23 ' HB2' ' A' ' 140' ' ' GLU . 36.9 mm -114.86 144.23 22.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 121.331 0.586 . . . . 18.41 111.992 -179.256 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 137' ' ' ASN . . . . . 0.425 ' O ' ' N ' ' A' ' 139' ' ' GLU . 48.9 t30 -114.8 157.06 23.77 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.069 -0.969 . . . . 16.82 108.94 178.364 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 7.9 t80 -41.71 -23.14 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 120.663 0.268 . . . . 14.65 111.524 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.425 ' N ' ' O ' ' A' ' 137' ' ' ASN . 44.5 mt-10 -80.22 -56.01 4.52 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.684 0.278 . . . . 14.82 110.946 -179.806 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.715 ' HB2' HG23 ' A' ' 136' ' ' ILE . 34.1 mt-10 -59.23 -31.39 69.01 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.155 0.502 . . . . 17.460000000000001 110.23 179.629 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.646 ' HA ' ' HE2' ' A' ' 144' ' ' MET . 89.0 t80 -69.34 -55.48 10.29 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.503 -0.771 . . . . 12.93 110.271 179.568 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.657 HG13 ' SD ' ' A' ' 85' ' ' MET . 2.4 t -44.43 -42.38 2.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.569 -0.741 . . . . 10.699999999999999 112.036 179.075 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 143' ' ' TRP . . . . . 0.511 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 92.6 t90 -69.94 -56.09 7.94 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.329 0.492 . . . . 13.66 112.329 -178.849 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 144' ' ' MET . . . . . 0.646 ' HE2' ' HA ' ' A' ' 141' ' ' PHE . 20.3 ptt? -61.72 -21.17 64.26 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 113.27 0.841 . . . . 14.5 113.27 -177.723 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 145' ' ' ILE . . . . . 0.629 ' HA ' ' HB2' ' A' ' 148' ' ' LYS . 38.0 pt -80.79 -43.9 21.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 C-N-CA 120.619 -0.432 . . . . 11.25 111.813 -179.939 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 146' ' ' SER . . . . . 0.486 ' N ' HG13 ' A' ' 145' ' ' ILE . 31.2 t -63.07 -14.69 51.33 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.297 0.57 . . . . 8.5399999999999991 109.933 179.602 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 147' ' ' GLN . . . . . 0.511 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 0.7 OUTLIER -119.52 2.8 11.25 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.171 -0.922 . . . . 11.869999999999999 110.488 -179.232 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 148' ' ' LYS . . . . . 0.629 ' HB2' ' HA ' ' A' ' 145' ' ' ILE . 26.3 ttpp . . . . . 0 C--O 1.25 1.084 0 CA-C-O 118.249 -0.882 . . . . 13.68 110.987 -179.793 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 149' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 151' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 53.5 p . . . . . 0 N--CA 1.487 1.397 0 CA-C-O 120.704 0.288 . . . . 4.8899999999999997 110.984 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 55.31 69.22 0.76 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.164 -0.471 . . . . 3.2599999999999998 111.279 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.411 ' HG ' ' HE2' ' A' ' 12' ' ' PHE . 7.9 mp -54.42 93.28 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.942 -0.572 . . . . 1.27 110.896 179.457 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 36.9 p -78.63 -173.39 3.38 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.208 -0.451 . . . . 1.1200000000000001 111.538 -179.77 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -63.68 -42.91 97.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.272 -0.422 . . . . 2.2000000000000002 111.515 -179.664 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.408 ' HG3' ' N ' ' A' ' 8' ' ' GLN . 11.1 pt-20 -69.83 -42.44 73.6 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.082 0.467 . . . . 1.3500000000000001 110.51 -179.615 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.408 ' N ' ' HG3' ' A' ' 7' ' ' GLU . 79.2 mt-30 -63.84 -41.39 97.83 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.564 -0.744 . . . . 2.2200000000000002 110.671 179.825 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.494 ' HA ' ' CZ ' ' A' ' 12' ' ' PHE . 45.8 mt -60.71 -51.95 67.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.034 -0.53 . . . . 0.54000000000000004 110.57 179.592 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.94 -23.19 66.2 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.022 -0.535 . . . . 0.5 111.376 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -69.8 -56.64 6.6 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 111.903 0.334 . . . . 2.27 111.903 -179.224 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.494 ' CZ ' ' HA ' ' A' ' 9' ' ' ILE . 11.0 p90 -78.83 -26.92 44.2 Favored 'General case' 0 C--N 1.332 -0.187 0 C-N-CA 120.491 -0.484 . . . . 0.37 110.879 -179.78 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 19.4 tptm -63.67 -34.68 78.4 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.208 -0.664 . . . . 1.23 109.208 178.701 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.43 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 18.2 t70 -70.23 -53.34 17.4 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.644 -0.707 . . . . 0.44 109.206 178.384 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.0 -14.29 22.03 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.535 -0.757 . . . . 0.28999999999999998 110.749 179.165 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 41.8 t80 -80.34 -52.84 7.21 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.957 -0.565 . . . . 0.47999999999999998 110.961 -179.746 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 23.3 m -66.97 -17.92 23.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.076 -0.511 . . . . 1.1100000000000001 110.787 -179.595 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.43 ' HG2' ' O ' ' A' ' 14' ' ' ASP . 74.0 mm-40 -65.95 -29.52 69.93 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.81 -0.632 . . . . 1.6000000000000001 111.636 179.857 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 36.4 m-85 -101.24 18.34 20.19 Favored 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 111.818 0.303 . . . . 0.64000000000000001 111.818 -179.665 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -115.23 80.37 1.42 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.966 0.413 . . . . 0.44 110.798 179.424 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 14.1 tppt? -87.82 -29.39 20.99 Favored 'General case' 0 N--CA 1.441 -0.918 0 CA-C-N 115.878 -0.601 . . . . 2.1000000000000001 110.66 -179.872 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -68.07 -16.72 64.14 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.116 -0.493 . . . . 1.8 111.404 -179.473 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.39 9.67 86.82 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.731 -0.747 . . . . 0.46000000000000002 112.937 179.703 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 34.6 p -79.65 8.18 7.04 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.619 0.247 . . . . 0.40000000000000002 111.012 179.932 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 55.43 21.43 27.12 Favored Glycine 0 C--N 1.333 0.379 0 C-N-CA 120.733 -0.746 . . . . 0.33000000000000002 111.707 -179.58 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.688 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 53.9 mtpt -134.88 155.13 51.22 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.577 -0.311 . . . . 1.1000000000000001 110.775 -179.091 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.651 HG13 ' HB2' ' A' ' 63' ' ' LEU . 20.5 pt -115.52 127.7 73.01 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.317 0 CA-C-O 120.921 0.391 . . . . 0.5 111.964 -178.963 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -53.09 139.84 27.32 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.1 -0.5 . . . . 0.29999999999999999 111.427 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.531 ' HA ' HD11 ' A' ' 63' ' ' LEU . 7.3 t -65.72 -20.9 66.45 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.992 -0.549 . . . . 1.03 111.454 -179.749 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.496 ' HD3' ' H ' ' A' ' 30' ' ' ARG . 0.0 OUTLIER -83.6 5.08 25.59 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.881 0.372 . . . . 3.0800000000000001 110.48 179.64 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -120.29 -6.65 9.85 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.845 -0.616 . . . . 2.2599999999999998 111.006 -179.845 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.594 HD13 HD13 ' A' ' 51' ' ' LEU . 10.3 tt -58.46 -51.5 69.57 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 116.482 -0.326 . . . . 1.3700000000000001 110.791 179.751 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.413 ' HA2' HD21 ' A' ' 48' ' ' LEU . . . -52.7 -48.07 57.07 Favored Glycine 0 C--N 1.332 0.331 0 C-N-CA 120.33 -0.938 . . . . 0.32000000000000001 111.335 179.405 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.492 ' HA ' ' HG2' ' A' ' 37' ' ' ARG . 88.6 m -57.94 -36.65 72.81 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.394 0.616 . . . . 0.31 109.54 178.493 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.5 -32.1 73.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.087 -0.961 . . . . 1.24 110.297 179.532 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 23.7 mmt -73.83 -26.72 60.74 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.891 -0.595 . . . . 1.1000000000000001 110.316 179.388 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.492 ' HG2' ' HA ' ' A' ' 34' ' ' THR . 17.9 mmt180 -66.78 -50.86 61.33 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.818 -0.628 . . . . 2.6899999999999999 110.271 179.566 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.437 HG23 ' HG ' ' A' ' 39' ' ' LEU . 7.9 t -65.05 -12.62 52.55 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.772 -0.649 . . . . 1.0600000000000001 111.313 179.833 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.437 ' HG ' HG23 ' A' ' 38' ' ' THR . 64.8 mt -112.77 156.32 23.05 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.205 -0.452 . . . . 1.26 110.614 -179.825 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -67.45 10.68 0.94 Allowed Glycine 0 CA--C 1.521 0.441 0 C-N-CA 121.022 -0.608 . . . . 0.68999999999999995 113.141 -179.74 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.418 ' H ' ' C ' ' A' ' 39' ' ' LEU . 15.8 mm-40 -67.4 -79.03 0.05 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.92 0.39 . . . . 1.97 111.122 179.798 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 56.44 68.7 2.09 Favored Pre-proline 0 C--N 1.331 -0.217 0 CA-C-N 115.923 -0.581 . . . . 2.6600000000000001 111.065 -179.628 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.606 ' HG2' HD23 ' A' ' 48' ' ' LEU . 61.5 Cg_endo -71.9 -171.53 0.69 Allowed 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.687 2.258 . . . . 0.51000000000000001 112.346 179.86 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 38.1 m -94.87 152.42 18.39 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.161 -0.472 . . . . 0.72999999999999998 110.639 179.716 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.415 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 37.4 tt0 -48.85 -53.07 20.91 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.574 -0.285 . . . . 2.7000000000000002 111.28 -179.651 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -46.92 -54.69 9.49 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.298 -0.41 . . . . 0.46000000000000002 111.424 -179.752 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -54.91 -50.29 69.17 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.358 -0.383 . . . . 2.23 110.82 179.876 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.606 HD23 ' HG2' ' A' ' 43' ' ' PRO . 0.1 OUTLIER -55.82 -36.09 67.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.115 -0.493 . . . . 1.3600000000000001 111.032 -179.879 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.415 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 28.5 mm-40 -75.88 -32.16 59.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.256 -0.429 . . . . 1.22 111.247 -179.707 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 64.7 m-20 -70.1 -55.42 9.5 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.464 -0.334 . . . . 0.62 111.09 -179.842 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.594 HD13 HD13 ' A' ' 32' ' ' LEU . 1.9 pp -59.19 -39.44 82.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.314 -0.403 . . . . 0.39000000000000001 111.116 -179.923 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 35.8 mt -64.52 -40.8 90.31 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-O 120.636 0.255 . . . . 0.5 110.594 179.429 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.89 -30.92 71.2 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.383 -0.371 . . . . 0.58999999999999997 111.003 179.901 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -80.46 -47.33 14.49 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.105 -0.498 . . . . 2.54 111.394 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -75.49 -14.86 60.45 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.351 0.5 . . . . 0.53000000000000003 112.351 -179.16 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -69.31 -38.71 78.37 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.705 0.288 . . . . 1.95 111.065 -179.486 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 30.6 m-80 -95.25 28.79 2.71 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.346 -0.388 . . . . 2.48 110.563 179.84 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 7.8 t-20 -148.92 138.43 21.8 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.109 -0.496 . . . . 2.48 110.542 -179.679 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 77.4 m-20 62.68 14.58 7.33 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.181 -0.463 . . . . 2.0499999999999998 111.118 179.909 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 22.3 m-80 58.47 13.62 2.58 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.034 -0.53 . . . . 1.47 111.711 179.469 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 113.78 48.22 0.59 Allowed Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.564 -0.827 . . . . 0.42999999999999999 113.045 179.483 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.688 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -146.22 153.8 41.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.109 0.48 . . . . 0.38 111.198 179.513 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.651 ' HB2' HG13 ' A' ' 27' ' ' ILE . 16.3 mt -126.6 156.71 40.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.631 -0.713 . . . . 1.4299999999999999 110.549 -179.623 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ASN . . . . . 0.442 ' OD1' ' HE3' ' A' ' 26' ' ' LYS . 0.1 OUTLIER -112.68 156.6 22.48 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 121.023 -0.271 . . . . 1.1899999999999999 110.447 179.674 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.438 ' O ' ' HB2' ' A' ' 69' ' ' CYS . 83.9 t80 -45.59 -32.51 2.35 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.751 0.31 . . . . 0.40000000000000002 110.998 179.639 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -80.39 -36.86 33.28 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 112.16 0.43 . . . . 0.81000000000000005 112.16 -179.555 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -62.71 -51.54 66.79 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.473 0.654 . . . . 1.3600000000000001 109.802 179.478 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.436 ' O ' ' HG3' ' A' ' 72' ' ' MET . 35.3 t80 -61.66 -48.13 82.23 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.999 -1.0 . . . . 0.51000000000000001 110.578 179.378 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.438 ' HB2' ' O ' ' A' ' 65' ' ' PHE . 7.8 t -57.96 -48.36 80.18 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.156 -0.475 . . . . 0.75 110.528 179.86 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -48.47 -48.6 27.81 Favored Glycine 0 N--CA 1.45 -0.415 0 CA-C-N 115.72 -0.673 . . . . 0.40999999999999998 112.03 179.863 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.573 HG23 ' HE2' ' A' ' 74' ' ' LYS . 15.3 mt -63.49 -43.65 98.46 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.362 0 CA-C-O 121.153 0.502 . . . . 0.51000000000000001 110.504 179.41 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' MET . . . . . 0.436 ' HG3' ' O ' ' A' ' 68' ' ' PHE . 49.6 mtp -58.34 -26.67 63.38 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.637 -0.71 . . . . 1.01 110.076 179.535 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -72.55 -43.66 63.18 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.003 -0.544 . . . . 0.69999999999999996 110.704 179.557 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.573 ' HE2' HG23 ' A' ' 71' ' ' ILE . 48.7 pttt -73.9 -30.29 62.52 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.234 -0.439 . . . . 1.3799999999999999 111.125 -179.877 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -80.45 -47.19 14.7 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.112 0.412 . . . . 1.98 112.112 -179.694 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 48.2 mtp -68.83 -29.81 68.22 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 112.065 0.395 . . . . 1.2 112.065 -179.0 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 28.2 ptt180 -67.51 -14.38 62.88 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.461 0.172 . . . . 4.6900000000000004 111.207 -179.772 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.473 ' HG2' HG23 ' A' ' 79' ' ' THR . 43.1 tt0 -41.03 -77.02 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.228 -0.442 . . . . 4.0099999999999998 111.663 -179.523 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.473 HG23 ' HG2' ' A' ' 78' ' ' GLU . 41.8 p -139.82 142.56 36.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.871 0.367 . . . . 5.2800000000000002 111.442 -179.797 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' ASP . . . . . 0.442 ' H ' ' H ' ' A' ' 81' ' ' THR . 3.9 p30 -169.08 -8.05 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.986 -0.552 . . . . 5.5999999999999996 110.596 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.442 ' H ' ' H ' ' A' ' 80' ' ' ASP . 5.7 t -102.27 122.74 44.8 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.027 -0.533 . . . . 7.29 111.042 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.407 ' HB2' ' OH ' ' A' ' 138' ' ' TYR . 10.5 pt-20 -55.87 -17.65 6.91 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.917 -0.583 . . . . 9.7400000000000002 112.232 -179.034 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -68.43 -56.37 8.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.917 0.389 . . . . 12.109999999999999 111.264 -179.583 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -72.99 -15.29 61.54 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.114 0.483 . . . . 10.869999999999999 110.379 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' MET . . . . . 0.701 ' HB3' HG22 ' A' ' 142' ' ' VAL . 15.0 mtt -76.37 -48.4 20.04 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.83 -0.623 . . . . 11.09 110.393 -179.779 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.428 ' O ' ' HG3' ' A' ' 90' ' ' LYS . 19.9 ttt180 -62.82 -41.95 99.52 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.546 -0.539 . . . . 15.52 109.546 179.354 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -55.16 -43.47 74.29 Favored 'General case' 0 C--O 1.233 0.214 0 N-CA-C 109.402 -0.592 . . . . 14.85 109.402 178.525 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.54 -28.37 67.74 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.541 -0.754 . . . . 14.109999999999999 110.667 179.132 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 82.4 t80 -66.84 -39.12 87.53 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 116.231 -0.44 . . . . 15.73 110.472 179.638 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.428 ' HG3' ' O ' ' A' ' 86' ' ' ARG . 2.7 mtpm? -64.48 -49.14 72.57 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.27 0.557 . . . . 17.66 110.269 179.327 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 60.6 mt -62.96 -45.13 99.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.255 -0.884 . . . . 18.149999999999999 111.479 -179.228 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.514 ' CG ' HG11 ' A' ' 108' ' ' VAL . 0.6 OUTLIER -68.28 -18.65 64.59 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.252 -0.431 . . . . 18.34 111.59 -179.378 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 48.2 t0 -99.01 103.9 15.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.049 0.452 . . . . 19.289999999999999 110.702 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.56 ' NE ' HG22 ' A' ' 108' ' ' VAL . 0.0 OUTLIER -67.68 -11.63 58.72 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.773 -0.649 . . . . 22.25 111.681 -179.461 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.47 ' HB2' ' OD1' ' A' ' 97' ' ' ASP . 28.2 m-20 -116.65 166.98 11.49 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.986 0.422 . . . . 23.34 111.193 -179.789 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.61 5.15 56.81 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.973 -0.632 . . . . 22.0 112.375 179.498 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.47 ' OD1' ' HB2' ' A' ' 95' ' ' ASP . 7.6 p-10 -61.68 -38.13 86.67 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.665 0.269 . . . . 22.280000000000001 111.13 -179.691 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 111.34 18.73 7.93 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.738 -0.744 . . . . 19.93 112.749 179.843 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' PHE . . . . . 0.441 ' HA ' ' O ' ' A' ' 136' ' ' ILE . 92.3 m-85 -145.35 153.48 41.28 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 120.622 0.249 . . . . 20.300000000000001 110.854 179.803 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.402 HD13 ' HB3' ' A' ' 92' ' ' PHE . 63.9 mt -114.01 139.76 38.09 Favored 'Isoleucine or valine' 0 C--O 1.231 0.107 0 CA-C-O 121.014 0.435 . . . . 19.370000000000001 111.312 -179.918 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 16.5 m -121.77 156.22 59.25 Favored Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 115.747 -0.66 . . . . 22.489999999999998 110.434 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_exo -43.56 -32.95 4.11 Favored 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.498 2.132 . . . . 23.0 112.508 -179.753 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -62.55 -48.75 78.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.095 0.474 . . . . 24.559999999999999 111.248 179.91 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.661 ' O ' HG23 ' A' ' 108' ' ' VAL . 33.5 mt-10 -73.08 -42.15 63.33 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.652 -0.704 . . . . 22.23 110.193 -179.662 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.466 HD12 ' HB ' ' A' ' 121' ' ' ILE . 1.6 tm? -48.89 -54.33 15.82 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.425 -0.807 . . . . 20.359999999999999 109.624 179.794 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.545 ' HB2' HD13 ' A' ' 121' ' ' ILE . 17.1 ttp180 -58.29 -51.11 71.15 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.19 -0.914 . . . . 27.190000000000001 110.844 179.851 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 50.3 t80 -56.23 -26.35 50.91 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.029 -0.532 . . . . 25.359999999999999 112.012 -179.147 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.661 HG23 ' O ' ' A' ' 104' ' ' GLU . 58.8 t -80.55 -55.38 8.67 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.16 0 N-CA-C 112.549 0.574 . . . . 21.059999999999999 112.549 -179.063 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 109' ' ' MET . . . . . 0.591 ' SD ' HG21 ' A' ' 116' ' ' VAL . 0.1 OUTLIER -48.58 -47.42 39.68 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.277 0.561 . . . . 20.93 110.48 -179.347 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.468 HD11 ' HG3' ' A' ' 106' ' ' ARG . 27.7 mt -60.27 -30.79 46.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.257 -0.883 . . . . 25.129999999999999 111.187 -179.806 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 111' ' ' ASN . . . . . 0.474 HD22 HH21 ' A' ' 94' ' ' ARG . 92.6 m-20 -72.9 -28.99 62.81 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.22 -0.445 . . . . 23.32 110.846 179.29 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.454 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 6.5 mt -76.06 -27.64 57.33 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.159 -0.473 . . . . 21.07 110.695 -179.889 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 121.77 12.1 5.64 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.865 -0.683 . . . . 23.050000000000001 112.441 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -117.51 135.21 54.09 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.86 0.362 . . . . 22.59 111.133 -179.843 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -93.54 134.99 35.25 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.114 -0.494 . . . . 27.960000000000001 110.6 179.783 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 116' ' ' VAL . . . . . 0.591 HG21 ' SD ' ' A' ' 109' ' ' MET . 8.6 m -144.58 155.44 14.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 121.116 0.484 . . . . 24.75 111.986 -179.562 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 45.1 p -100.9 150.38 22.91 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.486 -0.779 . . . . 27.239999999999998 109.939 178.865 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -54.65 -19.74 6.72 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.736 0.303 . . . . 26.629999999999999 111.361 -179.66 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -78.73 -54.19 6.35 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.28 -0.418 . . . . 29.140000000000001 111.824 -179.364 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.471 ' OE1' HG12 ' A' ' 116' ' ' VAL . 13.5 pt-20 -61.34 -36.52 80.39 Favored 'General case' 0 C--O 1.233 0.237 0 N-CA-C 111.612 0.227 . . . . 24.190000000000001 111.612 -179.171 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.545 HD13 ' HB2' ' A' ' 106' ' ' ARG . 22.0 pt -73.47 -37.61 51.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 C-N-CA 121.041 -0.264 . . . . 22.329999999999998 111.017 179.86 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.519 ' N ' HG13 ' A' ' 121' ' ' ILE . 17.4 t70 -59.36 -38.36 80.23 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.991 0.425 . . . . 24.289999999999999 110.179 179.27 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -65.35 -49.97 67.36 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.863 -0.608 . . . . 24.739999999999998 110.474 179.542 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.435 ' SD ' ' HE2' ' A' ' 148' ' ' LYS . 56.3 ttp -52.44 -46.01 66.23 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.375 -0.375 . . . . 19.710000000000001 110.717 179.641 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.547 HG23 HD11 ' A' ' 136' ' ' ILE . 79.2 mt -61.6 -33.48 57.43 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 CA-C-N 116.072 -0.513 . . . . 19.949999999999999 110.742 179.476 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 16.7 tpt85 -65.74 -36.14 82.73 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.261 -0.427 . . . . 24.949999999999999 110.994 -179.613 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -62.48 -43.5 98.67 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.939 -0.573 . . . . 18.690000000000001 111.663 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.657 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -87.75 -18.64 28.97 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.303 -0.408 . . . . 16.469999999999999 111.756 -179.301 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 129' ' ' ASP . . . . . 0.461 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 22.3 t70 -93.75 106.65 18.61 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.027 0.441 . . . . 20.399999999999999 111.124 -179.627 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 79.1 m-85 -91.6 -33.0 15.29 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.824 -0.626 . . . . 21.43 110.669 179.839 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -64.12 -18.74 64.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.12 -0.491 . . . . 23.370000000000001 110.555 179.74 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 64.98 19.1 65.36 Favored Glycine 0 N--CA 1.45 -0.388 0 CA-C-N 115.632 -0.713 . . . . 24.32 112.467 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 7.8 p30 -86.29 3.89 41.35 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.608 0.242 . . . . 23.879999999999999 111.458 -179.749 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 62.09 23.28 63.74 Favored Glycine 0 N--CA 1.453 -0.221 0 C-N-CA 120.653 -0.785 . . . . 22.670000000000002 112.369 -179.854 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 92.8 mmm -130.73 145.54 51.97 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 110.36 -0.237 . . . . 22.91 110.36 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.607 HG23 ' HB2' ' A' ' 140' ' ' GLU . 50.4 mm -115.44 145.36 21.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.325 0.583 . . . . 18.41 112.104 -179.555 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 137' ' ' ASN . . . . . 0.471 ' O ' ' N ' ' A' ' 139' ' ' GLU . 29.1 p-10 -122.99 158.43 30.51 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.157 -0.929 . . . . 16.82 108.753 178.239 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.419 ' O ' HG23 ' A' ' 142' ' ' VAL . 18.0 t80 -38.5 -23.72 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 112.193 0.442 . . . . 14.65 112.193 -179.746 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.471 ' N ' ' O ' ' A' ' 137' ' ' ASN . 45.0 mt-10 -80.46 -56.14 4.39 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.678 0.275 . . . . 14.82 111.517 -179.454 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.607 ' HB2' HG23 ' A' ' 136' ' ' ILE . 34.3 mt-10 -63.13 -34.94 78.69 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.077 0.465 . . . . 17.460000000000001 110.506 179.944 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.474 ' CZ ' HG21 ' A' ' 145' ' ' ILE . 88.0 t80 -63.74 -55.51 22.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.746 -0.661 . . . . 12.93 110.51 179.725 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.701 HG22 ' HB3' ' A' ' 85' ' ' MET . 4.6 t -48.28 -42.54 11.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.79 -0.641 . . . . 10.699999999999999 111.732 179.353 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 143' ' ' TRP . . . . . 0.474 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 83.4 t90 -61.76 -55.32 31.36 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.53 0.567 . . . . 13.66 112.53 -178.704 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 144' ' ' MET . . . . . 0.657 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 11.9 ptt? -64.02 -40.04 95.45 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 112.797 0.666 . . . . 14.5 112.797 -177.653 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 145' ' ' ILE . . . . . 0.474 HG21 ' CZ ' ' A' ' 141' ' ' PHE . 37.2 pt -65.42 -29.09 46.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 N-CA-C 111.931 0.345 . . . . 11.25 111.931 -179.268 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 146' ' ' SER . . . . . 0.457 ' HB3' ' NE2' ' A' ' 147' ' ' GLN . 41.7 t -69.09 -32.98 72.8 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.901 0.381 . . . . 8.5399999999999991 110.459 -179.751 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 147' ' ' GLN . . . . . 0.474 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 8.6 mm-40 -95.98 -16.04 21.94 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.912 -0.585 . . . . 11.869999999999999 111.478 -179.895 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 148' ' ' LYS . . . . . 0.451 ' HG3' ' O ' ' A' ' 144' ' ' MET . 68.9 mttt . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.293 -0.861 . . . . 13.68 111.183 179.661 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 149' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 151' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.6 m . . . . . 0 N--CA 1.486 1.331 0 CA-C-O 120.847 0.356 . . . . 4.8899999999999997 110.851 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -151.97 133.23 14.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.079 -0.51 . . . . 3.2599999999999998 110.751 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.439 HD13 ' CZ ' ' A' ' 12' ' ' PHE . 39.3 mt -67.4 91.69 0.27 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.322 -0.399 . . . . 1.27 110.602 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 66.4 p -66.49 -159.94 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.81 -0.632 . . . . 1.1200000000000001 111.651 -179.635 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -76.78 -45.22 29.77 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.345 -0.389 . . . . 2.2000000000000002 110.948 -179.508 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.79 -39.26 70.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.99 -0.55 . . . . 1.3500000000000001 110.687 -179.782 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 80.3 mt-30 -60.94 -47.33 86.93 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.961 -0.563 . . . . 2.2200000000000002 110.659 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.448 ' HA ' ' CZ ' ' A' ' 12' ' ' PHE . 66.8 mt -59.7 -54.3 36.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.087 -0.506 . . . . 0.54000000000000004 110.897 179.712 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.31 -18.7 51.43 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.253 -0.43 . . . . 0.5 111.682 -179.707 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -74.21 -56.87 4.4 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.617 0.246 . . . . 2.27 111.65 -179.491 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.448 ' CZ ' ' HA ' ' A' ' 9' ' ' ILE . 9.5 p90 -79.4 -20.85 46.6 Favored 'General case' 0 C--N 1.332 -0.158 0 C-N-CA 120.598 -0.441 . . . . 0.37 110.747 -179.9 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.424 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 19.7 tptm -70.28 -39.32 74.98 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.204 -0.665 . . . . 1.23 109.204 178.644 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -64.93 -47.53 77.4 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 108.735 -0.839 . . . . 0.44 108.735 177.911 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.45 -28.88 70.12 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.429 -0.805 . . . . 0.28999999999999998 110.02 178.581 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.424 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 30.1 t80 -67.33 -40.98 85.97 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.546 -0.752 . . . . 0.47999999999999998 110.238 179.364 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -68.83 -28.27 39.11 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.784 0 CA-C-N 115.73 -0.668 . . . . 1.1100000000000001 110.972 -179.82 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 83.7 mm-40 -61.5 -33.11 73.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.597 -0.729 . . . . 1.6000000000000001 111.332 -179.96 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -93.74 -5.83 47.48 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.497 -0.319 . . . . 0.64000000000000001 111.45 -179.617 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -95.14 78.39 3.51 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.901 0.382 . . . . 0.44 110.467 179.301 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 29.7 mmmt -90.94 -33.24 15.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.945 -0.57 . . . . 2.1000000000000001 111.19 -179.636 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -62.43 -23.98 67.16 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.226 -0.443 . . . . 1.8 111.177 -179.782 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 87.09 11.41 69.88 Favored Glycine 0 N--CA 1.453 -0.213 0 C-N-CA 120.758 -0.734 . . . . 0.46000000000000002 112.627 179.774 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 30.3 p -86.1 11.26 12.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.778 0.323 . . . . 0.40000000000000002 111.139 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 55.26 25.11 39.14 Favored Glycine 0 C--N 1.332 0.327 0 C-N-CA 120.813 -0.708 . . . . 0.33000000000000002 112.227 -179.824 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.651 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 42.5 mtpt -134.09 155.8 49.4 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.788 0.327 . . . . 1.1000000000000001 111.032 -179.58 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.52 HG13 ' HB2' ' A' ' 63' ' ' LEU . 30.8 pt -114.96 136.18 52.47 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.325 0 N-CA-C 112.27 0.47 . . . . 0.5 112.27 -178.825 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.92 135.35 57.55 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.262 -0.426 . . . . 0.29999999999999999 111.343 179.734 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.575 ' HA ' HD11 ' A' ' 63' ' ' LEU . 9.9 t -65.75 -23.35 66.72 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.996 -0.547 . . . . 1.03 111.179 -179.894 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 29.9 mtp180 -77.79 -2.57 37.02 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.069 -0.514 . . . . 3.0800000000000001 110.372 179.556 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -111.79 -6.18 14.33 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.759 -0.655 . . . . 2.2599999999999998 110.872 179.995 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -51.78 -50.94 59.73 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.944 -0.571 . . . . 1.3700000000000001 110.46 179.675 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -58.78 -43.02 96.73 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.63 -0.795 . . . . 0.32000000000000001 111.828 179.515 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 31.1 m -59.15 -32.24 69.7 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.989 0.424 . . . . 0.31 110.516 179.428 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.3 mt -67.51 -41.23 84.76 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 115.851 -0.613 . . . . 1.24 110.643 179.771 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.569 ' HG3' ' HG3' ' A' ' 43' ' ' PRO . 14.6 mmt -66.91 -25.66 66.48 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.013 -0.539 . . . . 1.1000000000000001 110.741 179.894 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -74.85 -47.82 28.27 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.855 -0.611 . . . . 2.6899999999999999 110.954 179.453 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.519 HG23 ' HG ' ' A' ' 39' ' ' LEU . 9.9 t -70.52 -13.69 62.21 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.98 0.419 . . . . 1.0600000000000001 111.033 179.758 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.519 ' HG ' HG23 ' A' ' 38' ' ' THR . 57.4 mt -113.85 156.65 23.53 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.92 -0.582 . . . . 1.26 110.626 -179.798 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -52.92 -11.44 1.36 Allowed Glycine 0 CA--C 1.521 0.45 0 C-N-CA 121.178 -0.534 . . . . 0.68999999999999995 113.269 -179.764 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -58.63 166.03 1.99 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.931 0.396 . . . . 1.97 111.181 179.673 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 46.3 t30 -172.55 73.72 0.44 Allowed Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 115.884 -0.598 . . . . 2.6600000000000001 110.513 179.795 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.569 ' HG3' ' HG3' ' A' ' 36' ' ' MET . 83.1 Cg_endo -80.18 158.34 23.33 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.741 2.294 . . . . 0.51000000000000001 112.712 -179.779 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.0 p -67.83 146.32 53.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.98 -0.555 . . . . 0.72999999999999998 110.932 179.55 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.1 tt0 -48.38 -49.23 35.51 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.86 0.362 . . . . 2.7000000000000002 110.791 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.22 -44.81 88.37 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.998 -0.546 . . . . 0.46000000000000002 111.127 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -54.28 -46.42 72.7 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.248 -0.433 . . . . 2.23 110.935 -179.939 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 37.8 mt -60.84 -45.16 95.59 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.337 -0.392 . . . . 1.3600000000000001 110.826 179.702 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 81.7 mm-40 -64.67 -27.51 68.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.455 -0.339 . . . . 1.22 111.161 -179.674 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 43.5 m-20 -74.8 -55.07 6.21 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.477 -0.328 . . . . 0.62 111.633 -179.652 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 2.4 pp -67.38 -41.12 85.55 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.468 -0.333 . . . . 0.39000000000000001 111.701 -179.316 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 76.9 mt -62.77 -45.88 97.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 120.637 0.256 . . . . 0.5 110.853 -179.94 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.89 -33.68 75.19 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.886 0.374 . . . . 0.58999999999999997 110.516 179.53 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -63.6 -44.31 94.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.985 -0.552 . . . . 2.54 110.004 179.302 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -79.7 -16.89 54.85 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.915 -0.584 . . . . 0.53000000000000003 110.871 179.253 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -73.55 -43.0 60.95 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.122 -0.49 . . . . 1.95 111.035 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -102.87 47.83 0.88 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.143 -0.48 . . . . 2.48 111.118 -179.826 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -167.55 -55.17 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.2 -0.454 . . . . 2.48 110.927 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 18.3 m120 -97.4 24.85 6.12 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.171 -0.468 . . . . 2.0499999999999998 110.751 179.846 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 37.1 m-20 64.81 -80.08 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 115.89 -0.595 . . . . 1.47 111.239 179.904 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -165.88 18.97 0.1 OUTLIER Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.804 -0.712 . . . . 0.42999999999999999 112.418 179.943 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.651 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -128.31 155.49 44.55 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.96 0.409 . . . . 0.38 111.373 -179.837 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.575 HD11 ' HA ' ' A' ' 29' ' ' THR . 14.8 mt -126.09 155.46 41.56 Favored 'General case' 0 C--O 1.222 -0.361 0 CA-C-N 115.834 -0.621 . . . . 1.4299999999999999 110.7 -179.631 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ASN . . . . . 0.477 ' HB2' ' HG3' ' A' ' 67' ' ' GLU . 1.4 m-20 -111.68 156.51 21.75 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.652 -0.249 . . . . 1.1899999999999999 110.552 -179.607 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 90.0 t80 -43.86 -39.53 3.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.427 -0.351 . . . . 0.40000000000000002 111.399 -179.524 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -70.48 -39.07 74.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.528 -0.306 . . . . 0.81000000000000005 111.67 -179.878 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.477 ' HG3' ' HB2' ' A' ' 64' ' ' ASN . 14.0 mt-10 -62.06 -53.64 52.66 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.426 0.631 . . . . 1.3600000000000001 109.695 179.523 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.444 ' O ' ' HG2' ' A' ' 72' ' ' MET . 31.3 t80 -59.69 -54.98 40.05 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.934 -1.03 . . . . 0.51000000000000001 110.497 179.309 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 36.2 t -51.02 -53.97 28.81 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-N 116.169 -0.469 . . . . 0.75 110.458 179.506 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -41.82 -54.71 4.22 Favored Glycine 0 N--CA 1.451 -0.305 0 CA-C-N 115.281 -0.872 . . . . 0.40999999999999998 112.462 179.702 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.737 HG23 ' HE2' ' A' ' 74' ' ' LYS . 14.0 mt -64.84 -48.91 82.41 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.26 0 CA-C-O 121.037 0.446 . . . . 0.51000000000000001 110.946 179.692 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' MET . . . . . 0.444 ' HG2' ' O ' ' A' ' 68' ' ' PHE . 81.2 mmm -47.79 -36.82 12.32 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.833 -0.622 . . . . 1.01 110.042 179.289 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.517 ' O ' ' HG3' ' A' ' 77' ' ' ARG . . . -63.73 -55.34 23.99 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.415 -0.812 . . . . 0.69999999999999996 110.974 179.407 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.737 ' HE2' HG23 ' A' ' 71' ' ' ILE . 61.1 pttt -60.17 -33.32 72.03 Favored 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 112.017 0.377 . . . . 1.3799999999999999 112.017 -179.199 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 65.1 mt-30 -78.82 -51.96 9.0 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 111.77 0.285 . . . . 1.98 111.77 -179.873 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 2.2 mmm -56.7 -19.07 14.71 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 116.336 -0.393 . . . . 1.2 111.68 -179.431 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.517 ' HG3' ' O ' ' A' ' 73' ' ' ALA . 67.1 mtm180 -45.22 -34.54 2.85 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 120.762 0.315 . . . . 4.6900000000000004 110.792 179.054 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -71.32 82.67 0.76 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.127 -0.488 . . . . 4.0099999999999998 110.562 179.482 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 13.5 t -157.29 -8.93 0.09 Allowed 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.971 0.415 . . . . 5.2800000000000002 110.943 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -107.3 139.46 41.73 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.835 -0.62 . . . . 5.5999999999999996 110.9 179.631 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.624 ' O ' ' HG3' ' A' ' 85' ' ' MET . 13.5 m -141.64 79.69 1.69 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.985 -0.552 . . . . 7.29 110.692 179.209 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.447 ' CD ' ' H ' ' A' ' 82' ' ' GLU . 1.9 mp0 -39.54 -49.51 2.14 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 115.381 -0.827 . . . . 9.7400000000000002 112.973 -178.589 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -56.7 -43.62 80.71 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.86 0.362 . . . . 12.109999999999999 111.199 -179.463 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -75.25 -14.53 60.53 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.058 -0.519 . . . . 10.869999999999999 111.248 -179.596 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' MET . . . . . 0.624 ' HG3' ' O ' ' A' ' 81' ' ' THR . 4.5 mtt -80.55 -30.69 37.06 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 121.181 0.515 . . . . 11.09 110.081 -179.889 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 20.9 ttt180 -78.81 -45.44 20.91 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.383 -0.826 . . . . 15.52 110.6 -179.697 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -66.14 -42.58 88.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.125 -0.489 . . . . 14.85 110.872 179.63 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.1 -39.26 86.7 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.24 -0.436 . . . . 14.109999999999999 111.257 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -59.2 -42.24 90.44 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.043 0.449 . . . . 15.73 110.61 179.86 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 5.5 mtpm? -63.32 -43.15 98.62 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.707 -0.679 . . . . 17.66 111.274 179.798 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 83.4 mt -62.67 -50.58 79.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.188 -0.46 . . . . 18.149999999999999 111.624 -179.531 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -64.67 -38.74 92.03 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.559 -0.291 . . . . 18.34 111.332 -179.504 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 29.3 t0 -66.27 91.97 0.18 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.046 0.45 . . . . 19.289999999999999 110.27 179.597 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 2.7 mmp_? -62.05 -2.31 0.89 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.692 -0.686 . . . . 22.25 112.156 -179.316 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 40.8 m-20 -124.78 177.95 5.73 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.942 0.401 . . . . 23.34 110.968 179.66 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.55 -4.41 54.81 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.947 -0.644 . . . . 22.0 111.947 179.29 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.88 -39.25 87.44 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.76 0.314 . . . . 22.280000000000001 111.324 -179.919 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 104.2 40.72 2.21 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.741 -0.742 . . . . 19.93 112.312 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' PHE . . . . . 0.449 ' HA ' ' O ' ' A' ' 136' ' ' ILE . 95.6 m-85 -143.62 142.04 30.87 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.675 0.274 . . . . 20.300000000000001 110.86 -179.96 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.509 ' HB ' ' HB ' ' A' ' 136' ' ' ILE . 56.6 mt -114.22 120.94 65.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.196 0 CA-C-O 121.069 0.462 . . . . 19.370000000000001 111.1 -179.937 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 31.8 p -114.38 156.18 44.81 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 115.799 -0.637 . . . . 22.489999999999998 110.564 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -40.58 -36.06 1.69 Allowed 'Trans proline' 0 C--N 1.349 0.589 0 C-N-CA 122.592 2.195 . . . . 23.0 112.66 -179.6 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.458 ' O ' ' HG3' ' A' ' 106' ' ' ARG . . . -68.04 -55.41 12.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.078 0.466 . . . . 24.559999999999999 111.172 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -62.49 -31.1 71.79 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.924 -0.58 . . . . 22.23 110.956 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.619 HD23 ' HB ' ' A' ' 121' ' ' ILE . 37.2 tp -68.42 -55.28 12.44 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.715 -0.675 . . . . 20.359999999999999 112.004 -178.45 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.459 ' HB3' HD13 ' A' ' 121' ' ' ILE . 0.3 OUTLIER -57.07 -40.22 76.46 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.758 0.313 . . . . 27.190000000000001 111.485 -179.003 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 21.1 t80 -58.02 -54.17 49.93 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.361 -0.381 . . . . 25.359999999999999 111.255 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.412 ' O ' HD12 ' A' ' 112' ' ' LEU . 48.3 t -67.9 -40.73 83.98 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.197 0 CA-C-N 116.725 -0.216 . . . . 21.059999999999999 111.332 -179.764 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -50.8 -38.6 49.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.846 0.355 . . . . 20.93 110.791 179.972 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.685 ' HA ' ' HA ' ' A' ' 114' ' ' GLU . 88.0 mt -67.27 -24.12 31.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.044 -0.525 . . . . 25.129999999999999 111.244 179.648 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -72.56 -21.27 61.18 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.069 -0.514 . . . . 23.32 110.354 179.167 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.412 HD12 ' O ' ' A' ' 108' ' ' VAL . 6.2 mp -93.76 -84.8 0.3 Allowed 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.168 -0.469 . . . . 21.07 111.415 -179.966 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 113' ' ' GLY . . . . . 0.484 ' O ' ' HG2' ' A' ' 114' ' ' GLU . . . -117.49 -1.64 17.88 Favored Glycine 0 C--N 1.334 0.435 0 C-N-CA 120.702 -0.761 . . . . 23.050000000000001 112.696 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.685 ' HA ' ' HA ' ' A' ' 110' ' ' ILE . 9.1 pt-20 42.62 -170.12 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 114.284 1.216 . . . . 22.59 114.284 179.137 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.609 ' HG2' ' HG3' ' A' ' 114' ' ' GLU . 3.4 mmmp? 66.11 54.64 0.96 Allowed 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 114.535 -1.212 . . . . 27.960000000000001 111.548 -179.81 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 116' ' ' VAL . . . . . 0.543 ' HB ' HG23 ' A' ' 121' ' ' ILE . 1.5 m -130.11 115.38 32.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.998 -0.546 . . . . 24.75 110.991 178.837 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 72.9 p -69.32 146.69 51.99 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.186 -0.461 . . . . 27.239999999999998 110.257 179.713 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 118' ' ' ASP . . . . . 0.478 ' HA ' HD11 ' A' ' 121' ' ' ILE . 9.2 m-20 -53.63 -17.46 2.19 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.244 -0.434 . . . . 26.629999999999999 111.102 -179.897 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.402 ' O ' ' HG2' ' A' ' 123' ' ' GLU . 46.9 mt-10 -79.77 -55.48 4.97 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.299 -0.41 . . . . 29.140000000000001 111.81 -179.559 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.472 ' OE1' HG12 ' A' ' 116' ' ' VAL . 13.5 pt-20 -58.07 -43.69 87.1 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 120.551 0.215 . . . . 24.190000000000001 111.395 -179.311 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.619 ' HB ' HD23 ' A' ' 105' ' ' LEU . 1.8 pt -68.68 -40.17 81.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 C-N-CA 121.037 -0.265 . . . . 22.329999999999998 111.127 179.795 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -61.41 -42.05 98.12 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.753 0.311 . . . . 24.289999999999999 110.5 179.583 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.402 ' HG2' ' O ' ' A' ' 119' ' ' GLU . 20.3 mm-40 -57.71 -45.09 86.19 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.24 -0.436 . . . . 24.739999999999998 110.264 179.419 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 58.6 ttp -57.57 -37.15 72.66 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.068 -0.515 . . . . 19.710000000000001 110.292 179.1 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.544 HG23 HD11 ' A' ' 136' ' ' ILE . 64.4 mt -66.66 -42.3 89.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 115.858 -0.61 . . . . 19.949999999999999 110.414 179.386 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 66.0 ttt180 -59.6 -37.29 78.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.794 -0.639 . . . . 24.949999999999999 110.931 179.739 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -63.99 -33.16 75.11 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.054 -0.521 . . . . 18.690000000000001 111.344 -179.762 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.681 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -95.86 -17.55 21.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.474 -0.33 . . . . 16.469999999999999 111.305 -179.824 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 129' ' ' ASP . . . . . 0.427 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 14.4 t0 -94.31 100.51 12.54 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.211 -0.449 . . . . 20.399999999999999 110.761 -179.852 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 88.1 m-85 -85.34 -43.07 14.01 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.899 -0.591 . . . . 21.43 111.462 -179.446 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -60.05 -24.19 64.35 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.413 -0.358 . . . . 23.370000000000001 110.798 -179.714 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 66.17 78.02 0.25 Allowed Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.91 -0.662 . . . . 24.32 112.855 179.655 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -135.29 -27.1 1.23 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.769 0.318 . . . . 23.879999999999999 110.935 179.715 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 102.9 13.47 29.37 Favored Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.82 -0.705 . . . . 22.670000000000002 112.681 179.875 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 70.2 mtp -133.05 153.63 51.32 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.677 0.275 . . . . 22.91 110.586 179.805 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.59 HG23 ' HB2' ' A' ' 140' ' ' GLU . 42.3 mm -114.95 145.65 20.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 121.282 0.563 . . . . 18.41 111.987 -179.579 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 137' ' ' ASN . . . . . 0.43 ' OD1' ' HB2' ' A' ' 139' ' ' GLU . 1.0 OUTLIER -119.93 157.19 29.29 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.171 -0.922 . . . . 16.82 108.965 178.136 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 79.9 t80 -39.99 -23.96 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 112.06 0.393 . . . . 14.65 112.06 -179.6 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.43 ' HB2' ' OD1' ' A' ' 137' ' ' ASN . 38.5 mt-10 -80.76 -56.13 4.35 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 120.697 0.284 . . . . 14.82 111.18 -179.223 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.59 ' HB2' HG23 ' A' ' 136' ' ' ILE . 59.8 mt-10 -60.46 -34.8 74.53 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.341 -0.391 . . . . 17.460000000000001 110.353 -179.927 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.451 ' CZ ' HG21 ' A' ' 145' ' ' ILE . 85.3 t80 -63.96 -55.0 25.67 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.0 -0.545 . . . . 12.93 110.125 179.174 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 142' ' ' VAL . . . . . 0.582 HG13 ' SD ' ' A' ' 85' ' ' MET . 2.6 t -47.91 -36.82 5.89 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-N 115.464 -0.789 . . . . 10.699999999999999 111.79 179.306 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 143' ' ' TRP . . . . . 0.546 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 91.5 t90 -69.79 -55.96 8.43 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.824 0.675 . . . . 13.66 112.824 -178.737 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 144' ' ' MET . . . . . 0.681 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 18.7 ptt? -63.91 -23.57 67.4 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 113.175 0.805 . . . . 14.5 113.175 -177.521 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 145' ' ' ILE . . . . . 0.537 HG13 ' N ' ' A' ' 146' ' ' SER . 49.2 pt -80.49 -40.7 19.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 N-CA-C 112.399 0.518 . . . . 11.25 112.399 -179.28 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 146' ' ' SER . . . . . 0.537 ' N ' HG13 ' A' ' 145' ' ' ILE . 78.7 p -61.21 -13.79 20.88 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.181 0.515 . . . . 8.5399999999999991 110.55 -179.71 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 147' ' ' GLN . . . . . 0.546 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 3.1 mm100 -98.49 -19.11 17.84 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.377 -0.828 . . . . 11.869999999999999 111.289 -179.16 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 148' ' ' LYS . . . . . 0.406 ' HG3' ' O ' ' A' ' 144' ' ' MET . 99.1 mttt . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.234 -0.889 . . . . 13.68 110.959 179.749 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 149' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 151' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.502 HD12 ' SD ' ' A' ' 76' ' ' MET . 0.6 OUTLIER . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.705 0.288 . . . . 1.27 110.35 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 74.0 p -70.01 -177.63 1.39 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.42 -0.355 . . . . 1.1200000000000001 111.341 -179.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -63.41 -48.02 79.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.435 -0.348 . . . . 2.2000000000000002 111.492 -179.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -67.14 -41.54 85.91 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.976 0.417 . . . . 1.3500000000000001 110.906 -179.425 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . 0.568 HE21 ' HA ' ' A' ' 8' ' ' GLN . 0.0 OUTLIER -64.28 -45.63 87.2 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.822 -0.627 . . . . 2.2200000000000002 111.037 179.948 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.532 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 56.5 mt -58.1 -51.16 74.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.432 -0.349 . . . . 0.54000000000000004 110.543 179.526 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.87 -19.26 65.7 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.149 -0.478 . . . . 0.5 111.189 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -72.44 -56.57 5.21 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.275 -0.42 . . . . 2.27 111.777 -179.275 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.532 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 28.1 p90 -79.03 -24.41 43.67 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 120.532 -0.467 . . . . 0.37 110.625 -179.739 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 19.7 tptm -66.62 -37.13 84.23 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 109.174 -0.676 . . . . 1.23 109.174 178.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.519 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 27.4 t70 -66.97 -50.7 61.48 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 109.121 -0.696 . . . . 0.44 109.121 178.332 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.81 -14.51 59.43 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.679 -0.692 . . . . 0.28999999999999998 110.612 179.042 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 75.5 t80 -80.08 -47.76 14.31 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.845 -0.616 . . . . 0.47999999999999998 110.647 -179.677 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 26.8 m -69.65 -20.49 23.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.142 -0.481 . . . . 1.1100000000000001 110.302 179.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.519 ' HG3' ' O ' ' A' ' 14' ' ' ASP . 74.5 mt-30 -58.97 -35.5 73.3 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.729 -0.669 . . . . 1.6000000000000001 111.02 179.434 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 88.1 m-85 -105.91 44.16 1.07 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.276 -0.42 . . . . 0.64000000000000001 111.509 -179.499 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -135.27 70.4 1.44 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.017 0.437 . . . . 0.44 110.72 179.463 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.438 ' N ' ' HD2' ' A' ' 21' ' ' LYS . 0.9 OUTLIER -78.24 -25.95 47.09 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.92 -0.582 . . . . 2.1000000000000001 110.89 179.983 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -70.3 -11.75 61.12 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.011 -0.54 . . . . 1.8 111.213 -179.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.46 17.22 66.27 Favored Glycine 0 C--N 1.33 0.208 0 C-N-CA 120.857 -0.687 . . . . 0.46000000000000002 112.898 179.655 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 60.0 p -90.39 8.24 34.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.751 0.31 . . . . 0.40000000000000002 111.181 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 57.93 19.59 37.8 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.854 -0.688 . . . . 0.33000000000000002 112.126 -179.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.513 ' HD3' ' OD1' ' A' ' 64' ' ' ASN . 20.7 mtmm -128.23 154.54 45.74 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.928 0.394 . . . . 1.1000000000000001 111.205 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.43 HG13 ' O ' ' A' ' 27' ' ' ILE . 45.7 pt -120.64 129.27 75.79 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.111 -0.495 . . . . 0.5 110.823 179.567 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -53.24 134.88 39.17 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.803 0.335 . . . . 0.29999999999999999 110.882 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 5.9 t -61.2 -17.19 51.89 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.096 -0.502 . . . . 1.03 110.869 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 59.1 mtt180 -78.79 -19.12 52.91 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.885 -0.598 . . . . 3.0800000000000001 110.488 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 33.3 mm-40 -97.28 -2.05 43.42 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.656 -0.702 . . . . 2.2599999999999998 110.9 179.813 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.556 HD23 HD22 ' A' ' 63' ' ' LEU . 0.4 OUTLIER -55.64 -54.79 39.84 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.908 -0.587 . . . . 1.3700000000000001 110.956 -179.956 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -56.14 -39.4 80.57 Favored Glycine 0 C--N 1.331 0.274 0 C-N-CA 120.654 -0.784 . . . . 0.32000000000000001 112.152 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 32.1 m -65.4 -35.96 82.51 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.995 0.426 . . . . 0.31 110.645 179.584 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 24.4 tp -68.52 -36.62 79.11 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.896 -0.593 . . . . 1.24 110.677 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.539 ' HG3' ' HG3' ' A' ' 43' ' ' PRO . 23.2 mmt -62.27 -42.0 98.96 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.273 -0.421 . . . . 1.1000000000000001 109.925 179.098 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -63.92 -33.39 75.59 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.771 -0.65 . . . . 2.6899999999999999 109.691 179.033 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.4 m -72.57 -16.92 61.75 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.315 -0.857 . . . . 1.0600000000000001 110.385 179.352 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 95.1 mt -114.0 157.24 22.73 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.663 -0.698 . . . . 1.26 110.641 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -52.98 -9.88 0.93 Allowed Glycine 0 CA--C 1.521 0.434 0 C-N-CA 120.997 -0.62 . . . . 0.68999999999999995 113.245 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 73.6 mm-40 -66.29 174.45 2.64 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.941 0.401 . . . . 1.97 111.314 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -173.01 67.91 0.37 Allowed Pre-proline 0 C--N 1.331 -0.231 0 CA-C-N 115.805 -0.634 . . . . 2.6600000000000001 110.336 179.688 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.539 ' HG3' ' HG3' ' A' ' 36' ' ' MET . 47.0 Cg_endo -67.87 148.09 75.97 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.595 2.197 . . . . 0.51000000000000001 112.332 -179.8 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 12.4 m -64.68 154.26 37.13 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.09 -0.505 . . . . 0.72999999999999998 110.543 179.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.401 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 7.1 tp10 -49.62 -55.07 14.96 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.681 0.276 . . . . 2.7000000000000002 111.22 -179.404 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.63 -46.03 70.34 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.227 -0.442 . . . . 0.46000000000000002 111.507 -179.726 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -51.38 -54.52 25.71 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.335 -0.393 . . . . 2.23 111.146 -179.8 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 47.3 mt -56.9 -40.91 77.17 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.731 0.3 . . . . 1.3600000000000001 111.019 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.401 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 79.5 mm-40 -66.16 -27.56 68.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.885 0.374 . . . . 1.22 111.0 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 30.2 m-20 -76.73 -52.8 8.93 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.106 -0.497 . . . . 0.62 111.85 -179.397 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.4 pp -69.37 -35.45 75.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.481 -0.327 . . . . 0.39000000000000001 111.879 -179.033 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 72.8 mt -69.36 -48.59 66.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.64 0.257 . . . . 0.5 111.138 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.99 -37.37 82.25 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.882 0.372 . . . . 0.58999999999999997 110.757 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -66.58 -51.65 54.09 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.081 -0.509 . . . . 2.54 110.52 179.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -67.25 -14.9 63.34 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.01 -0.541 . . . . 0.53000000000000003 111.055 179.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -74.34 -27.29 60.62 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.283 -0.417 . . . . 1.95 110.932 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -118.28 7.83 12.13 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.173 -0.467 . . . . 2.48 110.813 179.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -122.97 -12.68 7.95 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.196 -0.456 . . . . 2.48 110.977 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -140.46 27.18 2.1 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.218 -0.446 . . . . 2.0499999999999998 110.886 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . 0.552 ' N ' HD22 ' A' ' 60' ' ' ASN . 0.8 OUTLIER 62.01 -85.18 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.917 -0.583 . . . . 1.47 111.118 179.984 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -151.85 -3.05 0.19 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.755 -0.736 . . . . 0.42999999999999999 112.409 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.427 HE22 ' N ' ' A' ' 27' ' ' ILE . 0.0 OUTLIER -115.05 154.9 28.01 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.07 0.462 . . . . 0.38 111.071 179.966 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.587 ' HG ' ' HB2' ' A' ' 67' ' ' GLU . 0.8 OUTLIER -119.6 156.17 30.89 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.691 -0.686 . . . . 1.4299999999999999 109.96 -179.795 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . 0.588 ' HB2' ' HG2' ' A' ' 67' ' ' GLU . 52.7 m-80 -111.26 156.4 21.55 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 121.098 0.475 . . . . 1.1899999999999999 111.719 -178.674 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 84.0 t80 -48.11 -41.64 26.98 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.348 -0.842 . . . . 0.40000000000000002 109.96 178.757 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.68 -36.22 82.01 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.483 -0.781 . . . . 0.81000000000000005 111.337 179.421 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.588 ' HG2' ' HB2' ' A' ' 64' ' ' ASN . 8.8 mm-40 -64.69 -55.04 22.51 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.192 -0.458 . . . . 1.3600000000000001 110.004 179.524 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.436 ' HD1' HD21 ' A' ' 32' ' ' LEU . 43.4 t80 -59.2 -54.18 49.89 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.829 -0.623 . . . . 0.51000000000000001 110.541 179.378 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 35.2 t -52.77 -49.31 65.81 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 116.119 -0.491 . . . . 0.75 110.276 179.526 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -43.84 -50.72 7.23 Favored Glycine 0 N--CA 1.451 -0.342 0 CA-C-N 115.613 -0.721 . . . . 0.40999999999999998 112.23 179.225 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.87 HG23 ' HE2' ' A' ' 74' ' ' LYS . 13.5 mt -66.81 -51.4 55.98 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.261 0 CA-C-O 120.912 0.386 . . . . 0.51000000000000001 110.78 179.41 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . 0.454 ' O ' ' HG3' ' A' ' 76' ' ' MET . 83.8 mmm -45.91 -36.47 5.45 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.932 -0.576 . . . . 1.01 109.766 179.192 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -63.21 -55.03 28.4 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.253 -0.885 . . . . 0.69999999999999996 110.622 179.312 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.87 ' HE2' HG23 ' A' ' 71' ' ' ILE . 58.6 pttt -61.0 -28.62 69.17 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.296 -0.411 . . . . 1.3799999999999999 110.84 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -77.68 -42.17 35.49 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.233 -0.439 . . . . 1.98 111.266 179.438 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . 0.502 ' SD ' HD12 ' A' ' 4' ' ' LEU . 2.8 mtt . . . . . 0 N--CA 1.446 -0.628 0 CA-C-N 116.258 -0.428 . . . . 1.2 110.919 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.575 ' O ' ' HG2' ' A' ' 85' ' ' MET . 9.7 t . . . . . 0 C--O 1.226 -0.144 0 N-CA-C 110.503 -0.184 . . . . 7.29 110.503 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -66.55 -23.43 66.22 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 112.558 0.577 . . . . 9.7400000000000002 112.558 -178.741 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -64.45 -56.05 16.79 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-O 121.102 0.477 . . . . 12.109999999999999 111.809 -179.137 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -59.21 -19.31 44.42 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.865 -0.607 . . . . 10.869999999999999 111.118 -179.458 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' MET . . . . . 0.616 ' CB ' HG22 ' A' ' 142' ' ' VAL . 2.0 mmt -74.71 -49.85 19.66 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.137 -0.483 . . . . 11.09 110.609 -179.574 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 46.5 ttt180 -54.85 -43.17 72.81 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.036 -0.529 . . . . 15.52 110.075 179.775 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 25.3 mm-40 -60.37 -42.42 95.79 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.139 0.495 . . . . 14.85 109.973 178.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -69.85 -23.08 63.23 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.749 -0.66 . . . . 14.109999999999999 111.075 179.586 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 88.5 t80 -68.98 -41.56 77.75 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.389 -0.369 . . . . 15.73 110.419 179.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 50.0 mtmt -68.7 -39.13 80.64 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.92 -0.582 . . . . 17.66 110.646 179.552 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 81.7 mt -68.23 -44.48 84.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.038 -0.528 . . . . 18.149999999999999 111.441 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -67.69 -55.66 12.33 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.526 -0.306 . . . . 18.34 111.366 -179.646 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 41.8 t0 -55.32 99.08 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.823 0.344 . . . . 19.289999999999999 110.409 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.535 ' HG2' ' HB3' ' A' ' 104' ' ' GLU . 21.9 mmm180 -55.86 -33.08 64.21 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.125 -0.488 . . . . 22.25 110.955 -179.399 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.439 ' HB2' ' OD1' ' A' ' 97' ' ' ASP . 6.2 m-20 -101.71 170.13 8.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.189 -0.46 . . . . 23.34 110.929 -179.793 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.45 5.38 57.15 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.794 -0.717 . . . . 22.0 112.384 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.439 ' OD1' ' HB2' ' A' ' 95' ' ' ASP . 5.0 p-10 -58.7 -39.06 79.66 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.706 0.289 . . . . 22.280000000000001 111.307 -179.755 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 114.06 17.12 7.45 Favored Glycine 0 C--N 1.331 0.279 0 C-N-CA 120.698 -0.763 . . . . 19.93 112.91 179.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 99.2 m-85 -145.12 152.56 40.26 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 120.74 0.305 . . . . 20.300000000000001 110.829 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 61.2 mt -114.33 138.22 45.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 116.299 -0.41 . . . . 19.370000000000001 111.069 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 41.7 m -114.61 156.13 45.15 Favored Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 115.988 -0.551 . . . . 22.489999999999998 110.939 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_exo -41.76 -39.56 5.13 Favored 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 122.49 2.127 . . . . 23.0 112.281 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.71 -50.2 73.38 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.971 -0.559 . . . . 24.559999999999999 110.613 179.465 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . 0.535 ' HB3' ' HG2' ' A' ' 94' ' ' ARG . 44.3 mt-10 -64.53 -28.37 69.6 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.442 -0.799 . . . . 22.23 111.188 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.536 HD23 ' HB ' ' A' ' 121' ' ' ILE . 38.0 tp -64.97 -55.5 18.7 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.285 -0.416 . . . . 20.359999999999999 111.429 -179.076 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.615 ' HB3' HD13 ' A' ' 121' ' ' ILE . 14.6 ptt180 -64.32 -38.76 92.2 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.852 0.358 . . . . 27.190000000000001 110.531 179.893 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . 0.452 ' N ' ' HG3' ' A' ' 106' ' ' ARG . 1.7 t80 -54.55 -39.37 67.64 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.957 -0.565 . . . . 25.359999999999999 111.022 -179.544 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.474 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 76.8 t -80.15 -49.65 18.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.521 -0.308 . . . . 21.059999999999999 111.37 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -50.03 -35.54 25.29 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.389 -0.369 . . . . 20.93 111.08 -179.835 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 78.1 mt -75.92 -31.22 21.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.333 -0.394 . . . . 25.129999999999999 110.565 179.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 95.2 m-20 -67.8 -43.34 79.9 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.07 -0.514 . . . . 23.32 110.812 179.507 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.474 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 6.2 mt -66.25 -45.33 80.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.069 -0.514 . . . . 21.07 110.826 -179.841 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 137.95 -0.15 2.61 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.922 -0.656 . . . . 23.050000000000001 112.278 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -88.61 104.63 17.02 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.734 0.302 . . . . 22.59 111.201 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -74.04 113.71 11.54 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.298 -0.41 . . . . 27.960000000000001 110.506 179.526 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . 0.413 HG12 ' OE1' ' A' ' 120' ' ' GLU . 5.3 m -138.35 155.2 28.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 121.004 0.431 . . . . 24.75 111.789 -179.574 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . 0.417 ' O ' HG12 ' A' ' 121' ' ' ILE . 64.0 p -99.18 156.76 16.8 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.702 -0.681 . . . . 27.239999999999998 110.448 179.24 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -58.68 -21.4 54.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.41 -0.359 . . . . 26.629999999999999 111.507 -179.658 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -76.31 -55.38 5.61 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 111.874 0.324 . . . . 29.140000000000001 111.874 -179.269 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . 0.413 ' OE1' HG12 ' A' ' 116' ' ' VAL . 15.2 pt-20 -61.71 -39.44 91.5 Favored 'General case' 0 C--O 1.234 0.237 0 N-CA-C 111.679 0.251 . . . . 24.190000000000001 111.679 -179.33 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.615 HD13 ' HB3' ' A' ' 106' ' ' ARG . 18.7 pt -71.19 -34.88 56.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 C-N-CA 120.959 -0.297 . . . . 22.329999999999998 111.251 -179.709 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . 0.498 ' N ' HG13 ' A' ' 121' ' ' ILE . 15.0 t70 -59.01 -43.84 91.61 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.953 0.406 . . . . 24.289999999999999 110.292 179.583 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -63.85 -42.24 97.61 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.89 -0.596 . . . . 24.739999999999998 110.413 179.44 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.436 ' CE ' HD21 ' A' ' 105' ' ' LEU . 65.1 ttp -56.59 -34.04 66.79 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.15 -0.477 . . . . 19.710000000000001 110.825 179.663 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.574 HG23 HD11 ' A' ' 136' ' ' ILE . 87.0 mt -68.92 -46.09 79.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.237 -0.438 . . . . 19.949999999999999 110.371 179.592 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 27.9 tpt180 -59.57 -31.46 69.46 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.99 -0.55 . . . . 24.949999999999999 111.04 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -66.96 -40.58 87.52 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.17 -0.468 . . . . 18.690000000000001 111.302 -179.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.522 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -91.19 -13.59 32.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.376 -0.374 . . . . 16.469999999999999 111.094 -179.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . 0.447 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 8.7 t70 -95.99 106.72 18.92 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.151 -0.477 . . . . 20.399999999999999 111.054 -179.697 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 87.3 m-85 -98.93 -32.91 11.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.033 -0.53 . . . . 21.43 111.533 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -69.3 -15.5 63.36 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.719 0.295 . . . . 23.370000000000001 110.981 -179.734 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . 0.419 ' HA2' ' OD2' ' A' ' 129' ' ' ASP . . . 58.45 84.95 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.835 -0.697 . . . . 24.32 112.874 179.615 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 12.3 p-10 -147.66 -9.64 0.41 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.768 0.318 . . . . 23.879999999999999 111.004 179.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 80.14 18.2 72.51 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.835 -0.698 . . . . 22.670000000000002 112.43 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 40.4 mtp -137.52 155.3 49.42 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.576 0.227 . . . . 22.91 110.454 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.72 HG23 ' HB2' ' A' ' 140' ' ' GLU . 48.8 mm -114.79 142.8 26.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 121.404 0.621 . . . . 18.41 112.233 -179.242 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . 0.423 ' OD1' ' HB2' ' A' ' 139' ' ' GLU . 1.6 p30 -115.45 157.76 23.51 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.006 -0.997 . . . . 16.82 109.108 178.129 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.624 ' O ' HG23 ' A' ' 142' ' ' VAL . 29.0 t80 -39.12 -25.45 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 112.432 0.53 . . . . 14.65 112.432 -179.239 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . 0.423 ' HB2' ' OD1' ' A' ' 137' ' ' ASN . 43.5 mt-10 -80.18 -55.75 4.7 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.692 0.282 . . . . 14.82 111.529 -179.149 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.72 ' HB2' HG23 ' A' ' 136' ' ' ILE . 53.3 mt-10 -61.12 -31.33 71.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.941 0.401 . . . . 17.460000000000001 110.519 -179.825 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.604 ' CE2' HD13 ' A' ' 145' ' ' ILE . 88.9 t80 -67.67 -55.7 12.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.839 -0.619 . . . . 12.93 110.606 179.726 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.624 HG23 ' O ' ' A' ' 138' ' ' TYR . 34.4 t -47.23 -43.39 7.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 115.833 -0.622 . . . . 10.699999999999999 111.964 179.523 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 82.8 t90 -65.29 -55.21 19.61 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.697 0.629 . . . . 13.66 112.697 -178.448 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . 0.522 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 11.1 ptt? -61.78 -32.39 72.66 Favored 'General case' 0 N--CA 1.464 0.237 0 N-CA-C 112.55 0.574 . . . . 14.5 112.55 -177.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 145' ' ' ILE . . . . . 0.604 HD13 ' CE2' ' A' ' 141' ' ' PHE . 25.3 pt -80.71 -20.87 11.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 C-N-CA 120.779 -0.368 . . . . 11.25 111.423 179.835 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 33.2 t -67.66 -32.8 73.73 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.104 0.478 . . . . 8.5399999999999991 110.175 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 7.3 mm-40 -84.6 -23.65 29.49 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.595 -0.729 . . . . 11.869999999999999 111.1 180.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 63.9 mttm . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.289 -0.863 . . . . 13.68 110.989 179.503 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 21.4 mt . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.78 0.324 . . . . 1.27 110.919 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.554 HG22 ' H ' ' A' ' 6' ' ' GLU . 0.2 OUTLIER -73.44 -171.23 0.94 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.178 -0.465 . . . . 1.1200000000000001 110.869 179.969 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.554 ' H ' HG22 ' A' ' 5' ' ' THR . 9.9 tp10 -69.94 -46.25 65.72 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.134 0.492 . . . . 2.2000000000000002 110.442 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -72.03 -41.9 66.96 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.578 -0.737 . . . . 1.3500000000000001 110.664 179.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -60.55 -45.84 92.41 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.1 -0.5 . . . . 2.2200000000000002 110.603 179.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.532 ' HA ' ' CZ ' ' A' ' 12' ' ' PHE . 40.7 mt -57.92 -52.27 60.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.16 -0.473 . . . . 0.54000000000000004 110.879 179.733 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.2 -21.4 65.09 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.068 -0.515 . . . . 0.5 111.716 -179.607 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -72.72 -56.78 4.76 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 111.991 0.367 . . . . 2.27 111.991 -178.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.532 ' CZ ' ' HA ' ' A' ' 9' ' ' ILE . 7.5 p90 -77.92 -26.18 48.83 Favored 'General case' 0 C--N 1.332 -0.178 0 C-N-CA 120.674 -0.41 . . . . 0.37 110.789 -179.764 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.436 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 26.7 tptp -65.01 -38.47 91.04 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 109.383 -0.599 . . . . 1.23 109.383 178.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.485 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 20.1 t70 -66.65 -48.62 68.83 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 108.945 -0.761 . . . . 0.44 108.945 178.186 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.78 -14.59 59.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.411 -0.813 . . . . 0.28999999999999998 110.723 179.184 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.436 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 88.3 t80 -77.14 -49.89 14.21 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.029 -0.532 . . . . 0.47999999999999998 110.436 -179.579 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 16.5 m -67.32 -22.6 29.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.215 -0.448 . . . . 1.1100000000000001 110.26 179.67 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.485 ' HG2' ' O ' ' A' ' 14' ' ' ASP . 26.1 mm-40 -63.85 -20.82 66.1 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.829 -0.623 . . . . 1.6000000000000001 111.379 179.444 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 45.2 m-85 -114.83 24.21 11.96 Favored 'General case' 0 C--N 1.332 -0.156 0 N-CA-C 111.903 0.335 . . . . 0.64000000000000001 111.903 -179.36 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -112.26 81.45 1.47 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.965 0.412 . . . . 0.44 110.504 179.335 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -92.44 -25.52 18.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.832 -0.622 . . . . 2.1000000000000001 111.286 -179.63 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -70.49 -15.33 62.79 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.102 -0.499 . . . . 1.8 111.355 -179.497 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.16 -0.08 68.84 Favored Glycine 0 CA--C 1.518 0.24 0 C-N-CA 120.749 -0.739 . . . . 0.46000000000000002 112.708 179.718 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 40.4 p -82.48 11.9 5.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.632 0.253 . . . . 0.40000000000000002 111.222 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 57.86 24.47 53.92 Favored Glycine 0 C--N 1.33 0.245 0 C-N-CA 120.676 -0.773 . . . . 0.33000000000000002 111.724 -179.489 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.653 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 47.7 mtpt -129.61 155.49 45.75 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.725 0.298 . . . . 1.1000000000000001 110.678 -179.516 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.431 ' N ' HE22 ' A' ' 62' ' ' GLN . 36.3 pt -118.47 130.85 72.73 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.411 -0.359 . . . . 0.5 111.29 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -50.07 129.38 20.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.372 -0.376 . . . . 0.29999999999999999 111.274 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.418 HG22 HD13 ' A' ' 63' ' ' LEU . 79.7 p -61.55 -21.37 64.22 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.118 -0.492 . . . . 1.03 110.722 179.819 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 51.8 mtp180 -80.91 4.08 20.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.742 -0.663 . . . . 3.0800000000000001 110.201 179.492 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -119.05 -6.63 10.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.547 -0.751 . . . . 2.2599999999999998 110.55 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.49 HD22 HD11 ' A' ' 51' ' ' LEU . 10.2 tt -55.2 -51.18 67.37 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.242 -0.436 . . . . 1.3700000000000001 110.18 179.534 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -52.27 -48.88 52.77 Favored Glycine 0 C--N 1.331 0.288 0 C-N-CA 120.531 -0.842 . . . . 0.32000000000000001 111.496 179.209 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 90.7 m -59.36 -34.44 72.39 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 121.319 0.58 . . . . 0.31 109.848 178.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 47.2 tp -70.36 -28.66 65.3 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.296 -0.865 . . . . 1.24 110.26 179.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.481 ' HG2' ' O ' ' A' ' 32' ' ' LEU . 23.9 mmm -76.12 -21.42 56.66 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.06 -0.518 . . . . 1.1000000000000001 109.768 179.057 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -75.41 -44.74 42.98 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.651 -0.704 . . . . 2.6899999999999999 110.326 179.071 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.442 HG23 ' HG ' ' A' ' 39' ' ' LEU . 7.9 t -71.51 -13.28 61.76 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.031 -0.531 . . . . 1.0600000000000001 110.416 179.13 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.442 ' HG ' HG23 ' A' ' 38' ' ' THR . 76.7 mt -112.83 157.4 21.43 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.727 -0.67 . . . . 1.26 110.187 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -71.84 34.85 0.61 Allowed Glycine 0 CA--C 1.521 0.449 0 C-N-CA 120.762 -0.733 . . . . 0.68999999999999995 113.34 -179.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.411 ' H ' ' C ' ' A' ' 39' ' ' LEU . 12.8 mm-40 -93.58 -80.68 0.38 Allowed 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.791 0.329 . . . . 1.97 111.087 179.569 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 32.5 m-80 56.81 74.89 0.62 Allowed Pre-proline 0 C--N 1.332 -0.184 0 CA-C-N 115.943 -0.571 . . . . 2.6600000000000001 111.05 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.402 ' HD3' ' HB3' ' A' ' 36' ' ' MET . 92.1 Cg_endo -79.18 173.88 12.78 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.654 2.236 . . . . 0.51000000000000001 112.446 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 19.9 m -69.07 152.71 44.86 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.172 -0.467 . . . . 0.72999999999999998 110.778 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -55.09 -55.21 33.65 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.733 0.302 . . . . 2.7000000000000002 111.128 -179.648 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -54.43 -47.92 72.26 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.092 -0.504 . . . . 0.46000000000000002 111.804 -179.565 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.433 ' HG2' HD23 ' A' ' 51' ' ' LEU . 39.5 tt0 -57.99 -48.24 80.61 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.87 0.367 . . . . 2.23 110.456 -179.629 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.43 ' HA ' HD21 ' A' ' 51' ' ' LEU . 31.8 tp -57.07 -38.61 73.54 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.78 -0.645 . . . . 1.3600000000000001 110.977 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 83.3 mm-40 -72.82 -31.04 64.52 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.303 -0.408 . . . . 1.22 111.551 -179.682 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 28.1 m-20 -73.78 -54.99 6.79 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.547 -0.297 . . . . 0.62 111.8 -179.44 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.49 HD11 HD22 ' A' ' 32' ' ' LEU . 2.2 pp -60.75 -38.57 85.64 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.611 -0.268 . . . . 0.39000000000000001 111.516 -179.226 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 82.4 mt -68.81 -36.75 75.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.934 0.397 . . . . 0.5 110.744 179.595 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.96 -50.76 61.29 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.096 -0.502 . . . . 0.58999999999999997 111.073 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -62.08 -38.53 89.17 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.283 -0.417 . . . . 2.54 110.603 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -73.58 -18.21 61.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.285 -0.416 . . . . 0.53000000000000003 111.04 179.747 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -70.8 -55.02 9.48 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.272 -0.422 . . . . 1.95 110.612 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 7.9 p30 -89.65 43.68 1.16 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.183 -0.462 . . . . 2.48 110.988 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -155.16 -15.66 0.11 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.705 -0.68 . . . . 2.48 110.61 179.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -144.21 21.39 1.73 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.911 -0.586 . . . . 2.0499999999999998 110.613 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 9.8 m120 64.49 -83.24 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.126 0 CA-C-N 115.861 -0.609 . . . . 1.47 111.314 179.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -154.69 19.54 0.59 Allowed Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.793 -0.718 . . . . 0.42999999999999999 112.336 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.653 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -128.49 155.31 45.03 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.981 0.419 . . . . 0.38 111.156 -179.847 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.552 ' HG ' ' HB2' ' A' ' 67' ' ' GLU . 9.5 tp -124.45 154.09 41.0 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.901 -0.59 . . . . 1.4299999999999999 110.482 -179.604 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . 0.419 ' CG ' ' HE3' ' A' ' 26' ' ' LYS . 7.6 m-80 -113.41 157.63 21.67 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-O 121.111 0.481 . . . . 1.1899999999999999 111.548 -179.708 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 88.1 t80 -46.88 -43.52 18.85 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.281 -0.872 . . . . 0.40000000000000002 111.02 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -67.62 -34.43 76.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 0.81000000000000005 111.877 -179.82 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.552 ' HB2' ' HG ' ' A' ' 63' ' ' LEU . 22.4 mm-40 -64.39 -53.41 48.95 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.958 0.409 . . . . 1.3600000000000001 110.245 179.682 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.461 ' O ' ' HG3' ' A' ' 72' ' ' MET . 28.0 t80 -59.91 -51.11 71.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.825 -0.625 . . . . 0.51000000000000001 110.336 179.261 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 1.5 m -55.25 -49.67 71.45 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.821 -0.627 . . . . 0.75 111.085 179.727 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -47.51 -49.73 20.14 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.982 -0.627 . . . . 0.40999999999999998 112.212 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.634 HG23 ' HE3' ' A' ' 74' ' ' LYS . 12.7 mt -64.19 -45.56 95.98 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.308 0 CA-C-O 121.015 0.436 . . . . 0.51000000000000001 110.743 179.541 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . 0.461 ' HG3' ' O ' ' A' ' 68' ' ' PHE . 38.0 mtp -54.84 -25.01 25.68 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.9 -0.591 . . . . 1.01 110.135 179.556 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -76.04 -49.27 18.01 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.36 -0.382 . . . . 0.69999999999999996 110.748 179.69 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.634 ' HE3' HG23 ' A' ' 71' ' ' ILE . 19.2 pttp -65.35 -35.4 80.86 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.516 -0.311 . . . . 1.3799999999999999 111.081 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -81.41 -55.67 4.55 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.728 0.64 . . . . 1.98 112.728 -179.033 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 24.7 mtm . . . . . 0 N--CA 1.453 -0.285 0 N-CA-C 113.066 0.765 . . . . 1.2 113.066 -178.321 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.431 HG23 ' O ' ' A' ' 81' ' ' THR . 3.9 t . . . . . 0 CA--C 1.529 0.138 0 CA-C-O 121.252 0.548 . . . . 7.29 111.605 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.429 ' HB2' ' OH ' ' A' ' 138' ' ' TYR . 11.2 pt-20 -50.25 -20.77 1.13 Allowed 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 112.793 0.664 . . . . 9.7400000000000002 112.793 -178.876 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 25.9 mm-40 -68.78 -57.01 6.21 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.758 0.313 . . . . 12.109999999999999 111.644 -179.312 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -71.86 -27.34 62.81 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.106 0.479 . . . . 10.869999999999999 110.513 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' MET . . . . . 0.563 ' HB3' HD11 ' A' ' 145' ' ' ILE . 27.7 mtp -70.88 -36.09 72.63 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.629 -0.714 . . . . 11.09 110.47 -179.73 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 70.0 ttt180 -68.22 -43.56 77.72 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.973 -0.558 . . . . 15.52 110.2 179.575 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -55.21 -42.91 73.94 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.74 -0.467 . . . . 14.85 109.74 178.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . 0.428 ' HA ' HD12 ' A' ' 91' ' ' ILE . . . -61.1 -38.44 86.29 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.776 -0.647 . . . . 14.109999999999999 110.688 179.509 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -58.17 -40.89 82.63 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.237 -0.438 . . . . 15.73 110.554 179.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 26.3 mtpp -63.96 -37.9 89.11 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.829 -0.623 . . . . 17.66 110.584 179.611 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.428 HD12 ' HA ' ' A' ' 88' ' ' ALA . 66.0 mt -62.32 -44.03 98.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.875 -0.602 . . . . 18.149999999999999 111.598 -179.917 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.507 ' HA ' HG21 ' A' ' 108' ' ' VAL . 18.5 m-85 -80.31 -20.52 44.14 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 111.791 0.293 . . . . 18.34 111.791 -179.614 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -96.88 108.65 21.39 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.892 0.377 . . . . 19.289999999999999 111.047 -179.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.82 -58.9 3.33 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.941 -0.572 . . . . 22.25 111.295 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -74.82 158.86 32.72 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.151 -0.477 . . . . 23.34 111.347 -179.466 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -80.88 5.19 66.52 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.796 -0.716 . . . . 22.0 111.429 178.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 27.8 p-10 -55.52 -35.06 65.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.904 0.383 . . . . 22.280000000000001 111.384 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 89.86 30.95 11.78 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.867 -0.682 . . . . 19.93 112.167 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -146.78 146.79 30.39 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.639 0.257 . . . . 20.300000000000001 110.902 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.43 HD13 ' HB3' ' A' ' 92' ' ' PHE . 40.4 mt -114.17 125.3 71.44 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-O 120.846 0.355 . . . . 19.370000000000001 111.097 179.773 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . 0.489 ' OG ' ' HD2' ' A' ' 102' ' ' PRO . 47.3 t -114.61 152.67 46.46 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.055 -0.52 . . . . 22.489999999999998 110.421 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . 0.489 ' HD2' ' OG ' ' A' ' 101' ' ' SER . 55.6 Cg_exo -40.05 -34.71 1.01 Allowed 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.564 2.176 . . . . 23.0 112.848 179.669 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.86 -46.57 81.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.292 -0.413 . . . . 24.559999999999999 111.132 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . 0.44 ' O ' HG23 ' A' ' 108' ' ' VAL . 43.5 mt-10 -74.37 -39.2 62.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.936 -0.574 . . . . 22.23 110.75 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.875 HD23 ' HB ' ' A' ' 121' ' ' ILE . 8.7 tp -54.86 -49.68 70.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.93 -0.577 . . . . 20.359999999999999 110.407 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 10.4 ttt180 -63.89 -47.85 78.96 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.899 -0.591 . . . . 27.190000000000001 110.582 179.424 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 68.4 t80 -49.91 -43.43 49.63 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.881 -0.6 . . . . 25.359999999999999 111.492 -179.387 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.508 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 53.9 t -72.16 -49.94 40.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.585 -0.28 . . . . 21.059999999999999 111.268 -179.785 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 18.6 mmt -49.13 -49.54 41.69 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.302 -0.408 . . . . 20.93 111.352 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 63.4 mt -59.84 -28.13 40.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.232 -0.44 . . . . 25.129999999999999 110.937 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -77.9 -29.49 50.18 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.122 -0.49 . . . . 23.32 110.937 179.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.508 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 14.8 mt -74.47 -41.35 60.92 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.387 -0.37 . . . . 21.07 110.836 -179.892 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 131.28 -0.04 5.12 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.879 -0.677 . . . . 23.050000000000001 112.422 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -101.55 109.27 21.05 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.882 0.372 . . . . 22.59 111.021 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -74.77 113.68 12.33 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.128 -0.487 . . . . 27.960000000000001 111.013 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . 0.481 HG12 ' OE1' ' A' ' 120' ' ' GLU . 4.9 m -131.21 146.39 33.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 121.006 0.432 . . . . 24.75 111.437 179.634 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 55.3 p -92.88 152.39 19.43 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.883 -0.599 . . . . 27.239999999999998 110.128 179.306 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -55.79 -19.05 9.97 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.328 -0.396 . . . . 26.629999999999999 111.118 -179.69 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -76.11 -55.48 5.55 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.356 -0.384 . . . . 29.140000000000001 111.709 -179.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . 0.481 ' OE1' HG12 ' A' ' 116' ' ' VAL . 14.5 pt-20 -62.59 -40.82 98.13 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 111.873 0.323 . . . . 24.190000000000001 111.873 -179.152 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.875 ' HB ' HD23 ' A' ' 105' ' ' LEU . 43.9 pt -70.09 -35.14 62.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 C-N-CA 120.853 -0.339 . . . . 22.329999999999998 111.242 -179.671 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . 0.401 ' N ' HG13 ' A' ' 121' ' ' ILE . 13.3 t70 -61.14 -38.83 87.8 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.833 0.349 . . . . 24.289999999999999 110.305 179.437 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -64.52 -46.35 83.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.055 -0.521 . . . . 24.739999999999998 110.446 179.461 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.419 ' CE ' HD21 ' A' ' 105' ' ' LEU . 53.0 ttp -56.58 -39.04 72.82 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 116.09 -0.505 . . . . 19.710000000000001 110.537 179.457 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.607 HD11 HD22 ' A' ' 105' ' ' LEU . 82.1 mt -65.36 -41.3 90.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.914 -0.585 . . . . 19.949999999999999 110.513 179.488 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 69.1 ttt180 -60.52 -32.17 71.2 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.664 -0.698 . . . . 24.949999999999999 110.821 179.666 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -67.79 -36.19 79.99 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.125 -0.489 . . . . 18.690000000000001 111.062 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.75 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -90.93 -15.48 29.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.262 -0.426 . . . . 16.469999999999999 110.964 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . 0.44 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 19.1 t70 -98.39 106.67 18.98 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.978 -0.556 . . . . 20.399999999999999 110.902 -179.662 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -94.19 -33.34 13.33 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.805 -0.634 . . . . 21.43 111.448 -179.644 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -67.81 -15.97 63.88 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.87 0.367 . . . . 23.370000000000001 110.649 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 60.41 85.63 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.962 -0.637 . . . . 24.32 112.85 179.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -143.05 -35.4 0.4 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.753 0.311 . . . . 23.879999999999999 110.851 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 110.91 6.06 26.66 Favored Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.832 -0.699 . . . . 22.670000000000002 112.729 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 78.3 mtp -131.43 155.26 47.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.631 0.253 . . . . 22.91 110.627 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.662 HG23 ' HB2' ' A' ' 140' ' ' GLU . 48.1 mm -117.33 144.79 24.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 121.203 0.525 . . . . 18.41 111.851 -179.477 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . 0.451 ' O ' ' N ' ' A' ' 139' ' ' GLU . 29.8 p-10 -116.92 158.13 24.56 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.354 -0.839 . . . . 16.82 109.194 178.44 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.429 ' OH ' ' HB2' ' A' ' 82' ' ' GLU . 26.8 t80 -39.21 -23.72 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.368 0.507 . . . . 14.65 112.368 -179.534 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . 0.451 ' N ' ' O ' ' A' ' 137' ' ' ASN . 45.4 mt-10 -80.45 -56.01 4.48 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 120.744 0.307 . . . . 14.82 111.401 -179.486 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.662 ' HB2' HG23 ' A' ' 136' ' ' ILE . 34.7 mt-10 -62.82 -31.02 71.93 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.908 0.385 . . . . 17.460000000000001 110.38 -179.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.56 ' HA ' ' HE2' ' A' ' 144' ' ' MET . 78.0 t80 -66.89 -54.51 21.44 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.976 -0.556 . . . . 12.93 109.689 178.892 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.449 ' HA ' HD11 ' A' ' 145' ' ' ILE . 1.7 t -47.84 -35.44 4.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.306 -0.861 . . . . 10.699999999999999 111.286 179.101 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 143' ' ' TRP . . . . . 0.404 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 79.8 t90 -69.71 -55.32 10.26 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.278 0.473 . . . . 13.66 112.278 -179.42 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . 0.75 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 21.4 ptt? -65.32 -21.71 66.74 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 113.323 0.861 . . . . 14.5 113.323 -177.627 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 145' ' ' ILE . . . . . 0.635 ' HA ' ' HB2' ' A' ' 148' ' ' LYS . 44.0 pt -80.61 -43.77 21.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 C-N-CA 120.806 -0.357 . . . . 11.25 111.861 -179.821 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 146' ' ' SER . . . . . 0.535 ' N ' HG13 ' A' ' 145' ' ' ILE . 46.9 t -63.67 -13.89 46.98 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 121.472 0.653 . . . . 8.5399999999999991 109.473 179.574 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 147' ' ' GLN . . . . . 0.404 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 6.2 mm-40 -126.19 21.73 7.32 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 114.781 -1.099 . . . . 11.869999999999999 110.025 -179.272 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . 0.635 ' HB2' ' HA ' ' A' ' 145' ' ' ILE . 27.2 ttpp . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.203 -0.904 . . . . 13.68 110.931 -179.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 11.0 mp . . . . . 0 C--O 1.231 0.092 0 CA-C-O 120.932 0.396 . . . . 1.27 111.014 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.523 HG22 ' H ' ' A' ' 6' ' ' GLU . 0.2 OUTLIER -59.1 177.32 0.17 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.917 -0.583 . . . . 1.1200000000000001 111.181 -179.857 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.523 ' H ' HG22 ' A' ' 5' ' ' THR . 37.7 tt0 -62.88 -42.87 99.93 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.294 0.568 . . . . 2.2000000000000002 109.909 179.691 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -71.27 -39.0 71.83 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.309 -0.859 . . . . 1.3500000000000001 110.521 179.488 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 18.3 mm-40 -62.9 -43.12 99.67 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.894 -0.593 . . . . 2.2200000000000002 110.47 179.623 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.553 ' HA ' ' CZ ' ' A' ' 12' ' ' PHE . 83.6 mt -58.66 -54.35 34.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.139 -0.482 . . . . 0.54000000000000004 110.362 179.572 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.26 -22.38 65.94 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.042 -0.527 . . . . 0.5 111.074 179.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -73.38 -56.31 5.22 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.228 -0.442 . . . . 2.27 112.186 -178.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.553 ' CZ ' ' HA ' ' A' ' 9' ' ' ILE . 4.7 p90 -78.69 -26.51 44.92 Favored 'General case' 0 C--N 1.332 -0.157 0 C-N-CA 120.542 -0.463 . . . . 0.37 111.255 -179.374 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.431 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 27.8 tptp -67.03 -38.38 85.79 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.649 -0.5 . . . . 1.23 109.649 179.116 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.44 ' O ' HG22 ' A' ' 17' ' ' VAL . 16.8 t70 -66.62 -52.42 45.35 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 109.246 -0.65 . . . . 0.44 109.246 178.34 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.44 -13.66 52.71 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.603 -0.726 . . . . 0.28999999999999998 110.726 179.198 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.431 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 83.0 t80 -76.96 -48.51 17.89 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.083 -0.508 . . . . 0.47999999999999998 110.443 -179.741 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.44 HG22 ' O ' ' A' ' 14' ' ' ASP . 30.8 m -68.73 -22.7 26.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.205 -0.452 . . . . 1.1100000000000001 110.353 179.54 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.435 ' HG2' ' O ' ' A' ' 14' ' ' ASP . 26.3 mm-40 -59.48 -48.28 82.26 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.844 -0.616 . . . . 1.6000000000000001 111.461 179.444 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -88.14 37.34 0.81 Allowed 'General case' 0 N--CA 1.462 0.14 0 CA-C-O 120.771 0.32 . . . . 0.64000000000000001 111.622 -179.541 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -125.11 74.66 1.39 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.065 0.459 . . . . 0.44 110.397 179.328 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -84.72 -21.91 29.92 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.727 -0.67 . . . . 2.1000000000000001 111.309 -179.653 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -75.97 -22.25 56.09 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.978 -0.555 . . . . 1.8 111.398 -179.404 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 82.12 4.53 90.21 Favored Glycine 0 C--N 1.33 0.229 0 C-N-CA 120.678 -0.773 . . . . 0.46000000000000002 112.418 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 60.6 p -82.12 14.74 2.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.652 0.263 . . . . 0.40000000000000002 111.177 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 53.92 22.86 20.91 Favored Glycine 0 C--N 1.332 0.339 0 C-N-CA 120.714 -0.755 . . . . 0.33000000000000002 111.895 -179.498 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.639 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 46.2 mtpt -129.98 155.11 46.63 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.681 -0.259 . . . . 1.1000000000000001 110.692 -179.374 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.682 HG13 ' HB2' ' A' ' 63' ' ' LEU . 15.4 pt -114.89 122.12 68.36 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.203 0 CA-C-O 120.915 0.388 . . . . 0.5 112.021 -179.43 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -52.81 134.71 36.71 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.087 -0.506 . . . . 0.29999999999999999 111.114 179.693 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.0 t -65.53 -13.19 58.38 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.016 -0.538 . . . . 1.03 111.152 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 32.1 mtt180 -80.94 -10.09 59.76 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.012 -0.54 . . . . 3.0800000000000001 110.632 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -116.61 1.12 12.82 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.819 -0.628 . . . . 2.2599999999999998 110.619 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.713 HD11 ' CD1' ' A' ' 68' ' ' PHE . 16.0 tp -64.13 -47.75 78.75 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.382 -0.372 . . . . 1.3700000000000001 110.685 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.421 ' O ' ' HG3' ' A' ' 37' ' ' ARG . . . -51.86 -41.41 51.46 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.246 -0.978 . . . . 0.32000000000000001 110.927 179.115 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.437 ' O ' HG22 ' A' ' 38' ' ' THR . 95.2 m -68.14 -30.63 69.81 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.985 0.421 . . . . 0.31 110.359 179.112 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 60.6 tp -71.73 -41.52 68.39 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.761 -0.654 . . . . 1.24 111.246 -179.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.419 ' SD ' ' HG3' ' A' ' 43' ' ' PRO . 48.2 mtp -72.31 -23.9 61.24 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.301 -0.409 . . . . 1.1000000000000001 110.849 179.807 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.421 ' HG3' ' O ' ' A' ' 33' ' ' GLY . 81.9 mtt180 -72.62 -46.14 55.59 Favored 'General case' 0 N--CA 1.461 0.125 0 CA-C-O 120.958 0.408 . . . . 2.6899999999999999 110.297 179.179 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.591 HG23 HD13 ' A' ' 39' ' ' LEU . 1.8 t -68.16 -11.16 58.73 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.958 -0.564 . . . . 1.0600000000000001 110.412 179.023 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.591 HD13 HG23 ' A' ' 38' ' ' THR . 8.4 mp -111.47 156.82 21.09 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.603 -0.726 . . . . 1.26 110.304 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -45.79 -24.42 1.26 Allowed Glycine 0 CA--C 1.519 0.323 0 C-N-CA 121.224 -0.512 . . . . 0.68999999999999995 113.439 -179.652 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.433 ' OE1' ' HB3' ' A' ' 39' ' ' LEU . 19.7 mp0 -57.07 152.94 12.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.893 0.377 . . . . 1.97 111.174 179.811 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 -155.28 71.87 5.61 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.067 -0.515 . . . . 2.6600000000000001 110.952 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.419 ' HG3' ' SD ' ' A' ' 36' ' ' MET . 60.0 Cg_endo -69.24 152.5 72.01 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.789 2.326 . . . . 0.51000000000000001 112.35 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 27.2 m -76.13 151.21 37.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.174 -0.466 . . . . 0.72999999999999998 110.321 179.397 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.445 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 1.3 mp0 -44.55 -55.08 5.43 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.678 0.275 . . . . 2.7000000000000002 111.191 -179.714 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -54.5 -45.01 73.17 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.234 -0.439 . . . . 0.46000000000000002 111.392 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -56.2 -49.83 72.96 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.234 -0.439 . . . . 2.23 111.216 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 17.5 mt -59.74 -41.78 91.73 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.683 0.278 . . . . 1.3600000000000001 110.934 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.445 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 78.0 mm-40 -66.64 -30.28 70.52 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.523 -0.308 . . . . 1.22 111.274 -179.702 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 -75.83 -54.99 6.06 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.424 -0.353 . . . . 0.62 111.431 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 3.1 pp -64.09 -38.14 89.99 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.437 -0.347 . . . . 0.39000000000000001 111.361 -179.469 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 44.9 mt -65.79 -43.92 93.19 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 C-N-CA 121.066 -0.253 . . . . 0.5 110.741 179.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.8 -29.55 70.8 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.929 0.395 . . . . 0.58999999999999997 110.739 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -74.59 -52.96 10.34 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.963 -0.562 . . . . 2.54 110.075 179.625 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -69.86 -14.44 62.75 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.014 -0.539 . . . . 0.53000000000000003 111.508 179.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -73.6 -37.04 65.56 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.851 0.358 . . . . 1.95 110.965 -179.647 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 18.0 m120 -89.6 16.67 7.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.235 -0.439 . . . . 2.48 110.656 179.683 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -142.39 151.55 41.97 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.905 -0.589 . . . . 2.48 110.627 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 2.5 m120 62.86 9.92 3.98 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.221 -0.445 . . . . 2.0499999999999998 111.17 179.704 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 14.2 m120 63.03 11.52 5.22 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.329 -0.396 . . . . 1.47 111.827 179.796 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 110.44 44.03 1.02 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.61 -0.805 . . . . 0.42999999999999999 112.822 179.496 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.639 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -147.62 154.83 41.14 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.066 0.46 . . . . 0.38 111.11 179.856 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.682 ' HB2' HG13 ' A' ' 27' ' ' ILE . 66.4 mt -124.47 155.88 38.18 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.809 -0.632 . . . . 1.4299999999999999 109.982 179.531 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . 0.475 ' OD1' ' HE3' ' A' ' 26' ' ' LYS . 0.6 OUTLIER -113.15 156.74 22.66 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.924 -0.31 . . . . 1.1899999999999999 110.505 -179.66 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -43.06 -50.23 6.07 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.117 -0.492 . . . . 0.40000000000000002 110.913 179.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.7 -29.59 69.62 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.285 -0.416 . . . . 0.81000000000000005 111.35 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.422 ' HG2' ' HB2' ' A' ' 64' ' ' ASN . 14.3 mm-40 -65.1 -55.45 18.7 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.831 0.348 . . . . 1.3600000000000001 110.203 179.317 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.713 ' CD1' HD11 ' A' ' 32' ' ' LEU . 32.8 t80 -63.98 -45.98 86.65 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.077 -0.511 . . . . 0.51000000000000001 109.993 179.255 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 62.7 m -57.34 -35.46 69.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.809 -0.632 . . . . 0.75 110.251 179.477 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -59.51 -54.4 38.07 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.788 -0.72 . . . . 0.40999999999999998 111.431 179.436 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.599 HG23 ' HE2' ' A' ' 74' ' ' LYS . 12.6 mt -60.16 -43.38 92.96 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.347 0 CA-C-O 121.108 0.48 . . . . 0.51000000000000001 110.173 179.099 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . 0.409 ' HG3' ' O ' ' A' ' 68' ' ' PHE . 40.1 mtp -53.76 -32.52 52.64 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.859 -0.61 . . . . 1.01 110.051 179.317 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -67.17 -47.71 70.15 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.186 -0.461 . . . . 0.69999999999999996 110.853 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.599 ' HE2' HG23 ' A' ' 71' ' ' ILE . 65.7 pttt -70.44 -28.9 65.39 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.412 -0.358 . . . . 1.3799999999999999 111.747 -179.591 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . 0.454 ' HG3' HG22 ' A' ' 71' ' ' ILE . 6.9 mm100 -82.1 -35.06 28.98 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.186 0.517 . . . . 1.98 111.155 -179.383 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 50.7 mtp . . . . . 0 C--N 1.326 -0.451 0 CA-C-N 115.525 -0.762 . . . . 1.2 111.969 -179.024 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.558 ' O ' ' HG2' ' A' ' 85' ' ' MET . 6.6 t . . . . . 0 N--CA 1.47 0.571 0 CA-C-O 120.98 0.419 . . . . 7.29 111.836 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -42.71 -30.91 0.41 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 115.57 -0.741 . . . . 9.7400000000000002 112.977 -179.152 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -60.56 -55.94 27.37 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 120.879 0.371 . . . . 12.109999999999999 111.52 -179.332 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -63.99 -21.93 66.71 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.169 -0.468 . . . . 10.869999999999999 111.167 -179.582 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' MET . . . . . 0.558 ' HG2' ' O ' ' A' ' 81' ' ' THR . 11.3 mmm -74.41 -41.13 61.42 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.895 0.379 . . . . 11.09 110.578 -179.558 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 50.8 ttp180 -62.46 -46.57 87.92 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.969 -0.559 . . . . 15.52 110.404 179.729 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.439 ' O ' HG12 ' A' ' 91' ' ' ILE . 40.7 tt0 -55.73 -47.05 77.56 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.029 0.442 . . . . 14.85 109.867 179.015 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.84 -32.89 74.79 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.796 -0.638 . . . . 14.109999999999999 111.034 179.616 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 81.7 t80 -61.5 -37.12 82.52 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-O 120.978 0.418 . . . . 15.73 110.494 179.777 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 89.0 mttt -69.21 -40.1 78.21 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.871 -0.604 . . . . 17.66 110.501 179.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.439 HG12 ' O ' ' A' ' 87' ' ' GLU . 37.4 mm -60.51 -50.5 80.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.897 -0.592 . . . . 18.149999999999999 111.567 -179.799 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.448 ' HB3' HD13 ' A' ' 100' ' ' ILE . 8.2 m-85 -66.79 -48.08 70.11 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.306 -0.406 . . . . 18.34 111.635 -179.347 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 53.6 t0 -60.83 93.82 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.984 0.421 . . . . 19.289999999999999 110.557 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.717 ' HE ' ' HG2' ' A' ' 104' ' ' GLU . 34.8 mtm180 -63.01 -11.55 19.83 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.9 -0.591 . . . . 22.25 111.49 -179.497 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.436 ' HB2' ' OD1' ' A' ' 97' ' ' ASP . 8.9 m-20 -119.82 170.23 9.42 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.965 0.412 . . . . 23.34 111.09 -179.78 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.49 5.21 57.02 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.925 -0.655 . . . . 22.0 112.256 179.602 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.436 ' OD1' ' HB2' ' A' ' 95' ' ' ASP . 5.0 p-10 -60.0 -38.6 83.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.66 0.267 . . . . 22.280000000000001 111.119 -179.657 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 113.05 15.04 9.42 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.804 -0.712 . . . . 19.93 112.955 179.648 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -142.34 154.13 44.41 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.613 0.244 . . . . 20.300000000000001 110.758 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.448 HD13 ' HB3' ' A' ' 92' ' ' PHE . 76.8 mt -114.11 140.7 33.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 121.023 0.44 . . . . 19.370000000000001 111.337 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . 0.438 ' OG ' ' HD2' ' A' ' 102' ' ' PRO . 31.1 t -114.51 154.22 46.6 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 115.589 -0.732 . . . . 22.489999999999998 109.956 179.785 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . 0.438 ' HD2' ' OG ' ' A' ' 101' ' ' SER . 57.7 Cg_exo -50.53 -36.19 48.55 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 121.941 1.76 . . . . 23.0 111.442 -179.892 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.73 -48.84 79.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.765 -0.652 . . . . 24.559999999999999 109.911 178.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . 0.717 ' HG2' ' HE ' ' A' ' 94' ' ' ARG . 45.4 mt-10 -59.47 -45.62 91.12 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.303 -0.862 . . . . 22.23 110.332 179.245 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.573 HD22 ' HB ' ' A' ' 121' ' ' ILE . 2.6 tt -63.29 -29.7 70.97 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.585 -0.734 . . . . 20.359999999999999 110.615 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.462 ' CZ ' HD11 ' A' ' 110' ' ' ILE . 12.1 tpt180 -72.81 -40.41 65.88 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.709 -0.678 . . . . 27.190000000000001 111.5 -179.645 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 53.3 t80 -76.87 -35.18 57.63 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 111.98 0.363 . . . . 25.359999999999999 111.98 -178.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.447 HG21 ' HA ' ' A' ' 92' ' ' PHE . 90.4 t -72.34 -47.45 52.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 111.692 0.256 . . . . 21.059999999999999 111.692 -179.455 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 12.9 mmt -50.98 -36.32 38.44 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.712 0.291 . . . . 20.93 111.283 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.462 HD11 ' CZ ' ' A' ' 106' ' ' ARG . 72.4 mt -67.94 -35.58 72.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.894 0.378 . . . . 25.129999999999999 110.636 179.801 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 -66.06 -37.94 87.08 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.025 -0.534 . . . . 23.32 110.744 179.594 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 14.6 mt -67.59 -28.89 68.14 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.999 -0.546 . . . . 21.07 110.954 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 116.28 0.14 20.65 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.9 -0.667 . . . . 23.050000000000001 112.305 -179.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -103.42 110.06 21.93 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.768 0.318 . . . . 22.59 110.978 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 17.6 tppt? -80.58 116.2 20.49 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.2 -0.455 . . . . 27.960000000000001 110.743 179.708 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 3.7 m -125.33 154.59 33.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.035 0.445 . . . . 24.75 111.569 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 80.6 p -95.68 146.27 24.63 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.735 -0.666 . . . . 27.239999999999998 110.085 179.173 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -53.55 -18.94 3.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.279 -0.418 . . . . 26.629999999999999 111.367 -179.597 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -79.22 -52.13 8.56 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.38 -0.373 . . . . 29.140000000000001 111.697 -179.49 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -63.09 -37.12 85.92 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.627 -0.261 . . . . 24.190000000000001 111.567 -179.269 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.573 ' HB ' HD22 ' A' ' 105' ' ' LEU . 48.3 pt -74.67 -35.46 37.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 C-N-CA 120.995 -0.282 . . . . 22.329999999999998 111.031 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -61.2 -38.59 87.1 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.961 0.41 . . . . 24.289999999999999 110.309 179.185 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -67.81 -43.48 79.54 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.897 -0.592 . . . . 24.739999999999998 110.52 179.488 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 50.2 ttp -58.11 -39.5 78.83 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.044 -0.525 . . . . 19.710000000000001 110.573 179.62 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.431 HG23 HD11 ' A' ' 136' ' ' ILE . 76.2 mt -66.94 -36.4 77.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.16 -0.473 . . . . 19.949999999999999 110.608 179.585 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 37.6 ttm180 -66.04 -29.92 70.35 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.173 -0.467 . . . . 24.949999999999999 110.806 179.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -75.88 -26.89 57.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.14 -0.482 . . . . 18.690000000000001 111.239 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.683 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -97.81 -16.23 19.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.245 -0.434 . . . . 16.469999999999999 111.173 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . 0.4 ' HA ' ' OE1' ' A' ' 140' ' ' GLU . 31.4 t70 -94.57 105.19 17.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.135 -0.484 . . . . 20.399999999999999 111.009 -179.564 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -100.33 -33.34 10.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.865 -0.607 . . . . 21.43 111.294 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -64.06 -27.95 69.45 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.375 -0.375 . . . . 23.370000000000001 110.715 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 75.98 81.88 0.52 Allowed Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.921 -0.657 . . . . 24.32 112.952 179.51 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 16.5 p-10 -155.66 6.66 0.22 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.745 0.307 . . . . 23.879999999999999 110.919 179.605 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 59.94 25.64 62.04 Favored Glycine 0 C--N 1.331 0.251 0 C-N-CA 120.891 -0.671 . . . . 22.670000000000002 112.551 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 96.8 mmm -135.96 152.5 51.02 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.596 0.236 . . . . 22.91 110.43 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.731 HG23 ' HB2' ' A' ' 140' ' ' GLU . 41.4 mm -115.86 138.71 45.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 121.341 0.591 . . . . 18.41 112.126 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . 0.454 ' O ' ' N ' ' A' ' 139' ' ' GLU . 26.4 p30 -115.38 158.85 21.87 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.267 -0.879 . . . . 16.82 109.036 178.035 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.65 ' O ' HG23 ' A' ' 142' ' ' VAL . 28.6 t80 -38.49 -24.21 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 112.589 0.589 . . . . 14.65 112.589 -179.029 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . 0.454 ' N ' ' O ' ' A' ' 137' ' ' ASN . 44.4 mt-10 -80.25 -55.78 4.67 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.822 0.344 . . . . 14.82 111.213 -179.437 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.731 ' HB2' HG23 ' A' ' 136' ' ' ILE . 24.8 mt-10 -60.22 -27.17 66.98 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.174 -0.466 . . . . 17.460000000000001 110.266 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.725 ' HA ' ' HE2' ' A' ' 144' ' ' MET . 69.0 t80 -71.14 -56.34 6.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.877 -0.601 . . . . 12.93 110.415 179.54 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.65 HG23 ' O ' ' A' ' 138' ' ' TYR . 43.1 t -44.73 -48.05 2.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.774 -0.648 . . . . 10.699999999999999 111.794 179.432 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 78.8 t90 -64.65 -55.43 20.25 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.513 0.56 . . . . 13.66 112.513 -178.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . 0.725 ' HE2' ' HA ' ' A' ' 141' ' ' PHE . 16.7 ptt? -60.37 -35.41 75.64 Favored 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 112.451 0.538 . . . . 14.5 112.451 -178.004 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 145' ' ' ILE . . . . . 0.635 HG21 ' CZ ' ' A' ' 141' ' ' PHE . 3.2 pt -80.93 -17.27 12.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 C-N-CA 120.591 -0.444 . . . . 11.25 111.275 -179.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 42.2 t -69.25 -36.46 77.17 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.399 -0.593 . . . . 8.5399999999999991 109.399 179.231 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 31.8 mm-40 -93.56 -16.48 24.36 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.138 -0.937 . . . . 11.869999999999999 110.229 179.382 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . 0.438 ' CB ' ' HA ' ' A' ' 145' ' ' ILE . 37.6 ttpt . . . . . 0 C--O 1.25 1.112 0 CA-C-O 118.231 -0.89 . . . . 13.68 110.961 179.474 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 9.8 mp . . . . . 0 C--O 1.233 0.21 0 CA-C-O 120.651 0.262 . . . . 1.27 111.491 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -62.88 167.0 5.02 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.422 -0.354 . . . . 1.1200000000000001 110.68 179.616 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -49.37 -39.8 33.51 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.707 0.289 . . . . 2.2000000000000002 111.436 179.597 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.95 -33.72 59.83 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.432 -0.349 . . . . 1.3500000000000001 110.699 -179.593 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 -67.02 -44.73 79.5 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.001 -0.545 . . . . 2.2200000000000002 110.583 179.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.531 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 80.4 mt -61.29 -51.77 69.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.992 -0.549 . . . . 0.54000000000000004 110.755 179.804 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.48 -21.0 66.53 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.044 -0.526 . . . . 0.5 111.193 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -72.09 -56.42 5.64 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 116.405 -0.361 . . . . 2.27 111.696 -179.405 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.531 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 8.6 p90 -77.85 -24.67 48.52 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.703 -0.399 . . . . 0.37 110.823 -179.636 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.426 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 20.1 tptm -66.81 -36.93 83.51 Favored 'General case' 0 C--O 1.233 0.201 0 N-CA-C 109.355 -0.609 . . . . 1.23 109.355 178.738 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.447 ' O ' HG22 ' A' ' 17' ' ' VAL . 23.5 t70 -68.05 -48.18 66.32 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 109.224 -0.658 . . . . 0.44 109.224 178.347 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.72 -14.31 61.04 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.666 -0.697 . . . . 0.28999999999999998 110.528 178.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.426 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 81.2 t80 -77.48 -49.94 13.7 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-N 115.929 -0.578 . . . . 0.47999999999999998 110.18 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.447 HG22 ' O ' ' A' ' 14' ' ' ASP . 34.0 m -66.91 -21.4 28.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.075 -0.511 . . . . 1.1100000000000001 110.141 179.395 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.435 ' HG3' ' O ' ' A' ' 14' ' ' ASP . 70.5 mt-30 -59.99 -46.17 90.34 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.625 -0.716 . . . . 1.6000000000000001 111.212 179.2 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 25.8 m-85 -84.36 22.33 1.27 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.304 -0.407 . . . . 0.64000000000000001 111.565 -179.471 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -120.45 66.15 0.84 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.146 0.498 . . . . 0.44 110.441 179.385 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 11.2 mmmm -73.32 -26.19 60.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.77 -0.65 . . . . 2.1000000000000001 111.269 -179.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -68.89 -42.64 76.66 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.111 -0.495 . . . . 1.8 111.306 -179.629 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 107.73 11.77 24.09 Favored Glycine 0 C--N 1.331 0.272 0 C-N-CA 120.723 -0.751 . . . . 0.46000000000000002 112.791 179.683 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 38.5 p -86.18 10.35 14.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.71 0.29 . . . . 0.40000000000000002 111.199 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 55.68 20.12 23.35 Favored Glycine 0 C--N 1.332 0.333 0 C-N-CA 120.803 -0.713 . . . . 0.33000000000000002 112.126 -179.703 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.504 ' C ' HE22 ' A' ' 62' ' ' GLN . 32.5 mtpt -130.35 155.93 45.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.727 0.299 . . . . 1.1000000000000001 111.081 -179.669 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.464 ' N ' HE22 ' A' ' 62' ' ' GLN . 39.5 pt -115.5 133.7 61.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.408 -0.36 . . . . 0.5 111.494 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -48.8 143.21 5.51 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.116 -0.493 . . . . 0.29999999999999999 111.696 -179.672 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.485 ' HA ' HD11 ' A' ' 63' ' ' LEU . 58.5 p -68.86 -29.87 68.27 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.662 -0.699 . . . . 1.03 111.724 -179.704 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.545 ' HD3' ' H ' ' A' ' 30' ' ' ARG . 0.2 OUTLIER -86.11 0.47 53.43 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.392 -0.367 . . . . 3.0800000000000001 111.109 -179.536 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -109.29 -3.57 17.08 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.105 -0.498 . . . . 2.2599999999999998 110.845 179.824 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.494 HD23 HD13 ' A' ' 63' ' ' LEU . 1.4 tm? -61.03 -52.33 65.43 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.232 -0.44 . . . . 1.3700000000000001 110.616 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.447 ' HA2' HD21 ' A' ' 48' ' ' LEU . . . -52.41 -41.25 55.12 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.638 -0.791 . . . . 0.32000000000000001 111.633 179.441 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 89.4 m -64.5 -34.67 78.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.018 0.437 . . . . 0.31 110.218 179.103 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 28.9 tp -66.82 -23.72 66.08 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.711 -0.677 . . . . 1.24 110.525 179.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.42 ' HG3' ' HG3' ' A' ' 43' ' ' PRO . 23.3 mmt -78.92 -39.23 35.34 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.221 -0.445 . . . . 1.1000000000000001 110.039 178.846 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 70.3 mtt180 -59.19 -43.12 92.2 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.691 -0.686 . . . . 2.6899999999999999 111.068 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.488 HG23 HD13 ' A' ' 39' ' ' LEU . 2.0 t -70.4 -13.29 62.07 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.38 -0.373 . . . . 1.0600000000000001 111.42 179.886 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.488 HD13 HG23 ' A' ' 38' ' ' THR . 10.6 mp -113.14 157.14 22.03 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.193 -0.458 . . . . 1.26 110.59 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -48.29 -19.23 1.07 Allowed Glycine 0 CA--C 1.519 0.314 0 CA-C-N 116.013 -0.54 . . . . 0.68999999999999995 113.441 -179.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 61.9 mm-40 -59.03 168.57 1.28 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.885 0.374 . . . . 1.97 110.894 179.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 6.0 t30 -170.27 64.35 0.47 Allowed Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.068 -0.515 . . . . 2.6600000000000001 110.777 179.605 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.534 ' HB3' ' NE2' ' A' ' 75' ' ' GLN . 32.1 Cg_endo -64.8 154.96 70.07 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.633 2.222 . . . . 0.51000000000000001 112.449 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.403 HG22 ' N ' ' A' ' 45' ' ' GLU . 20.8 m -80.43 157.01 26.37 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.027 -0.533 . . . . 0.72999999999999998 110.69 179.765 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.403 ' N ' HG22 ' A' ' 44' ' ' THR . 39.2 tt0 -46.77 -49.05 20.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.549 -0.296 . . . . 2.7000000000000002 111.343 -179.701 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.09 -55.27 25.2 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.199 -0.455 . . . . 0.46000000000000002 111.516 -179.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -50.7 -50.84 54.09 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.289 -0.414 . . . . 2.23 111.045 -179.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.502 HD13 HD11 ' A' ' 51' ' ' LEU . 0.2 OUTLIER -58.25 -40.66 82.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.295 -0.411 . . . . 1.3600000000000001 110.866 -179.844 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 85.0 mm-40 -67.42 -29.64 69.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.421 -0.354 . . . . 1.22 110.976 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -70.68 -49.37 47.94 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.22 -0.446 . . . . 0.62 111.529 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.502 HD11 HD13 ' A' ' 48' ' ' LEU . 0.9 OUTLIER -72.78 -28.32 62.52 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.49 -0.323 . . . . 0.39000000000000001 111.614 -179.375 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.493 HD11 HD12 ' A' ' 48' ' ' LEU . 28.2 mt -70.21 -46.03 73.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 120.771 0.319 . . . . 0.5 110.389 179.467 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.94 -25.53 62.78 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.079 -0.51 . . . . 0.58999999999999997 111.083 -179.884 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -77.98 -46.57 20.73 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.194 -0.457 . . . . 2.54 110.731 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -74.39 -27.13 60.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.188 -0.46 . . . . 0.53000000000000003 111.378 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -64.76 -34.38 78.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.796 0.331 . . . . 1.95 110.985 -179.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -111.53 59.64 0.62 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.229 -0.441 . . . . 2.48 111.079 -179.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -170.81 -55.17 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.051 -0.522 . . . . 2.48 110.684 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 1.5 p30 -110.96 27.16 9.95 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.867 -0.606 . . . . 2.0499999999999998 110.818 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . 0.544 ' N ' HD22 ' A' ' 60' ' ' ASN . 0.8 OUTLIER 62.66 -81.75 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.945 -0.57 . . . . 1.47 111.331 179.877 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -158.49 34.83 0.51 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.752 -0.737 . . . . 0.42999999999999999 112.546 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.504 HE22 ' C ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -140.47 150.22 43.52 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.031 0.443 . . . . 0.38 111.379 179.893 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.494 HD13 HD23 ' A' ' 32' ' ' LEU . 13.5 mt -121.99 155.48 35.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.804 -0.634 . . . . 1.4299999999999999 110.566 -179.905 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -113.4 157.03 22.42 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.482 -0.326 . . . . 1.1899999999999999 110.847 -179.657 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 59.7 t80 -43.16 -35.16 1.27 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.427 -0.351 . . . . 0.40000000000000002 111.228 179.571 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.35 -38.8 59.89 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.143 0.423 . . . . 0.81000000000000005 112.143 -179.579 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -63.99 -53.19 54.01 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.216 0.531 . . . . 1.3600000000000001 110.28 179.636 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.48 ' HD1' HD21 ' A' ' 32' ' ' LEU . 18.4 t80 -59.22 -52.41 65.82 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.495 -0.775 . . . . 0.51000000000000001 110.789 179.459 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 35.8 t -56.54 -49.0 76.09 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 116.28 -0.418 . . . . 0.75 110.51 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -43.67 -50.94 6.96 Favored Glycine 0 N--CA 1.45 -0.391 0 CA-C-N 115.503 -0.771 . . . . 0.40999999999999998 112.313 179.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.537 HG23 ' HE3' ' A' ' 74' ' ' LYS . 11.0 mt -67.1 -42.69 88.62 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.373 0 CA-C-O 120.823 0.344 . . . . 0.51000000000000001 111.064 179.752 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . 0.403 ' HG2' ' O ' ' A' ' 68' ' ' PHE . 87.8 mmm -53.26 -41.05 65.1 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.28 0.562 . . . . 1.01 110.003 179.344 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.8 -53.24 60.28 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.297 -0.865 . . . . 0.69999999999999996 111.087 179.481 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.537 ' HE3' HG23 ' A' ' 71' ' ' ILE . 18.8 pttp -67.94 -27.09 66.32 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 120.858 0.361 . . . . 1.3799999999999999 111.327 -179.81 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . 0.534 ' NE2' ' HB3' ' A' ' 43' ' ' PRO . 35.2 tt0 -80.35 -28.05 38.13 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.104 -0.498 . . . . 1.98 111.826 -179.352 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 38.6 mtt . . . . . 0 N--CA 1.45 -0.454 0 CA-C-N 116.448 -0.342 . . . . 1.2 111.541 -179.483 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.471 ' O ' ' HG3' ' A' ' 85' ' ' MET . 2.7 t . . . . . 0 N--CA 1.466 0.358 0 CA-C-O 120.592 0.235 . . . . 7.29 111.289 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -79.86 -28.73 39.98 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 112.776 0.658 . . . . 9.7400000000000002 112.776 -178.3 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -59.91 -49.14 78.84 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.907 -0.317 . . . . 12.109999999999999 111.461 -179.393 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -69.72 -21.94 63.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.982 0.42 . . . . 10.869999999999999 110.628 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' MET . . . . . 0.604 ' SD ' HG13 ' A' ' 142' ' ' VAL . 23.9 mtt -72.75 -47.75 44.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.827 -0.624 . . . . 11.09 111.103 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.404 ' O ' ' HB3' ' A' ' 89' ' ' PHE . 64.7 ttt180 -62.17 -38.21 88.17 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.396 -0.365 . . . . 15.52 110.195 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -59.01 -45.11 91.49 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.165 -0.68 . . . . 14.85 109.165 178.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -69.15 -27.92 65.97 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.476 -0.784 . . . . 14.109999999999999 110.557 179.259 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.404 ' HB3' ' O ' ' A' ' 86' ' ' ARG . 62.0 t80 -63.4 -41.93 98.76 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.158 -0.474 . . . . 15.73 110.27 179.437 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 53.8 mttp -66.74 -41.82 87.2 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.765 -0.652 . . . . 17.66 110.435 179.481 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 78.3 mt -64.49 -39.61 86.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.102 -0.499 . . . . 18.149999999999999 111.076 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.535 ' HD1' HG11 ' A' ' 108' ' ' VAL . 1.7 m-85 -73.79 -33.75 64.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.345 -0.389 . . . . 18.34 111.103 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 51.1 t0 -81.27 114.87 20.36 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.364 -0.38 . . . . 19.289999999999999 110.507 179.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.525 ' HG2' ' HB3' ' A' ' 104' ' ' GLU . 22.0 mmm180 -65.47 -57.48 8.17 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.004 -0.544 . . . . 22.25 110.992 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.99 160.3 22.04 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.093 -0.503 . . . . 23.34 110.975 -179.693 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -84.18 5.49 79.88 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.857 -0.687 . . . . 22.0 112.175 179.641 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 16.8 p-10 -57.81 -33.36 68.5 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.747 0.308 . . . . 22.280000000000001 111.185 -179.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 96.04 26.97 10.63 Favored Glycine 0 C--N 1.331 0.274 0 C-N-CA 120.833 -0.699 . . . . 19.93 112.619 179.813 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 68.0 m-85 -142.57 142.69 32.21 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.599 0.238 . . . . 20.300000000000001 110.853 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.407 ' HB ' ' HB ' ' A' ' 136' ' ' ILE . 65.5 mt -114.38 127.27 71.92 Favored 'Isoleucine or valine' 0 C--O 1.231 0.126 0 CA-C-O 121.0 0.429 . . . . 19.370000000000001 111.17 179.882 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 75.6 m -114.44 156.5 44.44 Favored Pre-proline 0 C--N 1.332 -0.182 0 CA-C-N 115.879 -0.6 . . . . 22.489999999999998 110.783 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_exo -44.13 -35.86 8.16 Favored 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 122.41 2.073 . . . . 23.0 112.284 -179.813 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.436 ' O ' ' HG3' ' A' ' 106' ' ' ARG . . . -63.83 -48.11 78.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.169 -0.468 . . . . 24.559999999999999 110.734 179.709 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . 0.525 ' HB3' ' HG2' ' A' ' 94' ' ' ARG . 45.4 mt-10 -72.9 -19.89 61.19 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.837 -0.619 . . . . 22.23 110.842 179.703 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.841 HD23 ' HB ' ' A' ' 121' ' ' ILE . 14.7 tp -80.16 -39.98 28.26 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.062 -0.517 . . . . 20.359999999999999 111.691 -179.22 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.489 ' HB3' HD13 ' A' ' 121' ' ' ILE . 7.4 ppt_? -73.76 -35.79 65.04 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.852 0.358 . . . . 27.190000000000001 110.517 -179.834 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 60.4 t80 -69.41 -44.7 70.85 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.963 -0.562 . . . . 25.359999999999999 111.306 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.535 HG11 ' HD1' ' A' ' 92' ' ' PHE . 7.3 p -63.75 -43.74 98.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.529 -0.305 . . . . 21.059999999999999 111.571 -179.536 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.464 ' N ' HG13 ' A' ' 108' ' ' VAL . 20.6 mmt -55.43 -45.63 76.75 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.519 -0.309 . . . . 20.93 111.29 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 81.2 mt -59.35 -25.05 29.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.963 0.411 . . . . 25.129999999999999 110.619 179.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 80.1 m-20 -77.67 -39.41 44.96 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.963 -0.562 . . . . 23.32 110.533 179.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.431 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 10.5 mt -69.68 -28.68 66.07 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.93 -0.577 . . . . 21.07 110.668 179.859 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 113.18 17.08 7.94 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.921 -0.657 . . . . 23.050000000000001 112.523 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -113.88 108.8 17.55 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.804 0.335 . . . . 22.59 111.087 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -77.04 113.83 15.18 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.163 -0.471 . . . . 27.960000000000001 110.989 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . 0.488 ' HB ' HG23 ' A' ' 121' ' ' ILE . 1.2 m -127.39 155.01 38.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.026 0.441 . . . . 24.75 111.6 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . 0.44 ' O ' HG12 ' A' ' 121' ' ' ILE . 72.2 p -99.34 144.26 28.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.793 -0.639 . . . . 27.239999999999998 110.227 179.275 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -51.77 -20.94 2.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.274 -0.421 . . . . 26.629999999999999 111.551 -179.506 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 12.9 mm-40 -77.43 -55.33 5.48 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.502 -0.317 . . . . 29.140000000000001 111.694 -179.618 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -61.63 -40.92 96.59 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 111.825 0.306 . . . . 24.190000000000001 111.825 -179.204 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.841 ' HB ' HD23 ' A' ' 105' ' ' LEU . 4.9 pt -68.59 -42.67 83.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 C-N-CA 121.062 -0.255 . . . . 22.329999999999998 111.584 -179.442 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . 0.523 ' N ' HG13 ' A' ' 121' ' ' ILE . 24.0 t70 -59.76 -33.16 71.32 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.825 0.345 . . . . 24.289999999999999 110.649 179.842 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 -66.06 -49.19 68.5 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.034 -0.53 . . . . 24.739999999999998 110.434 179.562 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.409 ' CE ' HD21 ' A' ' 105' ' ' LEU . 3.1 tmm? -56.96 -37.94 72.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.032 -0.531 . . . . 19.710000000000001 111.054 179.547 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.602 HD11 HD22 ' A' ' 105' ' ' LEU . 66.4 mt -65.55 -43.52 94.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.291 -0.413 . . . . 19.949999999999999 110.516 179.793 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 23.9 ttm180 -57.43 -35.43 70.08 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.892 -0.595 . . . . 24.949999999999999 110.984 179.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -69.47 -43.5 73.11 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.166 -0.47 . . . . 18.690000000000001 110.969 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.611 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -80.4 -12.22 59.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.217 -0.447 . . . . 16.469999999999999 111.283 -179.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -101.31 106.14 17.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.161 -0.472 . . . . 20.399999999999999 110.942 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 82.1 m-85 -98.16 -33.64 11.05 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.911 -0.586 . . . . 21.43 111.032 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -65.1 -16.41 63.44 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.213 -0.449 . . . . 23.370000000000001 110.772 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 61.16 82.75 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.871 -0.68 . . . . 24.32 112.55 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -151.68 -6.68 0.24 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.65 0.262 . . . . 23.879999999999999 111.393 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 74.66 20.47 79.51 Favored Glycine 0 C--N 1.331 0.253 0 C-N-CA 120.785 -0.721 . . . . 22.670000000000002 112.815 179.647 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 47.9 mtp -136.01 155.64 49.93 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.623 0.249 . . . . 22.91 110.385 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.706 HG23 ' HB2' ' A' ' 140' ' ' GLU . 48.6 mm -114.84 140.17 37.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 121.309 0.576 . . . . 18.41 112.092 -179.416 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . 0.449 ' O ' ' N ' ' A' ' 139' ' ' GLU . 1.9 m-20 -115.07 157.84 22.96 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.919 -1.037 . . . . 16.82 108.996 178.594 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 31.2 t80 -40.0 -23.84 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 120.762 0.315 . . . . 14.65 111.605 179.795 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . 0.449 ' N ' ' O ' ' A' ' 137' ' ' ASN . 19.4 mm-40 -80.53 -55.77 4.63 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-O 120.958 0.408 . . . . 14.82 110.871 -179.586 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.706 ' HB2' HG23 ' A' ' 136' ' ' ILE . 25.8 mt-10 -61.27 -33.42 73.52 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.958 -0.565 . . . . 17.460000000000001 110.693 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.594 ' CZ ' HG21 ' A' ' 145' ' ' ILE . 76.9 t80 -66.91 -56.06 11.93 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.914 -0.585 . . . . 12.93 110.194 179.796 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.604 HG13 ' SD ' ' A' ' 85' ' ' MET . 2.5 t -45.75 -44.86 4.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.554 -0.748 . . . . 10.699999999999999 112.138 179.83 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 79.8 t90 -65.13 -55.58 17.89 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.439 0.533 . . . . 13.66 112.439 -178.69 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . 0.611 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 17.3 ptt? -60.28 -36.71 78.48 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 112.099 0.407 . . . . 14.5 112.099 -178.185 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 145' ' ' ILE . . . . . 0.594 HG21 ' CZ ' ' A' ' 141' ' ' PHE . 2.8 pt -80.73 -15.39 12.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 C-N-CA 120.803 -0.359 . . . . 11.25 111.327 179.817 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 45.0 t -69.42 -38.9 78.09 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.385 -0.598 . . . . 8.5399999999999991 109.385 179.589 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 10.0 mm-40 -87.03 -21.07 26.33 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.313 -0.858 . . . . 11.869999999999999 109.945 178.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 24.5 ttpp . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.258 -0.877 . . . . 13.68 111.11 179.7 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.497 HD13 ' SG ' ' A' ' 69' ' ' CYS . 78.7 mt . . . . . 0 C--O 1.232 0.178 0 CA-C-O 120.805 0.336 . . . . 1.27 111.165 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 50.5 p -73.19 -176.37 2.15 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.434 -0.348 . . . . 1.1200000000000001 111.525 -179.799 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -64.7 -38.08 89.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.475 -0.329 . . . . 2.2000000000000002 111.518 -179.586 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -75.06 -44.26 48.67 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.963 0.411 . . . . 1.3500000000000001 111.009 -179.549 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 27.6 mt-30 -61.92 -46.2 90.4 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.892 -0.595 . . . . 2.2200000000000002 110.885 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.542 ' HA ' ' CZ ' ' A' ' 12' ' ' PHE . 62.9 mt -58.56 -52.64 57.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.135 -0.484 . . . . 0.54000000000000004 111.006 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.85 -20.8 65.44 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.417 -0.356 . . . . 0.5 111.584 -179.722 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -70.82 -56.82 5.47 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 111.78 0.289 . . . . 2.27 111.78 -179.273 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.542 ' CZ ' ' HA ' ' A' ' 9' ' ' ILE . 19.3 p90 -79.57 -26.9 41.22 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 120.591 -0.444 . . . . 0.37 110.922 -179.692 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.428 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 45.8 tptt -65.51 -34.2 77.72 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 109.387 -0.598 . . . . 1.23 109.387 178.889 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.548 ' O ' HG22 ' A' ' 17' ' ' VAL . 14.4 t70 -69.98 -50.09 45.13 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 108.998 -0.742 . . . . 0.44 108.998 178.187 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.89 -14.8 50.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.663 -0.699 . . . . 0.28999999999999998 110.277 178.771 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.428 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 44.9 t80 -80.32 -45.47 17.78 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.636 -0.711 . . . . 0.47999999999999998 110.733 -179.616 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.548 HG22 ' O ' ' A' ' 14' ' ' ASP . 24.6 m -69.62 -20.46 23.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 121.003 0.43 . . . . 1.1100000000000001 110.288 179.749 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.469 ' HG3' ' O ' ' A' ' 14' ' ' ASP . 78.3 mt-30 -60.38 -29.43 68.94 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.784 -0.643 . . . . 1.6000000000000001 111.175 179.471 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 56.8 m-85 -104.34 13.64 31.69 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.558 -0.292 . . . . 0.64000000000000001 111.7 -179.409 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -114.12 81.96 1.62 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.981 0.419 . . . . 0.44 110.921 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 43.8 mmtm -85.42 -34.59 21.67 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.969 -0.56 . . . . 2.1000000000000001 111.291 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -62.26 -28.53 69.77 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.127 -0.488 . . . . 1.8 111.296 -179.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 89.69 7.25 69.1 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.697 -0.763 . . . . 0.46000000000000002 112.72 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 21.9 p -76.76 7.87 4.25 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.583 0.23 . . . . 0.40000000000000002 111.231 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 55.88 27.23 49.9 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.609 -0.805 . . . . 0.33000000000000002 111.745 -179.436 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.676 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 37.8 mtpt -136.68 155.56 49.71 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.858 0.361 . . . . 1.1000000000000001 111.095 -179.402 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.431 ' N ' HE22 ' A' ' 62' ' ' GLN . 46.5 pt -125.51 143.51 38.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.11 -0.496 . . . . 0.5 111.252 -179.735 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -56.92 124.98 20.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.365 -0.38 . . . . 0.29999999999999999 111.04 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.1 t -62.03 -13.36 25.31 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.116 -0.493 . . . . 1.03 111.268 -179.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 68.1 mtp180 -79.75 -29.07 40.41 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.125 -0.488 . . . . 3.0800000000000001 110.565 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -93.54 3.89 54.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.959 -0.564 . . . . 2.2599999999999998 110.341 179.678 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.442 HD23 HD22 ' A' ' 63' ' ' LEU . 0.8 OUTLIER -56.91 -55.29 36.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.794 -0.639 . . . . 1.3700000000000001 110.636 -179.932 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.478 ' HA3' HD21 ' A' ' 48' ' ' LEU . . . -53.91 -42.63 70.39 Favored Glycine 0 C--N 1.331 0.282 0 C-N-CA 120.556 -0.831 . . . . 0.32000000000000001 111.892 179.551 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 57.8 m -62.69 -36.35 82.64 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.094 0.473 . . . . 0.31 110.573 179.278 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 62.9 tp -65.28 -31.65 72.91 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.799 -0.637 . . . . 1.24 110.822 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.437 ' HG3' ' O ' ' A' ' 32' ' ' LEU . 19.3 mtp -80.48 -28.59 37.51 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.129 -0.487 . . . . 1.1000000000000001 110.851 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 24.9 mtp180 -65.23 -44.12 89.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.49 -0.323 . . . . 2.6899999999999999 110.731 179.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.452 HG23 ' CD1' ' A' ' 39' ' ' LEU . 1.3 t -65.59 -13.67 59.53 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.956 0.408 . . . . 1.0600000000000001 110.991 179.579 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.452 ' CD1' HG23 ' A' ' 38' ' ' THR . 8.8 mp -113.86 156.87 23.16 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.996 -0.547 . . . . 1.26 110.65 179.584 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -46.51 -27.95 3.22 Favored Glycine 0 CA--C 1.52 0.372 0 C-N-CA 120.886 -0.673 . . . . 0.68999999999999995 113.161 -179.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -60.66 154.64 20.87 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.712 0.292 . . . . 1.97 111.157 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 48.5 t-20 -172.13 82.61 0.46 Allowed Pre-proline 0 C--N 1.33 -0.242 0 CA-C-N 116.222 -0.444 . . . . 2.6600000000000001 110.747 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.401 ' HB3' ' NE2' ' A' ' 75' ' ' GLN . 56.1 Cg_endo -70.27 159.26 53.63 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.512 2.141 . . . . 0.51000000000000001 112.367 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 37.7 m -65.17 146.83 54.46 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.107 -0.497 . . . . 0.72999999999999998 110.584 179.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.499 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 16.8 mm-40 -48.38 -55.68 10.14 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.843 -0.162 . . . . 2.7000000000000002 111.377 -179.47 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -49.15 -42.66 40.32 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.784 0.326 . . . . 0.46000000000000002 111.248 -179.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.522 ' HG3' HD23 ' A' ' 51' ' ' LEU . 7.9 tp10 -64.52 -50.76 66.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.16 -0.473 . . . . 2.23 110.288 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.478 HD21 ' HA3' ' A' ' 33' ' ' GLY . 33.0 tp -57.32 -33.83 68.11 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.957 -0.565 . . . . 1.3600000000000001 110.9 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.499 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 77.4 mm-40 -73.55 -34.67 65.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.314 -0.403 . . . . 1.22 110.511 179.71 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 56.4 m-20 -72.26 -55.27 7.46 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.099 -0.501 . . . . 0.62 111.649 -179.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.522 HD23 ' HG3' ' A' ' 47' ' ' GLU . 1.9 pp -61.2 -34.64 75.41 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 111.823 0.305 . . . . 0.39000000000000001 111.823 -179.207 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 49.4 mt -72.01 -53.62 19.45 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 120.692 0.282 . . . . 0.5 110.857 179.61 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.85 -26.23 65.66 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.341 -0.39 . . . . 0.58999999999999997 111.036 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -77.33 -51.86 10.14 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.191 -0.459 . . . . 2.54 110.697 179.885 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -69.53 -16.6 63.46 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.197 -0.456 . . . . 0.53000000000000003 111.294 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -80.08 -36.66 35.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.361 -0.382 . . . . 1.95 110.964 -179.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 18.9 m120 -98.5 36.57 1.61 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.201 -0.454 . . . . 2.48 110.991 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -159.54 -27.39 0.07 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.172 -0.467 . . . . 2.48 110.937 179.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 10.4 m120 -120.19 20.44 12.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.273 -0.421 . . . . 2.0499999999999998 110.825 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 24.5 m-80 64.13 -81.34 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 115.901 -0.591 . . . . 1.47 111.453 179.694 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -154.84 5.21 0.26 Allowed Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.547 -0.835 . . . . 0.42999999999999999 113.001 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.676 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -117.23 153.91 32.08 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.984 0.421 . . . . 0.38 111.619 -179.945 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.525 ' HG ' ' HB2' ' A' ' 67' ' ' GLU . 1.7 tp -128.62 153.62 47.07 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.699 -0.682 . . . . 1.4299999999999999 110.201 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 10.9 m-80 -110.61 157.0 20.16 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-O 121.343 0.592 . . . . 1.1899999999999999 111.472 -179.363 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.443 ' O ' ' HB2' ' A' ' 69' ' ' CYS . 88.1 t80 -46.39 -38.91 9.58 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.91 -1.041 . . . . 0.40000000000000002 111.736 -179.439 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -67.49 -37.54 83.01 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.606 0.595 . . . . 0.81000000000000005 112.606 -179.087 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.525 ' HB2' ' HG ' ' A' ' 63' ' ' LEU . 7.7 mt-10 -63.92 -52.91 57.65 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.126 0.489 . . . . 1.3600000000000001 109.842 179.611 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.447 ' O ' ' HG3' ' A' ' 72' ' ' MET . 28.2 t80 -59.53 -54.39 47.14 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.551 -0.75 . . . . 0.51000000000000001 110.608 179.175 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.497 ' SG ' HD13 ' A' ' 4' ' ' LEU . 0.5 OUTLIER -53.78 -46.63 71.08 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.2 -0.455 . . . . 0.75 110.729 -179.986 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -48.28 -54.27 13.19 Favored Glycine 0 C--N 1.331 0.291 0 CA-C-N 115.857 -0.61 . . . . 0.40999999999999998 112.564 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.466 HG23 ' CE ' ' A' ' 74' ' ' LYS . 11.5 mt -61.79 -43.09 96.77 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.297 0 CA-C-O 120.861 0.363 . . . . 0.51000000000000001 110.751 179.755 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . 0.447 ' HG3' ' O ' ' A' ' 68' ' ' PHE . 61.8 mtp -54.9 -28.93 54.39 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.965 -0.561 . . . . 1.01 110.05 179.582 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.89 -50.3 36.49 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.964 -0.562 . . . . 0.69999999999999996 110.754 179.63 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.466 ' CE ' HG23 ' A' ' 71' ' ' ILE . 63.8 pttt -68.84 -28.49 66.77 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.357 -0.383 . . . . 1.3799999999999999 111.655 -179.616 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . 0.401 ' NE2' ' HB3' ' A' ' 43' ' ' PRO . 7.5 tt0 -81.0 -55.05 5.04 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.123 0.416 . . . . 1.98 112.123 -179.319 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 71.3 mtp . . . . . 0 N--CA 1.454 -0.256 0 N-CA-C 112.282 0.475 . . . . 1.2 112.282 -178.883 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.602 ' O ' ' HG3' ' A' ' 85' ' ' MET . 65.7 m . . . . . 0 CA--C 1.528 0.104 0 N-CA-C 111.707 0.262 . . . . 7.29 111.707 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.43 ' HB3' ' OH ' ' A' ' 138' ' ' TYR . 44.9 mt-10 -55.55 -16.34 3.83 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 112.873 0.694 . . . . 9.7400000000000002 112.873 -178.772 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -61.38 -55.99 25.38 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.863 0.364 . . . . 12.109999999999999 111.693 -179.329 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -71.59 -21.76 61.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.338 -0.392 . . . . 10.869999999999999 111.148 -179.522 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' MET . . . . . 0.646 ' HB3' HD11 ' A' ' 145' ' ' ILE . 10.8 mtp -74.38 -39.58 62.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.353 -0.385 . . . . 11.09 110.908 -179.473 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 61.4 ttt180 -69.76 -41.41 75.24 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.064 -0.517 . . . . 15.52 110.327 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -59.35 -40.93 87.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.219 0.533 . . . . 14.85 109.596 178.857 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -69.62 -29.51 67.02 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.652 -0.704 . . . . 14.109999999999999 110.425 179.277 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 64.0 t80 -66.91 -41.18 87.51 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.053 -0.521 . . . . 15.73 110.483 179.466 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 49.0 mttm -64.07 -42.93 96.82 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.882 -0.599 . . . . 17.66 110.789 179.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 84.0 mt -64.8 -46.95 90.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.892 -0.595 . . . . 18.149999999999999 111.066 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.493 ' CD1' HG11 ' A' ' 108' ' ' VAL . 2.2 m-85 -60.02 -48.03 83.41 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.256 -0.429 . . . . 18.34 110.867 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 42.9 t0 -64.68 109.49 2.04 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.074 -0.512 . . . . 19.289999999999999 110.608 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.477 ' HG2' ' HB3' ' A' ' 104' ' ' GLU . 19.1 mmm180 -64.84 -42.2 95.1 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.114 -0.494 . . . . 22.25 111.141 -179.441 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -94.39 178.46 5.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.277 -0.42 . . . . 23.34 110.969 -179.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.14 5.24 57.57 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.962 -0.637 . . . . 22.0 112.033 179.562 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 18.5 p-10 -63.54 -31.66 72.89 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.783 0.325 . . . . 22.280000000000001 111.079 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 93.41 27.28 13.5 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.784 -0.722 . . . . 19.93 112.606 179.704 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 67.9 m-85 -138.88 143.52 38.78 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.594 0.235 . . . . 20.300000000000001 110.879 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.498 ' HB ' ' HB ' ' A' ' 136' ' ' ILE . 56.1 mt -114.33 128.74 71.22 Favored 'Isoleucine or valine' 0 C--O 1.232 0.144 0 CA-C-O 120.94 0.4 . . . . 19.370000000000001 111.061 179.638 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 49.5 m -114.84 156.65 44.74 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 115.818 -0.628 . . . . 22.489999999999998 110.506 -179.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_exo -44.29 -35.11 7.84 Favored 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 122.174 1.916 . . . . 23.0 112.012 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.479 ' O ' ' HG3' ' A' ' 106' ' ' ARG . . . -65.35 -49.59 68.78 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.099 -0.501 . . . . 24.559999999999999 110.509 179.377 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . 0.477 ' HB3' ' HG2' ' A' ' 94' ' ' ARG . 45.5 mt-10 -69.71 -20.37 63.54 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.862 -0.608 . . . . 22.23 110.641 179.506 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.635 HD23 ' HB ' ' A' ' 121' ' ' ILE . 42.1 tp -80.29 -39.55 28.59 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.061 -0.518 . . . . 20.359999999999999 111.51 -179.346 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.479 ' HG3' ' O ' ' A' ' 103' ' ' ALA . 3.3 ppt_? -72.03 -32.16 66.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.186 0.517 . . . . 27.190000000000001 110.39 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 81.0 t80 -73.49 -43.33 60.38 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.581 -0.736 . . . . 25.359999999999999 111.482 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.52 HG13 ' N ' ' A' ' 109' ' ' MET . 7.5 p -66.86 -48.17 80.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 N-CA-C 111.879 0.325 . . . . 21.059999999999999 111.879 -179.184 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.52 ' N ' HG13 ' A' ' 108' ' ' VAL . 22.7 mmt -50.84 -41.89 58.1 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 111.625 0.232 . . . . 20.93 111.625 -179.174 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 79.7 mt -61.78 -30.44 48.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 120.951 0.405 . . . . 25.129999999999999 110.528 179.401 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -70.77 -35.85 72.79 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.007 -0.542 . . . . 23.32 110.427 179.619 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 9.0 mp -72.84 -42.14 64.08 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.946 -0.57 . . . . 21.07 110.634 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 115.53 41.11 0.82 Allowed Glycine 0 N--CA 1.452 -0.272 0 CA-C-N 115.875 -0.602 . . . . 23.050000000000001 112.392 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -110.03 -31.75 7.26 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 111.577 0.214 . . . . 22.59 111.577 -179.558 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 36.6 mtmm 52.7 90.0 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.966 0.413 . . . . 27.960000000000001 110.606 -179.596 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 2.4 m -123.38 155.78 29.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.906 -0.588 . . . . 24.75 112.12 -178.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . 0.408 ' O ' HG12 ' A' ' 121' ' ' ILE . 70.5 p -92.23 145.06 24.79 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.57 -0.741 . . . . 27.239999999999998 110.216 179.187 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . 0.479 ' HA ' HD11 ' A' ' 121' ' ' ILE . 8.8 m-20 -51.62 -18.38 1.14 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.041 -0.527 . . . . 26.629999999999999 111.98 -179.361 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -77.51 -55.62 5.22 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.078 0.399 . . . . 29.140000000000001 112.078 -179.008 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -61.87 -40.57 95.83 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 111.967 0.358 . . . . 24.190000000000001 111.967 -179.044 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.635 ' HB ' HD23 ' A' ' 105' ' ' LEU . 5.1 pt -69.63 -40.15 79.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 C-N-CA 120.897 -0.321 . . . . 22.329999999999998 111.522 -179.568 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . 0.429 ' N ' HG13 ' A' ' 121' ' ' ILE . 15.4 t70 -56.49 -41.52 76.78 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.858 0.361 . . . . 24.289999999999999 110.42 179.552 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -62.83 -45.37 92.91 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.059 -0.519 . . . . 24.739999999999998 110.475 179.52 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 59.9 ttp -56.98 -38.2 72.69 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.034 -0.53 . . . . 19.710000000000001 110.868 179.49 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.615 HG23 HD11 ' A' ' 136' ' ' ILE . 58.6 mt -64.43 -38.39 82.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.147 -0.479 . . . . 19.949999999999999 110.525 179.691 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . 0.407 ' HD2' HH11 ' A' ' 126' ' ' ARG . 6.7 ttp85 -62.21 -42.7 99.53 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.957 -0.565 . . . . 24.949999999999999 110.632 179.74 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -65.6 -26.46 67.85 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.876 -0.602 . . . . 18.690000000000001 110.962 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.623 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -95.65 -13.07 24.6 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.104 -0.498 . . . . 16.469999999999999 111.21 179.912 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -100.16 105.79 17.43 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.094 -0.503 . . . . 20.399999999999999 110.837 -179.77 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 91.2 m-85 -97.4 -30.91 12.65 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.878 -0.601 . . . . 21.43 111.387 -179.498 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -69.72 -15.04 63.08 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.301 -0.409 . . . . 23.370000000000001 110.715 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 60.5 87.4 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.977 -0.63 . . . . 24.32 113.059 179.581 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -155.7 -23.84 0.11 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.755 0.312 . . . . 23.879999999999999 111.099 179.511 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 93.87 23.51 22.85 Favored Glycine 0 C--N 1.331 0.293 0 C-N-CA 120.817 -0.706 . . . . 22.670000000000002 112.617 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 82.1 mmm -135.8 155.22 50.68 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 110.423 -0.214 . . . . 22.91 110.423 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.652 HG23 ' HB2' ' A' ' 140' ' ' GLU . 46.9 mm -114.57 139.53 40.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 121.306 0.574 . . . . 18.41 111.599 179.759 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . 0.451 ' O ' ' N ' ' A' ' 139' ' ' GLU . 16.2 m-20 -115.09 157.4 23.61 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.095 -0.957 . . . . 16.82 108.887 178.662 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.43 ' OH ' ' HB3' ' A' ' 82' ' ' GLU . 19.5 t80 -41.13 -22.86 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 120.893 0.378 . . . . 14.65 111.024 179.483 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . 0.451 ' N ' ' O ' ' A' ' 137' ' ' ASN . 9.6 mm-40 -81.16 -55.25 4.87 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.24 -0.436 . . . . 14.82 111.019 -179.662 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.652 ' HB2' HG23 ' A' ' 136' ' ' ILE . 31.9 mt-10 -60.11 -34.1 73.04 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.195 -0.457 . . . . 17.460000000000001 110.74 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.482 ' CZ ' HG21 ' A' ' 145' ' ' ILE . 82.2 t80 -68.29 -55.28 12.68 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.034 -0.53 . . . . 12.93 110.326 179.503 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 2.3 t -47.04 -39.67 4.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.485 -0.78 . . . . 10.699999999999999 111.684 179.427 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 143' ' ' TRP . . . . . 0.466 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 84.8 t90 -71.06 -55.43 8.26 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.182 0.438 . . . . 13.66 112.182 -178.856 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . 0.623 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 17.3 ptt? -61.3 -23.79 65.95 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 113.156 0.799 . . . . 14.5 113.156 -177.801 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 145' ' ' ILE . . . . . 0.646 HD11 ' HB3' ' A' ' 85' ' ' MET . 48.5 pt -80.7 -46.15 21.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 N-CA-C 112.488 0.551 . . . . 11.25 112.488 -179.287 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 146' ' ' SER . . . . . 0.573 ' N ' HG13 ' A' ' 145' ' ' ILE . 12.6 p -63.29 -13.94 44.09 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-O 121.201 0.524 . . . . 8.5399999999999991 110.469 -179.839 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 147' ' ' GLN . . . . . 0.466 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 17.0 mm-40 -117.57 13.77 14.39 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.35 -0.841 . . . . 11.869999999999999 111.326 -178.563 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . 0.544 ' HG3' ' O ' ' A' ' 144' ' ' MET . 35.5 mttm . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.19 -0.91 . . . . 13.68 110.84 179.548 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.461 HD13 ' SG ' ' A' ' 69' ' ' CYS . 49.3 mt . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.955 0.407 . . . . 1.27 110.71 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.428 HG22 ' H ' ' A' ' 6' ' ' GLU . 0.2 OUTLIER -73.41 169.32 17.41 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.875 -0.602 . . . . 1.1200000000000001 111.073 -179.833 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.428 ' H ' HG22 ' A' ' 5' ' ' THR . 32.9 tt0 -52.05 -46.64 65.18 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.407 -0.36 . . . . 2.2000000000000002 111.501 179.668 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -70.82 -46.13 63.33 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.216 -0.447 . . . . 1.3500000000000001 111.08 -179.27 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -58.16 -42.99 87.14 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.975 -0.557 . . . . 2.2200000000000002 110.872 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.506 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 72.5 mt -59.47 -51.04 77.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.302 -0.408 . . . . 0.54000000000000004 110.376 179.596 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.08 -22.54 66.97 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.024 -0.535 . . . . 0.5 111.315 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -70.05 -56.87 5.81 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 116.34 -0.391 . . . . 2.27 111.835 -179.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.518 ' HB2' ' HE2' ' A' ' 68' ' ' PHE . 13.3 p90 -78.91 -24.85 43.85 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.733 -0.387 . . . . 0.37 110.692 -179.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.41 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 24.0 tptp -64.01 -35.58 81.17 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 108.923 -0.769 . . . . 1.23 108.923 178.382 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.443 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 20.4 t70 -70.14 -49.78 47.18 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 115.621 -0.718 . . . . 0.44 109.302 178.37 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.43 -14.62 42.81 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.769 -0.65 . . . . 0.28999999999999998 110.506 178.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.41 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 36.3 t80 -79.93 -50.58 10.24 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.742 -0.663 . . . . 0.47999999999999998 110.686 -179.708 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 31.2 m -65.93 -19.31 25.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 121.01 0.433 . . . . 1.1100000000000001 110.336 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.443 ' HG2' ' O ' ' A' ' 14' ' ' ASP . 75.3 mm-40 -58.64 -37.18 75.39 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.656 -0.702 . . . . 1.6000000000000001 111.331 179.294 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 62.0 m-85 -91.26 9.87 29.57 Favored 'General case' 0 N--CA 1.464 0.248 0 N-CA-C 111.767 0.284 . . . . 0.64000000000000001 111.767 -179.684 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -106.85 83.94 1.92 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.886 0.374 . . . . 0.44 110.808 179.602 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 29.9 mmmt -92.77 -10.61 36.34 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.061 -0.518 . . . . 2.1000000000000001 111.242 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -84.95 -14.32 47.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.147 -0.479 . . . . 1.8 111.281 -179.488 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.14 6.73 88.79 Favored Glycine 0 N--CA 1.453 -0.21 0 C-N-CA 120.688 -0.768 . . . . 0.46000000000000002 112.605 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 40.2 p -82.4 8.09 12.39 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.688 0.28 . . . . 0.40000000000000002 111.071 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 56.94 18.01 24.49 Favored Glycine 0 C--N 1.332 0.34 0 C-N-CA 120.824 -0.703 . . . . 0.33000000000000002 112.165 -179.683 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.475 ' C ' HE22 ' A' ' 62' ' ' GLN . 32.6 mtpt -129.31 155.69 45.21 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.773 0.32 . . . . 1.1000000000000001 111.161 -179.406 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.46 ' N ' HE22 ' A' ' 62' ' ' GLN . 39.8 pt -118.19 133.02 66.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 120.895 0.379 . . . . 0.5 111.455 -179.791 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -52.52 138.77 27.03 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.079 -0.509 . . . . 0.29999999999999999 111.247 -179.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.555 ' HA ' HD11 ' A' ' 63' ' ' LEU . 8.9 t -71.27 -2.51 16.41 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.194 -0.457 . . . . 1.03 111.323 -179.771 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.436 ' HD2' ' N ' ' A' ' 30' ' ' ARG . 0.9 OUTLIER -98.48 2.49 47.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.029 0.443 . . . . 3.0800000000000001 110.25 179.592 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -124.43 -5.41 7.7 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.782 -0.645 . . . . 2.2599999999999998 110.886 -179.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.468 ' O ' ' HG2' ' A' ' 36' ' ' MET . 2.1 tm? -55.57 -51.28 67.64 Favored 'General case' 0 C--O 1.233 0.198 0 N-CA-C 109.954 -0.387 . . . . 1.3700000000000001 109.954 179.694 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.42 ' HA2' HD11 ' A' ' 48' ' ' LEU . . . -53.71 -37.31 56.72 Favored Glycine 0 C--N 1.333 0.366 0 C-N-CA 120.629 -0.796 . . . . 0.32000000000000001 111.4 179.122 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 59.7 m -67.49 -31.48 71.65 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.279 0.561 . . . . 0.31 110.112 178.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 56.3 tp -72.83 -19.72 61.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.544 -0.753 . . . . 1.24 110.369 179.554 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.468 ' HG2' ' O ' ' A' ' 32' ' ' LEU . 75.8 mmm -80.02 -47.11 15.43 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.062 -0.517 . . . . 1.1000000000000001 110.786 179.593 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 13.4 ptm180 -61.85 -39.87 93.38 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.365 -0.38 . . . . 2.6899999999999999 111.399 -179.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.491 HG23 HD12 ' A' ' 39' ' ' LEU . 5.3 t -62.84 -14.42 45.64 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 121.179 0.514 . . . . 1.0600000000000001 110.413 179.491 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.491 HD12 HG23 ' A' ' 38' ' ' THR . 6.8 mp -114.46 157.21 23.23 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.464 -0.789 . . . . 1.26 109.31 178.385 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -74.02 34.54 0.91 Allowed Glycine 0 CA--C 1.521 0.43 0 C-N-CA 120.612 -0.804 . . . . 0.68999999999999995 113.298 -179.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.471 ' OE1' ' HB3' ' A' ' 39' ' ' LEU . 3.5 mm100 -91.65 -68.12 0.81 Allowed 'General case' 0 C--O 1.232 0.14 0 CA-C-O 120.829 0.347 . . . . 1.97 110.547 179.517 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 31.0 m-80 54.42 78.32 0.39 Allowed Pre-proline 0 CA--C 1.53 0.183 0 CA-C-N 115.961 -0.563 . . . . 2.6600000000000001 111.16 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.429 ' HD3' ' HB3' ' A' ' 36' ' ' MET . 74.4 Cg_endo -75.04 175.51 11.15 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.456 2.104 . . . . 0.51000000000000001 112.319 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 34.4 m -74.16 149.01 41.19 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.173 -0.467 . . . . 0.72999999999999998 110.734 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.479 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 38.1 mt-10 -53.6 -55.84 22.31 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.546 -0.297 . . . . 2.7000000000000002 111.484 -179.664 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.85 -47.08 71.32 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.339 -0.391 . . . . 0.46000000000000002 111.698 -179.405 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -57.9 -49.95 74.99 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.926 0.393 . . . . 2.23 110.582 -179.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.42 HD11 ' HA2' ' A' ' 33' ' ' GLY . 21.4 tp -57.48 -37.13 72.42 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.832 -0.622 . . . . 1.3600000000000001 111.068 -179.772 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.479 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 78.4 mm-40 -75.2 -28.01 59.82 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.42 -0.355 . . . . 1.22 111.264 -179.818 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 45.7 m-20 -75.35 -46.05 35.6 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.402 -0.363 . . . . 0.62 111.681 -179.588 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.414 HD21 ' HA ' ' A' ' 48' ' ' LEU . 1.9 pp -71.92 -40.12 69.01 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.552 -0.295 . . . . 0.39000000000000001 111.66 -179.314 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 71.8 mt -64.97 -45.02 95.94 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-O 120.746 0.308 . . . . 0.5 110.736 179.795 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -69.08 -35.12 76.15 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.308 -0.405 . . . . 0.58999999999999997 110.667 179.767 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -64.93 -46.63 80.83 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.18 -0.464 . . . . 2.54 109.87 179.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -70.92 -21.5 62.35 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.844 -0.616 . . . . 0.53000000000000003 110.909 179.295 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -65.65 -54.39 28.17 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.344 -0.389 . . . . 1.95 110.865 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 87.1 m-20 -93.81 52.76 1.71 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.279 -0.419 . . . . 2.48 110.932 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.431 HD22 ' C ' ' A' ' 58' ' ' ASN . 0.2 OUTLIER -162.33 -63.24 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.188 -0.46 . . . . 2.48 110.628 179.987 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 29.4 m-80 -93.0 27.1 2.54 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.204 -0.453 . . . . 2.0499999999999998 110.869 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 10.9 m120 65.21 -78.98 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 115.998 -0.546 . . . . 1.47 111.172 179.876 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -163.79 22.06 0.16 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.901 -0.666 . . . . 0.42999999999999999 112.297 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.475 HE22 ' C ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -131.92 153.1 50.61 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.976 0.417 . . . . 0.38 111.38 -179.782 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.555 HD11 ' HA ' ' A' ' 29' ' ' THR . 33.6 mt -120.63 151.9 38.86 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.768 -0.651 . . . . 1.4299999999999999 110.276 179.818 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 19.9 m-80 -113.18 157.69 21.37 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.765 0.317 . . . . 1.1899999999999999 110.879 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -42.61 -39.75 2.46 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.751 -0.659 . . . . 0.40000000000000002 111.415 -179.499 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -68.98 -35.63 76.94 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.105 0.409 . . . . 0.81000000000000005 112.105 -179.575 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -61.1 -52.87 63.08 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.01 0.433 . . . . 1.3600000000000001 110.457 179.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.518 ' HE2' ' HB2' ' A' ' 12' ' ' PHE . 36.6 t80 -65.63 -46.24 80.01 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.698 -0.683 . . . . 0.51000000000000001 111.02 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.461 ' SG ' HD13 ' A' ' 4' ' ' LEU . 2.7 t -58.38 -46.99 85.28 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.233 -0.44 . . . . 0.75 110.723 -179.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -53.32 -50.27 53.12 Favored Glycine 0 N--CA 1.451 -0.347 0 CA-C-N 115.837 -0.619 . . . . 0.40999999999999998 112.136 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.604 HG23 ' HE2' ' A' ' 74' ' ' LYS . 12.6 mt -62.57 -38.04 80.46 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.386 0 CA-C-O 120.924 0.392 . . . . 0.51000000000000001 110.787 179.695 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -58.6 -28.57 65.71 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.899 -0.591 . . . . 1.01 110.26 179.421 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -73.09 -49.45 28.4 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.06 -0.518 . . . . 0.69999999999999996 110.778 179.632 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.604 ' HE2' HG23 ' A' ' 71' ' ' ILE . 61.9 pttt -69.56 -26.7 64.62 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.245 -0.434 . . . . 1.3799999999999999 110.838 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 58.2 tt0 -78.69 -50.06 12.07 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.074 -0.512 . . . . 1.98 110.99 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 34.8 mtt . . . . . 0 N--CA 1.447 -0.612 0 CA-C-N 116.175 -0.466 . . . . 1.2 110.908 179.779 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.505 ' O ' ' HG2' ' A' ' 85' ' ' MET . 6.1 t . . . . . 0 N--CA 1.47 0.532 0 CA-C-O 121.079 0.466 . . . . 7.29 111.388 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.44 ' HA ' ' HG2' ' A' ' 85' ' ' MET . 13.1 pt-20 -46.08 -32.38 2.84 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 113.064 0.764 . . . . 9.7400000000000002 113.064 -178.479 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -53.74 -56.06 20.77 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.002 0.43 . . . . 12.109999999999999 111.733 -179.152 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -65.99 -17.51 64.72 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.227 -0.442 . . . . 10.869999999999999 110.85 -179.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' MET . . . . . 0.603 ' CB ' HG22 ' A' ' 142' ' ' VAL . 0.8 OUTLIER -83.0 -25.02 32.63 Favored 'General case' 0 CA--C 1.509 -0.63 0 CA-C-O 121.912 0.863 . . . . 11.09 109.081 -179.089 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 31.1 tpt180 -71.04 -45.23 64.22 Favored 'General case' 0 N--CA 1.442 -0.835 0 CA-C-N 113.902 -1.499 . . . . 15.52 110.151 179.693 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -69.26 -37.26 77.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.844 -0.616 . . . . 14.85 110.06 178.839 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -69.69 -39.58 76.86 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.008 -0.542 . . . . 14.109999999999999 111.046 179.635 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -64.25 -34.84 79.04 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.995 0.426 . . . . 15.73 110.276 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 59.8 mttt -62.45 -55.23 29.65 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.726 -0.67 . . . . 17.66 110.882 179.493 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 55.1 mt -64.15 -29.68 48.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.655 -0.702 . . . . 18.149999999999999 111.652 -179.409 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -79.6 -29.97 41.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.584 -0.28 . . . . 18.34 111.657 -179.403 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 24.1 t0 -83.84 101.83 11.91 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.009 0.433 . . . . 19.289999999999999 110.617 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.86 -14.17 58.65 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.874 -0.603 . . . . 22.25 111.719 -179.567 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.467 ' HB2' ' OD1' ' A' ' 97' ' ' ASP . 4.7 m-20 -125.66 160.07 30.62 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.932 0.396 . . . . 23.34 111.148 -179.876 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -87.68 5.34 85.11 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.899 -0.667 . . . . 22.0 112.051 179.64 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.467 ' OD1' ' HB2' ' A' ' 95' ' ' ASP . 10.4 p-10 -61.54 -33.12 73.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.784 0.326 . . . . 22.280000000000001 110.962 -179.844 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 99.84 17.85 24.43 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.758 -0.734 . . . . 19.93 112.845 179.691 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . 0.421 ' HB2' ' OD2' ' A' ' 97' ' ' ASP . 98.0 m-85 -141.09 147.1 38.01 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.815 0.34 . . . . 20.300000000000001 111.313 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 71.3 mt -114.96 136.2 52.41 Favored 'Isoleucine or valine' 0 C--O 1.232 0.157 0 CA-C-N 116.141 -0.482 . . . . 19.370000000000001 110.828 179.368 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 70.8 m -114.64 156.13 45.18 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 116.076 -0.511 . . . . 22.489999999999998 110.647 -179.819 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -40.1 -36.14 1.39 Allowed 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 122.458 2.105 . . . . 23.0 112.524 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.83 -51.66 60.89 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.105 -0.498 . . . . 24.559999999999999 110.839 179.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . 0.402 ' O ' HG23 ' A' ' 108' ' ' VAL . 45.8 mt-10 -63.42 -45.03 92.87 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.808 -0.633 . . . . 22.23 110.739 179.768 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.769 HD23 ' HB ' ' A' ' 121' ' ' ILE . 21.7 tp -52.27 -42.71 63.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.862 -0.608 . . . . 20.359999999999999 110.999 -179.665 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.547 HH21 ' HA ' ' A' ' 117' ' ' THR . 4.4 ttm180 -72.13 -45.24 61.33 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.896 -0.593 . . . . 27.190000000000001 111.14 -179.907 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -53.14 -34.2 55.76 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.272 -0.422 . . . . 25.359999999999999 111.42 -179.468 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.466 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 43.3 t -80.17 -51.15 16.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.636 -0.256 . . . . 21.059999999999999 111.292 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 18.1 mmt -49.61 -46.18 49.01 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.372 -0.376 . . . . 20.93 111.406 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 68.4 mt -62.31 -30.16 48.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.92 0.39 . . . . 25.129999999999999 110.589 179.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 -74.94 -28.02 60.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.029 -0.532 . . . . 23.32 110.913 179.494 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 27.8 mt -77.16 -41.79 40.31 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.108 -0.496 . . . . 21.07 110.732 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 131.18 -5.2 5.65 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.996 -0.621 . . . . 23.050000000000001 111.965 -179.611 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -91.13 97.69 11.3 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.696 0.284 . . . . 22.59 110.875 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -68.71 102.1 1.45 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.291 -0.413 . . . . 27.960000000000001 110.82 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . 0.442 ' HB ' HG23 ' A' ' 121' ' ' ILE . 2.3 m -115.86 154.74 17.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.212 -0.449 . . . . 24.75 111.428 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . 0.547 ' HA ' HH21 ' A' ' 106' ' ' ARG . 81.5 p -98.88 145.77 26.65 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.854 -0.612 . . . . 27.239999999999998 110.53 179.487 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -51.88 -20.84 2.49 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.227 -0.442 . . . . 26.629999999999999 111.612 -179.549 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -78.26 -53.2 7.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.427 -0.351 . . . . 29.140000000000001 111.676 -179.527 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -63.83 -37.91 89.13 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.04 0.385 . . . . 24.190000000000001 112.04 -179.115 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.769 ' HB ' HD23 ' A' ' 105' ' ' LEU . 38.7 pt -72.83 -42.19 61.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 C-N-CA 120.83 -0.348 . . . . 22.329999999999998 111.702 -179.518 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . 0.478 ' N ' HG13 ' A' ' 121' ' ' ILE . 18.1 t70 -58.74 -44.77 90.59 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.842 0.353 . . . . 24.289999999999999 110.671 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -60.08 -44.99 94.38 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.082 -0.508 . . . . 24.739999999999998 110.457 179.475 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 43.2 ttp -57.46 -33.66 68.19 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.905 -0.588 . . . . 19.710000000000001 110.63 179.386 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 66.5 mt -65.82 -43.96 93.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.048 -0.524 . . . . 19.949999999999999 110.554 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 33.8 ttm180 -58.23 -40.66 82.28 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.924 -0.58 . . . . 24.949999999999999 111.048 179.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -56.45 -43.65 79.7 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.254 -0.43 . . . . 18.690000000000001 111.08 -179.892 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.628 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -87.39 -14.25 41.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.148 -0.478 . . . . 16.469999999999999 111.28 -179.776 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . 0.432 ' HA ' ' OE1' ' A' ' 140' ' ' GLU . 27.5 t70 -93.61 99.23 11.71 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.015 0.436 . . . . 20.399999999999999 110.728 -179.739 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -89.74 -37.1 14.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.8 -0.636 . . . . 21.43 111.278 -179.679 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -63.7 -18.04 63.59 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.324 -0.398 . . . . 23.370000000000001 110.583 -179.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 60.74 83.45 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.977 -0.63 . . . . 24.32 112.831 179.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . 0.424 ' OD2' ' HB2' ' A' ' 135' ' ' MET . 12.6 p-10 -146.44 -5.62 0.56 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.791 0.329 . . . . 23.879999999999999 111.086 179.586 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 77.09 11.71 85.31 Favored Glycine 0 C--N 1.331 0.254 0 C-N-CA 120.866 -0.683 . . . . 22.670000000000002 112.699 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' MET . . . . . 0.424 ' HB2' ' OD2' ' A' ' 133' ' ' ASP . 88.9 mtp -133.38 154.27 50.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.646 0.26 . . . . 22.91 110.389 179.653 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.662 HG23 ' HB2' ' A' ' 140' ' ' GLU . 40.4 mm -115.3 144.89 21.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 121.254 0.55 . . . . 18.41 112.155 -179.246 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . 0.429 ' O ' ' N ' ' A' ' 139' ' ' GLU . 30.0 p-10 -114.81 157.86 22.68 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.304 -0.862 . . . . 16.82 108.779 178.058 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.645 ' O ' HG23 ' A' ' 142' ' ' VAL . 27.8 t80 -39.27 -25.19 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 112.377 0.51 . . . . 14.65 112.377 -179.152 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . 0.429 ' N ' ' O ' ' A' ' 137' ' ' ASN . 44.9 mt-10 -80.05 -55.92 4.61 Favored 'General case' 0 C--O 1.234 0.275 0 O-C-N 122.226 -0.296 . . . . 14.82 111.401 -179.563 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.662 ' HB2' HG23 ' A' ' 136' ' ' ILE . 30.7 mt-10 -60.82 -27.33 67.97 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.986 0.422 . . . . 17.460000000000001 110.36 179.895 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.619 ' HA ' ' HE2' ' A' ' 144' ' ' MET . 91.6 t80 -69.33 -56.01 8.77 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.905 -0.588 . . . . 12.93 109.787 179.333 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.645 HG23 ' O ' ' A' ' 138' ' ' TYR . 38.9 t -45.41 -40.84 2.84 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 CA-C-N 115.55 -0.75 . . . . 10.699999999999999 111.643 178.917 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 143' ' ' TRP . . . . . 0.41 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 75.5 t90 -67.68 -55.61 12.58 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.744 0.646 . . . . 13.66 112.744 -178.845 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . 0.628 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 19.9 ptt? -67.07 -20.25 65.79 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 113.257 0.836 . . . . 14.5 113.257 -177.433 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 145' ' ' ILE . . . . . 0.574 HG23 ' O ' ' A' ' 141' ' ' PHE . 43.4 pt -80.52 -46.09 21.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 N-CA-C 112.236 0.458 . . . . 11.25 112.236 -179.121 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 146' ' ' SER . . . . . 0.551 ' N ' HG13 ' A' ' 145' ' ' ILE . 28.8 t -63.58 -13.93 46.55 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.193 0.521 . . . . 8.5399999999999991 110.356 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 147' ' ' GLN . . . . . 0.41 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 16.6 mm-40 -118.35 45.33 2.04 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.385 -0.825 . . . . 11.869999999999999 111.651 -178.245 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . 0.442 ' HE3' ' O ' ' A' ' 145' ' ' ILE . 10.4 mtmp? . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.242 -0.885 . . . . 13.68 110.919 179.51 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.9 mt . . . . . 0 CA--C 1.529 0.143 0 CA-C-O 120.618 0.247 . . . . 1.27 111.007 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 72.3 p -76.68 -177.45 4.27 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.456 -0.338 . . . . 1.1200000000000001 111.294 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -60.25 -51.26 70.32 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.376 -0.375 . . . . 2.2000000000000002 111.562 -179.512 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -67.74 -45.63 74.44 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.983 0.42 . . . . 1.3500000000000001 111.018 -179.572 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -59.23 -42.41 90.95 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.812 -0.631 . . . . 2.2200000000000002 111.245 -179.717 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.532 ' HA ' ' CZ ' ' A' ' 12' ' ' PHE . 55.0 mt -60.62 -49.79 83.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.884 0.373 . . . . 0.54000000000000004 110.652 179.744 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.2 -19.07 64.73 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.995 -0.548 . . . . 0.5 111.099 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -73.94 -55.83 5.69 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.259 -0.428 . . . . 2.27 111.767 -179.238 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.532 ' CZ ' ' HA ' ' A' ' 9' ' ' ILE . 4.2 p90 -77.53 -24.51 49.95 Favored 'General case' 0 C--N 1.332 -0.196 0 C-N-CA 120.673 -0.411 . . . . 0.37 111.012 -179.582 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 23.9 tptp -66.92 -41.44 87.05 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 109.397 -0.594 . . . . 1.23 109.397 178.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -65.26 -47.67 75.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.898 -0.592 . . . . 0.44 109.477 178.498 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.87 -30.65 70.27 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 115.643 -0.708 . . . . 0.28999999999999998 110.415 179.127 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 24.9 t80 -66.95 -38.89 86.96 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.572 -0.74 . . . . 0.47999999999999998 110.623 179.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -70.88 -28.39 33.5 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.774 0 CA-C-N 115.966 -0.561 . . . . 1.1100000000000001 111.153 -179.724 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -60.54 -27.86 67.98 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.791 -0.641 . . . . 1.6000000000000001 111.486 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 54.9 m-85 -94.01 -12.63 28.22 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.63 -0.259 . . . . 0.64000000000000001 111.672 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -84.93 91.25 8.0 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.894 0.378 . . . . 0.44 110.732 179.621 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 71.8 mmtt -100.03 -26.03 14.11 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.965 -0.561 . . . . 2.1000000000000001 111.243 -179.659 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -70.96 -20.14 62.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.168 -0.469 . . . . 1.8 111.281 -179.549 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 86.45 0.2 86.64 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.786 -0.721 . . . . 0.46000000000000002 112.707 179.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 22.7 p -79.39 10.74 3.48 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.738 0.304 . . . . 0.40000000000000002 111.212 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 55.54 30.01 54.97 Favored Glycine 0 C--N 1.331 0.293 0 C-N-CA 120.82 -0.705 . . . . 0.33000000000000002 112.066 -179.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.482 ' C ' HE22 ' A' ' 62' ' ' GLN . 33.0 mtmm -138.33 155.85 48.18 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.744 0.307 . . . . 1.1000000000000001 111.238 -179.466 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.558 HG13 ' HB2' ' A' ' 63' ' ' LEU . 33.8 pt -116.12 126.41 73.61 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 116.358 -0.383 . . . . 0.5 111.199 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -50.74 142.02 11.99 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.181 -0.463 . . . . 0.29999999999999999 111.501 -179.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.503 ' HA ' HD11 ' A' ' 63' ' ' LEU . 9.8 t -67.44 -16.09 64.03 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.886 -0.597 . . . . 1.03 111.745 -179.542 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -89.46 5.08 46.95 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.473 -0.33 . . . . 3.0800000000000001 110.679 179.728 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -123.18 -4.26 8.45 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.091 -0.504 . . . . 2.2599999999999998 110.942 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.508 HD21 ' CD1' ' A' ' 68' ' ' PHE . 1.6 tm? -58.81 -48.6 80.75 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.35 -0.386 . . . . 1.3700000000000001 110.373 179.617 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -55.64 -35.77 63.18 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.533 -0.841 . . . . 0.32000000000000001 111.306 179.341 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 88.5 m -69.74 -39.92 76.5 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.062 0.458 . . . . 0.31 110.21 179.272 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 56.1 tp -65.15 -24.07 67.3 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.731 -0.668 . . . . 1.24 110.322 179.439 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.496 ' HG3' ' HG3' ' A' ' 43' ' ' PRO . 21.5 mmt -75.46 -43.32 50.15 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.94 -0.573 . . . . 1.1000000000000001 110.13 179.139 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -55.87 -50.14 71.43 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.645 -0.707 . . . . 2.6899999999999999 111.102 179.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.442 HG23 ' HG ' ' A' ' 39' ' ' LEU . 10.1 t -61.68 -13.49 23.17 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.294 -0.412 . . . . 1.0600000000000001 111.135 179.84 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.442 ' HG ' HG23 ' A' ' 38' ' ' THR . 75.0 mt -113.57 157.16 22.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.096 -0.502 . . . . 1.26 110.613 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -75.85 40.36 1.4 Allowed Glycine 0 CA--C 1.521 0.426 0 C-N-CA 120.883 -0.675 . . . . 0.68999999999999995 114.027 -178.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 9.9 mp0 -97.15 -66.72 0.88 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 117.103 0.451 . . . . 1.97 111.109 179.029 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 59.0 m-20 60.82 67.21 1.55 Allowed Pre-proline 0 CA--C 1.53 0.199 0 CA-C-N 116.149 -0.478 . . . . 2.6600000000000001 111.098 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.496 ' HG3' ' HG3' ' A' ' 36' ' ' MET . 60.1 Cg_endo -71.47 160.39 48.65 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.72 2.28 . . . . 0.51000000000000001 112.124 179.655 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 33.4 m -74.5 146.76 42.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.153 -0.476 . . . . 0.72999999999999998 110.604 179.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.435 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 41.9 tt0 -46.4 -50.34 16.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.61 -0.268 . . . . 2.7000000000000002 111.137 -179.522 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -51.32 -53.07 39.66 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.274 -0.421 . . . . 0.46000000000000002 111.315 -179.748 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.467 ' HG2' HD23 ' A' ' 51' ' ' LEU . 36.8 tt0 -52.08 -49.5 63.43 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.357 -0.383 . . . . 2.23 110.618 179.888 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 51.6 mt -57.87 -40.24 79.73 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.38 -0.373 . . . . 1.3600000000000001 110.584 179.572 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.435 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 31.7 mm-40 -65.66 -32.74 74.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.411 -0.359 . . . . 1.22 111.026 179.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -75.13 -54.64 6.79 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.222 -0.444 . . . . 0.62 112.103 -179.349 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.467 HD23 ' HG2' ' A' ' 47' ' ' GLU . 2.2 pp -66.33 -39.71 89.42 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 111.995 0.368 . . . . 0.39000000000000001 111.995 -178.871 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 86.1 mt -68.48 -43.31 83.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 C-N-CA 121.147 -0.221 . . . . 0.5 111.054 -179.647 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.86 -38.86 89.95 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.809 0.338 . . . . 0.58999999999999997 110.811 179.72 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -64.02 -43.54 95.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.13 -0.486 . . . . 2.54 110.309 179.607 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -77.19 -16.36 59.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.983 -0.553 . . . . 0.53000000000000003 110.996 179.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -65.74 -23.9 66.84 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.148 -0.478 . . . . 1.95 110.799 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -103.92 29.61 5.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.035 -0.53 . . . . 2.48 110.621 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -158.51 150.26 21.23 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.007 -0.542 . . . . 2.48 110.754 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 74.4 m-20 59.76 15.1 4.54 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.042 -0.526 . . . . 2.0499999999999998 111.021 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 18.3 m-80 60.71 12.9 3.96 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.905 -0.589 . . . . 1.47 111.917 179.29 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 113.62 30.47 2.6 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.636 -0.792 . . . . 0.42999999999999999 112.389 179.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.482 HE22 ' C ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -127.32 154.52 44.84 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.095 0.474 . . . . 0.38 111.3 -179.832 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.558 ' HB2' HG13 ' A' ' 27' ' ' ILE . 17.4 mt -121.08 152.42 38.68 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.608 -0.724 . . . . 1.4299999999999999 109.753 179.366 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . 0.438 ' H ' ' CG ' ' A' ' 67' ' ' GLU . 0.8 OUTLIER -113.07 156.76 22.55 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 110.19 -0.3 . . . . 1.1899999999999999 110.19 -179.483 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.537 ' O ' ' HB2' ' A' ' 69' ' ' CYS . 82.8 t80 -42.41 -41.56 2.93 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.483 -0.326 . . . . 0.40000000000000002 110.959 179.889 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 3.8 m -71.45 -33.85 69.73 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.352 -0.386 . . . . 0.81000000000000005 111.397 -179.766 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.438 ' CG ' ' H ' ' A' ' 64' ' ' ASN . 17.5 mm-40 -62.51 -51.28 68.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.871 0.367 . . . . 1.3600000000000001 110.287 179.393 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.508 ' CD1' HD21 ' A' ' 32' ' ' LEU . 32.8 t80 -67.65 -47.43 69.56 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.021 -0.536 . . . . 0.51000000000000001 110.649 179.534 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.537 ' HB2' ' O ' ' A' ' 65' ' ' PHE . 0.1 OUTLIER -57.27 -38.9 74.62 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-O 120.959 0.409 . . . . 0.75 110.059 179.599 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -57.51 -50.95 60.87 Favored Glycine 0 CA--C 1.507 -0.466 0 N-CA-C 111.119 -0.792 . . . . 0.40999999999999998 111.119 179.462 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.706 HG23 ' HE2' ' A' ' 74' ' ' LYS . 70.6 mt -59.5 -50.12 81.09 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.656 0 CA-C-O 121.032 0.444 . . . . 0.51000000000000001 110.365 178.466 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 15.2 mtp -49.68 -28.94 6.58 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.613 -0.721 . . . . 1.01 110.51 179.524 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -71.87 -45.28 61.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.328 -0.396 . . . . 0.69999999999999996 110.231 179.291 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.706 ' HE2' HG23 ' A' ' 71' ' ' ILE . 49.0 pttt -70.56 -28.87 65.23 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.125 -0.489 . . . . 1.3799999999999999 111.041 179.823 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . 0.494 HE22 ' HA ' ' A' ' 43' ' ' PRO . 4.8 tp-100 -80.58 -55.42 4.87 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.001 -0.545 . . . . 1.98 111.623 -179.784 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 68.3 mtp . . . . . 0 N--CA 1.449 -0.496 0 CA-C-N 116.169 -0.469 . . . . 1.2 111.793 -179.275 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.64 ' O ' ' HG2' ' A' ' 85' ' ' MET . 58.8 m . . . . . 0 CA--C 1.529 0.137 0 N-CA-C 109.925 -0.398 . . . . 7.29 109.925 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -58.12 -16.03 11.72 Favored 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 113.39 0.885 . . . . 9.7400000000000002 113.39 -178.169 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -64.26 -56.5 14.17 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.001 0.429 . . . . 12.109999999999999 111.683 -179.286 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -68.19 -14.08 62.71 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.045 -0.525 . . . . 10.869999999999999 110.919 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' MET . . . . . 0.64 ' HG2' ' O ' ' A' ' 81' ' ' THR . 4.5 mmm -80.35 -38.77 29.83 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.119 -0.491 . . . . 11.09 110.42 -179.441 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 10.4 ttm180 -67.73 -42.55 81.72 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.975 -0.557 . . . . 15.52 109.595 179.303 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.503 ' O ' HG12 ' A' ' 91' ' ' ILE . 36.9 tt0 -59.55 -48.77 80.34 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.879 -0.6 . . . . 14.85 109.811 179.011 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.56 -29.87 70.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.938 -0.574 . . . . 14.109999999999999 110.778 179.583 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 46.7 t80 -59.28 -52.04 67.37 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 109.846 -0.427 . . . . 15.73 109.846 179.492 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -59.06 -37.77 77.82 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.797 -0.638 . . . . 17.66 110.021 178.77 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.503 HG12 ' O ' ' A' ' 87' ' ' GLU . 40.0 mm -59.92 -40.98 84.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.431 -0.804 . . . . 18.149999999999999 110.83 179.469 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.528 ' O ' ' HD3' ' A' ' 94' ' ' ARG . 7.0 m-85 -74.06 -56.64 4.68 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.311 -0.404 . . . . 18.34 111.332 -179.636 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . 0.486 ' HA ' ' CZ ' ' A' ' 94' ' ' ARG . 43.2 t0 -49.96 124.97 10.97 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 120.947 0.403 . . . . 19.289999999999999 110.566 -179.739 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.67 ' CZ ' ' HB3' ' A' ' 104' ' ' GLU . 0.0 OUTLIER -76.78 -31.97 57.38 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.904 -0.589 . . . . 22.25 111.662 -178.694 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -113.76 177.97 4.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.978 0.418 . . . . 23.34 111.368 -179.036 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -88.38 3.9 85.32 Favored Glycine 0 N--CA 1.449 -0.472 0 N-CA-C 110.919 -0.872 . . . . 22.0 110.919 178.632 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 22.3 p-10 -56.02 -39.18 71.55 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.227 -0.487 . . . . 22.280000000000001 111.167 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 89.48 21.57 40.3 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.846 -0.693 . . . . 19.93 111.922 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . 0.501 ' HA ' ' O ' ' A' ' 136' ' ' ILE . 97.5 m-85 -136.93 143.83 43.12 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.858 0.361 . . . . 20.300000000000001 111.328 -179.709 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.538 ' HB ' ' HB ' ' A' ' 136' ' ' ILE . 59.6 mt -114.35 132.3 63.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-N 115.904 -0.589 . . . . 19.370000000000001 110.832 179.629 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 26.7 p -114.42 156.18 44.86 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.037 -0.529 . . . . 22.489999999999998 110.693 -179.705 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_exo -42.78 -48.71 7.18 Favored 'Trans proline' 0 C--N 1.348 0.538 0 C-N-CA 122.686 2.257 . . . . 23.0 112.965 -179.78 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.81 -51.29 68.86 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.093 0.473 . . . . 24.559999999999999 111.068 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . 0.67 ' HB3' ' CZ ' ' A' ' 94' ' ' ARG . 38.6 mt-10 -59.15 -41.34 88.1 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.716 -0.674 . . . . 22.23 111.04 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.708 HD23 ' HB ' ' A' ' 121' ' ' ILE . 47.7 tp -54.38 -46.72 73.13 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.67 -0.695 . . . . 20.359999999999999 111.037 -179.476 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 5.4 ttt180 -60.47 -48.16 82.98 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.104 -0.498 . . . . 27.190000000000001 110.854 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 72.5 t80 -52.19 -35.02 47.92 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.223 -0.444 . . . . 25.359999999999999 111.513 -179.457 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.631 HG21 HH11 ' A' ' 94' ' ' ARG . 30.2 t -77.18 -54.12 13.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 N-CA-C 111.748 0.277 . . . . 21.059999999999999 111.748 -179.611 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -49.54 -39.63 35.27 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.834 0.349 . . . . 20.93 110.955 -179.715 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 84.7 mt -66.84 -28.68 43.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.17 -0.468 . . . . 25.129999999999999 110.936 179.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 89.1 m-20 -72.84 -46.18 54.37 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.235 -0.439 . . . . 23.32 110.336 179.639 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 9.6 mp -60.32 -45.11 94.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.626 -0.715 . . . . 21.07 110.976 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 128.95 11.81 2.79 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.8 -0.714 . . . . 23.050000000000001 112.474 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -106.51 94.64 5.24 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.789 0.328 . . . . 22.59 111.07 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -60.99 126.2 26.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.159 -0.473 . . . . 27.960000000000001 110.704 179.588 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . 0.425 HG12 ' OE1' ' A' ' 120' ' ' GLU . 3.0 m -144.41 150.71 16.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.231 -0.44 . . . . 24.75 111.444 -179.792 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 68.3 p -94.5 149.36 21.32 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.826 -0.625 . . . . 27.239999999999998 110.218 179.231 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -54.78 -17.24 3.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.155 -0.475 . . . . 26.629999999999999 111.601 -179.597 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -77.8 -55.18 5.54 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.479 -0.328 . . . . 29.140000000000001 111.511 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . 0.425 ' OE1' HG12 ' A' ' 116' ' ' VAL . 14.6 pt-20 -63.36 -38.84 92.71 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 111.996 0.369 . . . . 24.190000000000001 111.996 -179.151 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.708 ' HB ' HD23 ' A' ' 105' ' ' LEU . 42.0 pt -71.68 -41.61 71.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 N-CA-C 111.787 0.292 . . . . 22.329999999999998 111.787 -179.408 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . 0.513 ' N ' HG13 ' A' ' 121' ' ' ILE . 19.7 t70 -59.89 -39.76 86.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.741 0.305 . . . . 24.289999999999999 110.702 179.873 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -65.06 -43.9 90.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.11 -0.496 . . . . 24.739999999999998 110.605 179.682 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 52.6 ttp -56.76 -37.78 71.54 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.114 -0.494 . . . . 19.710000000000001 110.585 179.459 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.61 HG23 HD11 ' A' ' 136' ' ' ILE . 72.3 mt -65.85 -43.23 93.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.99 -0.55 . . . . 19.949999999999999 110.448 179.595 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 75.0 ttt180 -60.82 -30.66 70.22 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.701 -0.682 . . . . 24.949999999999999 111.115 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -75.88 -27.62 57.81 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.132 -0.485 . . . . 18.690000000000001 111.362 -179.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.581 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -101.06 -8.73 22.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.355 -0.384 . . . . 16.469999999999999 111.181 -179.805 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 30.2 t0 -100.7 87.48 3.35 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.179 -0.464 . . . . 20.399999999999999 110.825 -179.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 71.7 m-85 -67.4 -49.81 62.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.895 -0.593 . . . . 21.43 111.147 -179.633 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -57.39 -29.12 63.81 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.239 -0.437 . . . . 23.370000000000001 110.776 179.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 67.17 63.62 3.7 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.973 -0.632 . . . . 24.32 112.909 179.419 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -122.95 7.26 9.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.851 0.358 . . . . 23.879999999999999 110.586 179.533 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 69.07 18.83 73.27 Favored Glycine 0 C--N 1.33 0.246 0 C-N-CA 120.99 -0.624 . . . . 22.670000000000002 112.629 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 85.6 mmm -134.57 153.66 51.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.701 0.286 . . . . 22.91 110.545 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.663 HG23 ' HB2' ' A' ' 140' ' ' GLU . 43.4 mm -114.79 141.81 29.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 121.091 0.472 . . . . 18.41 111.563 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . 0.477 ' ND2' ' H ' ' A' ' 138' ' ' TYR . 3.5 t-20 -114.89 156.42 25.02 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.258 -0.883 . . . . 16.82 108.801 178.345 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.694 ' O ' HG23 ' A' ' 142' ' ' VAL . 6.8 t80 -40.08 -24.8 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 120.706 0.288 . . . . 14.65 111.487 179.698 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . 0.435 ' N ' ' O ' ' A' ' 137' ' ' ASN . 14.3 mm-40 -80.28 -55.78 4.67 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.876 0.37 . . . . 14.82 111.01 -179.353 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.663 ' HB2' HG23 ' A' ' 136' ' ' ILE . 35.5 mt-10 -57.74 -31.17 66.19 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.005 -0.543 . . . . 17.460000000000001 110.401 179.742 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.554 ' CE2' HD13 ' A' ' 145' ' ' ILE . 90.0 t80 -69.58 -56.04 8.44 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.599 -0.728 . . . . 12.93 110.708 -179.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.694 HG23 ' O ' ' A' ' 138' ' ' TYR . 52.0 t -46.58 -38.22 3.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.002 -0.545 . . . . 10.699999999999999 111.958 179.626 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 143' ' ' TRP . . . . . 0.451 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 91.0 t90 -71.08 -55.87 7.32 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.469 0.544 . . . . 13.66 112.469 -178.809 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . 0.581 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 18.4 ptt? -62.47 -25.0 67.76 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 112.971 0.73 . . . . 14.5 112.971 -177.75 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 145' ' ' ILE . . . . . 0.587 HD11 ' HB3' ' A' ' 85' ' ' MET . 45.1 pt -80.93 -40.47 18.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 N-CA-C 112.168 0.433 . . . . 11.25 112.168 -179.83 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 146' ' ' SER . . . . . 0.538 ' N ' HG13 ' A' ' 145' ' ' ILE . 88.1 p -61.31 -14.82 29.72 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-O 121.494 0.664 . . . . 8.5399999999999991 109.557 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 147' ' ' GLN . . . . . 0.451 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 2.7 mm-40 -113.6 -11.51 12.99 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 114.899 -1.046 . . . . 11.869999999999999 109.897 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . 0.579 ' HB2' ' HA ' ' A' ' 145' ' ' ILE . 28.0 ttpp . . . . . 0 C--O 1.25 1.085 0 CA-C-O 118.247 -0.882 . . . . 13.68 110.92 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.598 HD13 ' SG ' ' A' ' 69' ' ' CYS . 33.2 mt . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.827 0.346 . . . . 1.27 110.614 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 56.5 p -70.99 -165.4 0.12 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.132 -0.486 . . . . 1.1200000000000001 111.194 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -75.48 -42.79 52.16 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.995 0.426 . . . . 2.2000000000000002 110.472 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -73.06 -35.13 66.63 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.834 -0.621 . . . . 1.3500000000000001 110.536 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -70.85 -47.21 60.59 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.922 -0.581 . . . . 2.2200000000000002 110.817 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.517 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 35.4 mt -58.46 -41.26 81.18 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 116.271 -0.422 . . . . 0.54000000000000004 110.912 179.828 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -76.06 -22.05 56.08 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.438 -0.347 . . . . 0.5 111.043 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -68.47 -57.1 6.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.199 -0.455 . . . . 2.27 111.736 -179.425 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.517 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 11.5 p90 -76.76 -25.29 53.27 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.678 -0.409 . . . . 0.37 110.489 -179.721 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.404 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 18.9 tptm -63.33 -34.01 76.77 Favored 'General case' 0 CA--C 1.519 -0.242 0 N-CA-C 108.87 -0.789 . . . . 1.23 108.87 178.227 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.608 ' O ' HG22 ' A' ' 17' ' ' VAL . 14.0 t70 -69.74 -53.02 20.39 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 109.013 -0.736 . . . . 0.44 109.013 178.418 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.05 -15.23 21.26 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.821 -0.627 . . . . 0.28999999999999998 110.508 178.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.404 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 66.1 t80 -80.69 -44.76 18.24 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.746 -0.661 . . . . 0.47999999999999998 111.001 -179.729 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.608 HG22 ' O ' ' A' ' 14' ' ' ASP . 25.7 m -69.33 -21.14 24.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.983 0.42 . . . . 1.1100000000000001 110.675 -179.664 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.55 ' HG3' ' O ' ' A' ' 14' ' ' ASP . 83.8 mt-30 -63.69 -25.29 68.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.83 -0.623 . . . . 1.6000000000000001 111.3 179.814 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -104.9 25.06 10.93 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.57 -0.286 . . . . 0.64000000000000001 111.617 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -116.74 80.64 1.5 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.059 0.457 . . . . 0.44 110.723 179.336 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt -93.83 5.14 52.63 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.85 -0.614 . . . . 2.1000000000000001 111.176 -179.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -103.89 -1.26 27.99 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.316 -0.402 . . . . 1.8 111.35 -179.371 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 63.48 10.39 36.03 Favored Glycine 0 CA--C 1.517 0.201 0 C-N-CA 120.921 -0.657 . . . . 0.46000000000000002 113.144 179.578 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 30.4 p -90.15 10.85 22.84 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.699 0.285 . . . . 0.40000000000000002 111.122 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 56.26 18.13 20.12 Favored Glycine 0 C--N 1.332 0.306 0 C-N-CA 120.766 -0.73 . . . . 0.33000000000000002 111.912 -179.653 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.531 ' C ' HE22 ' A' ' 62' ' ' GLN . 32.1 mtpt -129.58 155.95 44.97 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.594 -0.303 . . . . 1.1000000000000001 110.819 -179.339 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.492 ' N ' HE22 ' A' ' 62' ' ' GLN . 35.7 pt -120.87 129.96 75.13 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 120.934 0.397 . . . . 0.5 111.359 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -47.78 137.46 9.6 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.144 -0.48 . . . . 0.29999999999999999 111.336 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.494 HG23 ' HD2' ' A' ' 30' ' ' ARG . 5.5 t -67.31 -0.27 3.41 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.926 -0.579 . . . . 1.03 110.873 179.804 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.494 ' HD2' HG23 ' A' ' 29' ' ' THR . 3.6 mmm180 -94.28 -17.8 22.27 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.98 -0.554 . . . . 3.0800000000000001 110.28 179.839 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -102.07 -3.0 28.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.56 -0.745 . . . . 2.2599999999999998 110.503 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.445 HD12 HD11 ' A' ' 51' ' ' LEU . 3.2 tm? -58.08 -50.66 72.68 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.009 -0.542 . . . . 1.3700000000000001 110.311 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -54.34 -38.56 62.5 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.49 -0.862 . . . . 0.32000000000000001 111.524 179.301 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 92.8 m -65.95 -34.53 78.33 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.006 0.432 . . . . 0.31 110.429 179.145 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 48.3 tp -68.3 -36.68 79.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.789 -0.641 . . . . 1.24 110.909 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.452 ' HG3' ' HG3' ' A' ' 43' ' ' PRO . 40.0 mmm -65.46 -40.19 92.91 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.88 -0.415 . . . . 1.1000000000000001 109.88 179.549 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 74.9 mtp180 -67.9 -30.39 69.71 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.266 -0.642 . . . . 2.6899999999999999 109.266 178.705 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 96.2 m -65.97 -21.29 66.41 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 115.286 -0.87 . . . . 1.0600000000000001 110.415 179.245 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 10.3 mp -114.49 156.96 23.62 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.493 -0.776 . . . . 1.26 110.413 179.757 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -53.16 -8.12 0.64 Allowed Glycine 0 CA--C 1.52 0.402 0 C-N-CA 121.109 -0.567 . . . . 0.68999999999999995 113.339 -179.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 82.9 mm-40 -60.43 176.14 0.38 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.089 0.471 . . . . 1.97 111.343 179.752 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 16.8 p-10 -169.81 72.27 0.66 Allowed Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 115.782 -0.645 . . . . 2.6600000000000001 110.85 179.8 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.452 ' HG3' ' HG3' ' A' ' 36' ' ' MET . 56.9 Cg_endo -68.84 142.29 51.68 Favored 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.595 2.196 . . . . 0.51000000000000001 112.316 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 26.9 m -64.22 148.46 50.05 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.243 -0.435 . . . . 0.72999999999999998 110.168 179.346 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.479 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 6.7 tp10 -48.15 -55.69 9.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.595 0.236 . . . . 2.7000000000000002 110.999 -179.356 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -51.13 -52.13 46.9 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.144 -0.48 . . . . 0.46000000000000002 111.42 -179.837 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -50.01 -50.45 47.29 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.375 -0.375 . . . . 2.23 110.702 179.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 12.8 mt -57.07 -45.48 83.26 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.229 -0.441 . . . . 1.3600000000000001 110.676 179.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.479 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 30.4 mm-40 -60.73 -32.31 71.59 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.811 0.339 . . . . 1.22 110.911 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -73.71 -55.52 6.16 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.204 -0.453 . . . . 0.62 112.185 -179.086 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.445 HD11 HD12 ' A' ' 32' ' ' LEU . 1.8 pp -66.59 -36.72 83.3 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 111.613 0.227 . . . . 0.39000000000000001 111.613 -179.13 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 78.9 mt -64.81 -43.25 96.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.702 0.287 . . . . 0.5 110.483 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.54 -28.84 68.14 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.2 -0.454 . . . . 0.58999999999999997 110.372 179.328 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -66.05 -51.36 58.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.93 -0.577 . . . . 2.54 110.228 179.452 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -78.51 -14.72 59.22 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.055 -0.52 . . . . 0.53000000000000003 111.429 179.708 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.477 ' HA ' HG21 ' A' ' 29' ' ' THR . 40.7 tt0 -59.97 -44.09 94.68 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.504 -0.316 . . . . 1.95 111.051 -179.807 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -122.45 57.64 1.08 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.306 -0.406 . . . . 2.48 110.984 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -149.26 -30.53 0.24 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.157 -0.474 . . . . 2.48 110.782 179.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 27.7 m-80 -128.7 25.69 5.65 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.139 -0.482 . . . . 2.0499999999999998 110.784 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . 0.565 ' N ' HD22 ' A' ' 60' ' ' ASN . 0.8 OUTLIER 62.69 11.37 4.8 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.96 -0.564 . . . . 1.47 111.667 179.846 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 104.18 37.95 2.78 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.687 -0.768 . . . . 0.42999999999999999 112.647 179.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.531 HE22 ' C ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -140.56 154.31 46.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.139 0.495 . . . . 0.38 111.438 179.921 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 81.3 mt -122.02 147.76 45.67 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.742 -0.663 . . . . 1.4299999999999999 110.146 179.607 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -112.9 156.76 22.4 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.61 -0.268 . . . . 1.1899999999999999 110.507 -179.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.444 ' O ' ' HB2' ' A' ' 69' ' ' CYS . 78.3 t80 -43.69 -42.6 5.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.206 -0.452 . . . . 0.40000000000000002 111.287 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.27 -34.11 74.27 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 111.874 0.324 . . . . 0.81000000000000005 111.874 -179.713 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -63.09 -54.02 44.56 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.097 0.475 . . . . 1.3600000000000001 110.239 179.501 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.48 ' HE2' ' HB2' ' A' ' 12' ' ' PHE . 28.7 t80 -64.14 -45.01 90.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.752 -0.658 . . . . 0.51000000000000001 110.752 179.676 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.598 ' SG ' HD13 ' A' ' 4' ' ' LEU . 3.9 t -58.15 -44.19 87.74 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.079 -0.509 . . . . 0.75 110.156 179.62 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -53.26 -48.16 60.02 Favored Glycine 0 N--CA 1.45 -0.432 0 CA-C-N 115.622 -0.717 . . . . 0.40999999999999998 111.674 179.536 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.494 HG23 ' CE ' ' A' ' 74' ' ' LYS . 14.4 mt -62.75 -44.7 99.7 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.363 0 CA-C-O 121.091 0.472 . . . . 0.51000000000000001 110.426 179.257 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -53.33 -27.12 21.66 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.555 -0.748 . . . . 1.01 110.035 179.472 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -74.48 -47.29 34.13 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.907 -0.588 . . . . 0.69999999999999996 111.034 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.494 ' CE ' HG23 ' A' ' 71' ' ' ILE . 63.1 pttt -68.74 -27.5 65.98 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 116.551 -0.295 . . . . 1.3799999999999999 111.247 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 22.3 mt-30 -81.24 -50.41 9.59 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.796 0.332 . . . . 1.98 111.497 179.061 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 33.1 mtt . . . . . 0 N--CA 1.454 -0.265 0 N-CA-C 112.373 0.509 . . . . 1.2 112.373 -178.963 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.519 ' O ' ' HG2' ' A' ' 85' ' ' MET . 13.0 t . . . . . 0 N--CA 1.458 -0.046 0 CA-C-O 120.751 0.31 . . . . 7.29 111.163 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.438 ' HA ' ' HG2' ' A' ' 85' ' ' MET . 41.9 mt-10 -75.61 -14.4 60.37 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.21 -0.45 . . . . 9.7400000000000002 111.495 -179.273 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -60.78 -55.29 34.92 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.384 -0.371 . . . . 12.109999999999999 111.614 -179.716 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -65.74 -20.52 66.3 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.303 -0.408 . . . . 10.869999999999999 111.23 -179.503 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' MET . . . . . 0.539 ' HB3' HD11 ' A' ' 145' ' ' ILE . 1.5 mmm -80.46 -36.01 34.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.991 0.424 . . . . 11.09 110.78 -179.353 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 29.4 ttt180 -67.96 -42.44 80.88 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.821 -0.627 . . . . 15.52 110.487 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -68.06 -37.93 81.86 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.078 -0.51 . . . . 14.85 110.002 179.161 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.16 -31.15 67.33 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.972 -0.558 . . . . 14.109999999999999 110.854 179.499 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -67.71 -40.45 84.27 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.118 -0.492 . . . . 15.73 110.456 179.766 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -66.5 -39.91 88.97 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.914 -0.585 . . . . 17.66 110.559 179.493 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 96.9 mt -64.47 -47.93 87.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.845 -0.616 . . . . 18.149999999999999 110.795 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.482 ' HD2' HG11 ' A' ' 108' ' ' VAL . 4.4 m-85 -63.85 -57.14 10.77 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.114 -0.494 . . . . 18.34 110.695 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . 0.601 ' HA ' HH21 ' A' ' 94' ' ' ARG . 27.4 t0 -53.51 127.3 24.67 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 120.787 0.327 . . . . 19.289999999999999 110.228 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.731 ' H ' ' HE ' ' A' ' 94' ' ' ARG . 0.0 OUTLIER -98.19 -24.18 15.38 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.28 -0.418 . . . . 22.25 111.788 -178.665 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -101.84 -179.93 4.15 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.969 0.414 . . . . 23.34 111.026 -179.794 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.26 3.3 56.67 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.886 -0.673 . . . . 22.0 112.024 179.628 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -71.63 -36.14 70.66 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.869 0.366 . . . . 22.280000000000001 111.24 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 90.38 27.15 21.31 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.737 -0.744 . . . . 19.93 112.494 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . 0.422 ' HA ' ' O ' ' A' ' 136' ' ' ILE . 86.3 m-85 -132.32 142.81 49.49 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.569 0.223 . . . . 20.300000000000001 110.764 179.839 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.579 ' HB ' ' HB ' ' A' ' 136' ' ' ILE . 41.5 mt -114.47 126.28 71.97 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-O 120.923 0.392 . . . . 19.370000000000001 111.268 179.893 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 26.8 p -116.05 156.12 47.19 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 115.94 -0.573 . . . . 22.489999999999998 110.555 179.794 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_exo -41.63 -36.33 3.1 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 122.448 2.099 . . . . 23.0 112.464 -179.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.416 ' O ' ' HG3' ' A' ' 106' ' ' ARG . . . -64.89 -49.98 68.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.08 0.467 . . . . 24.559999999999999 110.591 179.554 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . 0.582 ' HB3' ' CZ ' ' A' ' 94' ' ' ARG . 38.1 mt-10 -63.24 -50.25 70.94 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.935 -0.575 . . . . 22.23 110.677 179.337 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.626 HD23 ' HB ' ' A' ' 121' ' ' ILE . 48.0 tp -51.55 -35.43 40.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.642 -0.708 . . . . 20.359999999999999 111.799 -179.081 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.448 ' HG3' ' N ' ' A' ' 107' ' ' PHE . 0.1 OUTLIER -76.28 -32.15 58.65 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.91 0.386 . . . . 27.190000000000001 110.551 -179.677 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . 0.448 ' N ' ' HG3' ' A' ' 106' ' ' ARG . 85.5 t80 -72.62 -34.75 67.57 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.901 -0.591 . . . . 25.359999999999999 111.732 -179.883 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.487 HG13 ' N ' ' A' ' 109' ' ' MET . 7.3 p -77.86 -47.0 26.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 N-CA-C 112.011 0.374 . . . . 21.059999999999999 112.011 -179.203 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.487 ' N ' HG13 ' A' ' 108' ' ' VAL . 0.2 OUTLIER -51.6 -36.99 47.89 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.724 0.297 . . . . 20.93 111.533 -179.321 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.428 HG13 ' O ' ' A' ' 106' ' ' ARG . 75.7 mt -69.47 -26.8 32.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.349 -0.387 . . . . 25.129999999999999 111.082 -179.827 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -73.29 -41.14 63.94 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.195 -0.457 . . . . 23.32 110.619 179.635 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 9.2 mp -63.5 -44.37 94.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.914 -0.585 . . . . 21.07 110.945 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 133.6 1.88 3.72 Favored Glycine 0 C--N 1.331 0.286 0 C-N-CA 120.688 -0.768 . . . . 23.050000000000001 112.753 179.562 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -103.16 115.38 30.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.784 0.326 . . . . 22.59 111.291 -179.637 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -76.09 128.52 35.15 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.196 -0.456 . . . . 27.960000000000001 110.256 179.434 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . 0.466 ' HB ' HG23 ' A' ' 121' ' ' ILE . 3.1 m -142.36 155.6 18.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 121.18 0.514 . . . . 24.75 111.802 -179.474 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . 0.456 ' O ' HG12 ' A' ' 121' ' ' ILE . 43.0 p -103.44 147.49 27.07 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.472 -0.785 . . . . 27.239999999999998 110.208 179.646 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -51.95 -19.69 1.94 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.241 -0.436 . . . . 26.629999999999999 111.519 -179.635 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -77.9 -54.92 5.76 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.523 -0.308 . . . . 29.140000000000001 111.704 -179.535 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . 0.431 ' OE1' HG12 ' A' ' 116' ' ' VAL . 14.6 pt-20 -63.17 -39.57 95.03 Favored 'General case' 0 C--N 1.332 -0.196 0 N-CA-C 112.034 0.383 . . . . 24.190000000000001 112.034 -179.182 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.626 ' HB ' HD23 ' A' ' 105' ' ' LEU . 15.2 pt -71.63 -40.28 70.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 C-N-CA 121.022 -0.271 . . . . 22.329999999999998 111.63 -179.485 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . 0.532 ' N ' HG13 ' A' ' 121' ' ' ILE . 15.4 t70 -57.79 -43.13 85.43 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.741 0.305 . . . . 24.289999999999999 110.538 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -63.0 -43.7 98.07 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.07 -0.514 . . . . 24.739999999999998 110.171 179.415 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.455 ' HE3' HD21 ' A' ' 105' ' ' LEU . 56.0 ttp -57.15 -33.89 67.87 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.002 -0.545 . . . . 19.710000000000001 110.362 179.148 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.653 HG23 HD11 ' A' ' 136' ' ' ILE . 97.3 mt -67.36 -43.72 87.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.815 -0.629 . . . . 19.949999999999999 110.533 179.638 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 32.3 ttm180 -60.3 -32.6 71.37 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.937 -0.574 . . . . 24.949999999999999 110.801 179.593 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -63.67 -29.73 70.93 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.13 -0.487 . . . . 18.690000000000001 111.278 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.686 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -104.28 -15.37 15.49 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.3 -0.409 . . . . 16.469999999999999 111.329 -179.86 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -93.98 103.53 15.61 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.108 -0.496 . . . . 20.399999999999999 110.771 -179.666 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -96.52 -31.09 12.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.883 -0.599 . . . . 21.43 111.32 -179.427 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -70.69 -15.85 62.75 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.389 -0.369 . . . . 23.370000000000001 110.74 179.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 58.88 85.29 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 121.024 -0.607 . . . . 24.32 112.946 179.557 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -152.21 1.98 0.34 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.684 0.278 . . . . 23.879999999999999 111.073 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 69.28 20.85 75.5 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.81 -0.709 . . . . 22.670000000000002 112.753 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 82.1 mmm -135.12 155.04 51.4 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.591 0.234 . . . . 22.91 110.523 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.674 HG23 ' HB2' ' A' ' 140' ' ' GLU . 46.4 mm -116.79 143.81 26.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 121.093 0.473 . . . . 18.41 111.491 179.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . 0.404 ' C ' ' N ' ' A' ' 139' ' ' GLU . 30.2 m-20 -114.41 156.67 24.07 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.267 -0.878 . . . . 16.82 108.711 178.465 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.686 ' O ' HG23 ' A' ' 142' ' ' VAL . 16.9 t80 -42.65 -23.47 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.673 0.273 . . . . 14.65 111.151 179.823 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . 0.404 ' N ' ' C ' ' A' ' 137' ' ' ASN . 12.0 mm-40 -80.52 -56.03 4.46 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 120.904 0.383 . . . . 14.82 110.831 -179.799 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.674 ' HB2' HG23 ' A' ' 136' ' ' ILE . 29.6 mt-10 -57.96 -27.26 63.26 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.139 -0.482 . . . . 17.460000000000001 110.121 179.616 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.585 ' HA ' ' HE2' ' A' ' 144' ' ' MET . 90.3 t80 -70.4 -55.71 8.41 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.746 -0.661 . . . . 12.93 110.035 179.435 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.686 HG23 ' O ' ' A' ' 138' ' ' TYR . 55.1 t -46.03 -36.91 2.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 115.781 -0.645 . . . . 10.699999999999999 111.507 178.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 79.5 t90 -71.81 -55.5 7.47 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 112.563 0.579 . . . . 13.66 112.563 -178.809 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . 0.686 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 20.8 ptt? -64.28 -22.63 67.02 Favored 'General case' 0 N--CA 1.463 0.203 0 N-CA-C 112.921 0.711 . . . . 14.5 112.921 -177.637 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 145' ' ' ILE . . . . . 0.694 ' HA ' ' HB2' ' A' ' 148' ' ' LYS . 28.3 pt -80.55 -42.58 21.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 C-N-CA 120.702 -0.399 . . . . 11.25 111.416 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 146' ' ' SER . . . . . 0.469 ' N ' HG13 ' A' ' 145' ' ' ILE . 82.3 p -65.04 -14.15 59.7 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.519 0.676 . . . . 8.5399999999999991 109.421 179.235 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 -125.94 19.5 7.76 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 114.839 -1.073 . . . . 11.869999999999999 110.066 -179.589 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . 0.694 ' HB2' ' HA ' ' A' ' 145' ' ' ILE . 24.1 ttpp . . . . . 0 C--O 1.25 1.107 0 CA-C-O 118.296 -0.859 . . . . 13.68 110.898 -179.618 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 51.3 mt . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.77 0.319 . . . . 1.27 111.105 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -98.07 165.16 12.03 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.205 -0.452 . . . . 1.1200000000000001 110.838 179.822 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -51.59 -39.05 57.21 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.797 0.332 . . . . 2.2000000000000002 111.51 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.444 ' HG3' ' N ' ' A' ' 8' ' ' GLN . 11.6 pt-20 -72.08 -46.7 55.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.278 -0.419 . . . . 1.3500000000000001 111.075 -179.406 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . 0.444 ' N ' ' HG3' ' A' ' 7' ' ' GLU . 96.7 mt-30 -61.04 -42.55 98.69 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.885 -0.598 . . . . 2.2200000000000002 110.945 -179.812 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.483 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 77.1 mt -59.29 -51.94 66.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.951 -0.568 . . . . 0.54000000000000004 110.893 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.0 -26.8 67.86 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.12 -0.491 . . . . 0.5 111.654 -179.718 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -69.45 -56.72 6.61 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 112.155 0.428 . . . . 2.27 112.155 -178.834 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.483 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 8.5 p90 -77.89 -25.03 48.29 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 120.466 -0.494 . . . . 0.37 110.908 -179.544 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.457 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 41.6 tptt -64.45 -34.12 77.47 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 108.969 -0.752 . . . . 1.23 108.969 178.707 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -70.12 -48.95 55.35 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 108.697 -0.853 . . . . 0.44 108.697 177.689 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.84 -14.06 41.26 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.268 -0.878 . . . . 0.28999999999999998 110.355 178.697 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.457 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 31.2 t80 -80.04 -54.04 6.16 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.809 -0.632 . . . . 0.47999999999999998 111.0 -179.501 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 15.6 m -62.25 -22.73 30.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 121.105 0.479 . . . . 1.1100000000000001 110.334 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 75.6 mm-40 -61.09 -32.41 72.07 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.624 -0.716 . . . . 1.6000000000000001 111.543 179.597 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 99.7 m-85 -101.97 33.89 2.88 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.741 0.305 . . . . 0.64000000000000001 111.631 -179.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -125.64 75.5 1.49 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.042 0.449 . . . . 0.44 110.425 179.32 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 41.1 tptt -87.01 -33.85 19.43 Favored 'General case' 0 N--CA 1.436 -1.129 0 CA-C-N 115.824 -0.625 . . . . 2.1000000000000001 110.925 -179.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -63.24 -15.68 57.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.102 -0.499 . . . . 1.8 111.384 -179.52 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.48 10.7 84.6 Favored Glycine 0 C--N 1.331 0.264 0 C-N-CA 120.832 -0.699 . . . . 0.46000000000000002 112.833 179.553 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 20.3 p -86.9 15.35 5.98 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.637 0.256 . . . . 0.40000000000000002 111.213 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 53.35 26.39 29.57 Favored Glycine 0 C--N 1.333 0.388 0 C-N-CA 120.851 -0.69 . . . . 0.33000000000000002 112.234 -179.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.474 ' C ' HE22 ' A' ' 62' ' ' GLN . 31.5 mtmm -135.0 156.57 48.82 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.822 0.344 . . . . 1.1000000000000001 111.054 -179.646 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.616 HG13 ' HB2' ' A' ' 63' ' ' LEU . 23.8 pt -114.11 126.02 71.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 121.115 0.483 . . . . 0.5 111.468 -179.649 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -54.49 138.17 41.07 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.861 -0.609 . . . . 0.29999999999999999 111.213 179.707 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 9.4 t -68.31 -9.44 47.75 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.061 -0.518 . . . . 1.03 111.382 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.421 ' HD3' ' N ' ' A' ' 30' ' ' ARG . 0.0 OUTLIER -87.13 -14.14 42.15 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.256 -0.429 . . . . 3.0800000000000001 110.681 179.902 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -108.19 -0.28 21.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.093 -0.503 . . . . 2.2599999999999998 110.632 179.768 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.447 HD22 ' HA ' ' A' ' 32' ' ' LEU . 1.0 OUTLIER -60.08 -46.08 90.77 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.072 -0.513 . . . . 1.3700000000000001 109.972 179.665 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.589 ' HA2' HD11 ' A' ' 48' ' ' LEU . . . -56.89 -36.8 74.8 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.507 -0.854 . . . . 0.32000000000000001 111.277 179.051 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 87.6 m -70.54 -32.5 69.98 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.007 0.432 . . . . 0.31 110.027 179.047 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.46 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 1.2 tt -65.48 -35.47 80.98 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.679 -0.691 . . . . 1.24 110.165 179.68 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.571 ' HG3' ' HG3' ' A' ' 43' ' ' PRO . 21.7 mmt -69.52 -42.17 75.03 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.215 -0.448 . . . . 1.1000000000000001 110.482 179.301 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 62.7 mtp180 -53.19 -51.65 61.39 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.617 -0.719 . . . . 2.6899999999999999 111.403 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 10.2 t -62.99 -12.78 28.1 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.433 -0.349 . . . . 1.0600000000000001 111.538 -179.785 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.46 ' HG ' ' O ' ' A' ' 35' ' ' LEU . 47.1 mt -113.06 156.65 22.75 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.364 -0.38 . . . . 1.26 110.708 -179.827 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -76.88 39.89 1.6 Allowed Glycine 0 CA--C 1.52 0.357 0 C-N-CA 120.88 -0.676 . . . . 0.68999999999999995 113.912 -178.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 67.2 mm-40 -94.3 -59.98 1.83 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 117.148 0.474 . . . . 1.97 110.745 179.034 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.567 HD22 ' N ' ' A' ' 42' ' ' ASN . 0.8 OUTLIER 57.15 66.28 3.17 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.132 -0.486 . . . . 2.6600000000000001 111.088 179.965 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.571 ' HG3' ' HG3' ' A' ' 36' ' ' MET . 43.5 Cg_endo -67.42 167.95 19.26 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.593 2.195 . . . . 0.51000000000000001 112.117 179.723 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 20.6 m -74.43 150.09 40.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.184 -0.462 . . . . 0.72999999999999998 110.511 179.654 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -54.76 -48.01 73.17 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.654 0.264 . . . . 2.7000000000000002 111.434 -179.716 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.81 -47.19 81.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.375 -0.375 . . . . 0.46000000000000002 111.498 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.451 ' O ' HD23 ' A' ' 51' ' ' LEU . 10.0 tp10 -56.46 -48.79 76.33 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.03 0.443 . . . . 2.23 110.48 -179.554 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.589 HD11 ' HA2' ' A' ' 33' ' ' GLY . 33.4 tp -57.45 -41.24 80.16 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.555 -0.748 . . . . 1.3600000000000001 110.938 -179.759 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 67.8 mt-30 -72.17 -25.95 61.88 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.058 -0.519 . . . . 1.22 111.212 -179.595 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -71.12 -55.05 9.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.483 -0.326 . . . . 0.62 111.565 -179.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.451 HD23 ' O ' ' A' ' 47' ' ' GLU . 0.9 OUTLIER -64.9 -38.8 92.16 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.459 -0.337 . . . . 0.39000000000000001 111.844 -179.226 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 94.5 mt -65.5 -48.37 83.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.841 0.353 . . . . 0.5 110.837 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.92 -26.33 66.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.192 -0.458 . . . . 0.58999999999999997 110.745 179.635 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -69.79 -53.98 15.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.991 -0.549 . . . . 2.54 110.416 179.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -72.7 -14.3 61.54 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.996 -0.547 . . . . 0.53000000000000003 111.176 179.735 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -55.53 -30.61 61.02 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.097 -0.501 . . . . 1.95 111.406 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -118.57 -33.23 4.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.506 -0.316 . . . . 2.48 111.337 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -69.58 -34.64 74.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.412 -0.358 . . . . 2.48 111.133 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . 0.453 ' O ' ' HB2' ' A' ' 60' ' ' ASN . 13.5 m120 -114.7 6.25 15.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.315 -0.402 . . . . 2.0499999999999998 111.246 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . 0.453 ' HB2' ' O ' ' A' ' 59' ' ' ASN . 39.6 m-80 74.0 -49.66 0.68 Allowed 'General case' 0 N--CA 1.466 0.375 0 O-C-N 123.607 0.567 . . . . 1.47 111.527 -179.867 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 169.43 7.52 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.598 -0.81 . . . . 0.42999999999999999 112.992 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.474 HE22 ' C ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -124.66 155.03 39.85 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.995 0.426 . . . . 0.38 111.284 179.837 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.616 ' HB2' HG13 ' A' ' 27' ' ' ILE . 27.3 mt -129.28 156.56 43.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.867 -0.606 . . . . 1.4299999999999999 110.854 -179.79 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . 0.421 ' H ' ' CG ' ' A' ' 67' ' ' GLU . 44.3 m-80 -112.34 157.26 21.21 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.526 -0.307 . . . . 1.1899999999999999 110.493 179.902 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.473 ' O ' ' HB2' ' A' ' 69' ' ' CYS . 87.8 t80 -43.06 -38.46 2.34 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.986 -0.552 . . . . 0.40000000000000002 110.654 179.589 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -72.81 -37.71 67.44 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.063 -0.517 . . . . 0.81000000000000005 111.922 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.421 ' CG ' ' H ' ' A' ' 64' ' ' ASN . 20.6 mm-40 -59.65 -49.97 75.69 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.179 0.514 . . . . 1.3600000000000001 109.918 179.562 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.466 ' HE2' ' HB2' ' A' ' 12' ' ' PHE . 34.2 t80 -68.5 -53.7 21.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.525 -0.761 . . . . 0.51000000000000001 110.839 179.763 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.473 ' HB2' ' O ' ' A' ' 65' ' ' PHE . 1.8 t -51.52 -41.02 60.74 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-O 120.971 0.415 . . . . 0.75 110.267 179.667 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -56.94 -50.38 64.45 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.864 -0.684 . . . . 0.40999999999999998 111.526 179.577 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.453 ' HA ' ' HE2' ' A' ' 74' ' ' LYS . 11.4 mt -62.38 -36.69 76.02 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.407 0 CA-C-O 120.88 0.372 . . . . 0.51000000000000001 110.852 179.344 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . 0.406 ' HG2' ' O ' ' A' ' 68' ' ' PHE . 95.0 mmm -59.2 -41.34 88.32 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.153 0.501 . . . . 1.01 109.679 179.104 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -55.93 -52.7 63.19 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.463 -0.79 . . . . 0.69999999999999996 110.659 178.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.453 ' HE2' ' HA ' ' A' ' 71' ' ' ILE . 55.3 pttt -68.7 -30.52 69.2 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.287 -0.415 . . . . 1.3799999999999999 111.15 -179.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . 0.491 ' NE2' ' HB3' ' A' ' 43' ' ' PRO . 5.1 tp-100 -68.64 -45.61 71.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.92 0.39 . . . . 1.98 110.884 179.624 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 45.1 mtt . . . . . 0 N--CA 1.445 -0.719 0 CA-C-N 115.861 -0.609 . . . . 1.2 111.022 -179.744 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.532 ' O ' ' HG2' ' A' ' 85' ' ' MET . 3.0 t . . . . . 0 N--CA 1.469 0.492 0 CA-C-O 121.17 0.509 . . . . 7.29 111.07 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -49.92 -18.95 0.59 Allowed 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 115.281 -0.872 . . . . 9.7400000000000002 113.112 -178.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -60.35 -56.28 23.35 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 111.854 0.316 . . . . 12.109999999999999 111.854 -179.213 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -72.73 -13.65 61.38 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.357 -0.383 . . . . 10.869999999999999 111.285 -179.455 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' MET . . . . . 0.628 ' HB3' HG22 ' A' ' 142' ' ' VAL . 5.6 mmm -79.34 -49.28 12.66 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.468 -0.333 . . . . 11.09 110.627 -179.197 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 16.3 ttp180 -63.45 -42.23 98.65 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 116.219 -0.446 . . . . 15.52 109.912 179.586 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -60.11 -42.14 94.1 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.013 -0.539 . . . . 14.85 109.795 179.105 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -72.17 -23.23 61.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.75 -0.659 . . . . 14.109999999999999 110.597 179.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -68.95 -43.44 75.04 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.194 -0.457 . . . . 15.73 110.482 179.649 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 47.7 mtmt -68.32 -40.99 81.46 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.135 -0.484 . . . . 17.66 110.353 179.482 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 93.0 mt -64.47 -46.36 93.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.89 -0.595 . . . . 18.149999999999999 111.106 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.457 ' HA ' HG21 ' A' ' 108' ' ' VAL . 0.6 OUTLIER -65.93 -49.13 69.03 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.281 -0.418 . . . . 18.34 110.907 -179.963 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -61.06 98.63 0.08 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.28 -0.418 . . . . 19.289999999999999 110.069 179.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.43 ' HG2' ' HB3' ' A' ' 104' ' ' GLU . 18.9 mmm180 -51.7 -27.77 12.76 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.918 -0.583 . . . . 22.25 111.231 -179.414 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.423 ' HB2' ' OD1' ' A' ' 97' ' ' ASP . 4.0 m-20 -112.22 169.9 8.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.3 -0.409 . . . . 23.34 110.731 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.41 5.6 57.31 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.891 -0.671 . . . . 22.0 112.051 179.675 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.423 ' OD1' ' HB2' ' A' ' 95' ' ' ASP . 7.8 p-10 -57.43 -32.7 67.16 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.687 0.28 . . . . 22.280000000000001 111.23 -179.659 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 107.43 12.97 22.06 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.698 -0.763 . . . . 19.93 112.926 179.626 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . 0.455 ' HA ' ' O ' ' A' ' 136' ' ' ILE . 97.3 m-85 -138.69 145.26 40.14 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.834 0.349 . . . . 20.300000000000001 111.071 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 48.5 mt -115.85 137.81 48.33 Favored 'Isoleucine or valine' 0 C--O 1.232 0.148 0 CA-C-N 116.151 -0.477 . . . . 19.370000000000001 111.445 -179.726 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 28.3 p -115.84 156.31 46.65 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 115.827 -0.624 . . . . 22.489999999999998 110.606 179.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_exo -44.34 -38.01 11.0 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.396 2.064 . . . . 23.0 112.552 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -63.89 -40.05 95.6 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.055 -0.521 . . . . 24.559999999999999 111.037 179.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . 0.526 ' O ' HG23 ' A' ' 108' ' ' VAL . 42.2 mt-10 -72.82 -41.44 64.9 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.473 -0.785 . . . . 22.23 110.369 -179.896 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.583 HD23 ' HE1' ' A' ' 109' ' ' MET . 4.9 tp -58.05 -55.04 40.14 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.695 -0.684 . . . . 20.359999999999999 110.381 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 9.0 ttp180 -54.61 -49.78 69.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.588 -0.733 . . . . 27.190000000000001 111.573 -179.813 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 55.3 t80 -54.59 -33.8 60.93 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.203 -0.453 . . . . 25.359999999999999 111.786 -178.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.526 HG23 ' O ' ' A' ' 104' ' ' GLU . 58.3 t -79.23 -55.43 9.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 112.113 0.412 . . . . 21.059999999999999 112.113 -179.187 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.583 ' HE1' HD23 ' A' ' 105' ' ' LEU . 49.5 mtm -50.64 -41.23 55.02 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.524 0.202 . . . . 20.93 111.429 -179.278 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 88.9 mt -62.85 -32.59 56.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.928 0.394 . . . . 25.129999999999999 110.546 179.36 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 95.8 m-20 -71.46 -38.27 71.29 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.007 -0.542 . . . . 23.32 110.828 179.501 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.489 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 2.3 mt -74.66 -25.94 59.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.191 -0.459 . . . . 21.07 110.936 -179.708 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 98.23 46.87 2.12 Favored Glycine 0 N--CA 1.453 -0.23 0 C-N-CA 120.887 -0.673 . . . . 23.050000000000001 112.433 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -100.26 -27.02 13.71 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.523 0.201 . . . . 22.59 111.359 -179.684 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 13.4 mmmm 52.3 85.97 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.327 -0.397 . . . . 27.960000000000001 110.809 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . 0.457 HG21 ' SD ' ' A' ' 109' ' ' MET . 2.8 m -129.44 155.38 41.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.122 -0.49 . . . . 24.75 111.824 -179.514 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 59.2 p -95.87 146.71 24.35 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.798 -0.637 . . . . 27.239999999999998 109.864 178.608 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -55.54 -15.85 3.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.476 -0.329 . . . . 26.629999999999999 111.618 -179.453 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -79.21 -55.22 5.26 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.498 -0.319 . . . . 29.140000000000001 111.612 -179.573 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . 0.413 ' OE1' HG12 ' A' ' 116' ' ' VAL . 13.3 pt-20 -62.03 -37.34 84.54 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 111.824 0.305 . . . . 24.190000000000001 111.824 -179.347 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.549 ' HB ' HD23 ' A' ' 105' ' ' LEU . 33.3 pt -74.89 -38.19 43.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 N-CA-C 111.887 0.329 . . . . 22.329999999999998 111.887 -179.06 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . 0.504 ' N ' HG13 ' A' ' 121' ' ' ILE . 18.0 t70 -62.33 -43.94 97.66 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.872 0.367 . . . . 24.289999999999999 110.561 179.753 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -62.55 -43.03 99.83 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.03 -0.532 . . . . 24.739999999999998 110.565 179.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 45.4 ttp -56.41 -36.95 69.51 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.063 -0.517 . . . . 19.710000000000001 110.651 179.389 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.644 HG23 HD11 ' A' ' 136' ' ' ILE . 71.9 mt -65.24 -43.05 95.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.045 -0.525 . . . . 19.949999999999999 110.514 179.751 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 69.9 ttt180 -59.4 -37.92 79.25 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.815 -0.63 . . . . 24.949999999999999 111.046 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -70.92 -24.48 62.47 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.202 -0.454 . . . . 18.690000000000001 111.315 -179.635 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.577 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -98.94 -12.77 20.37 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.309 -0.405 . . . . 16.469999999999999 111.272 -179.831 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 62.1 t0 -103.32 96.45 6.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.204 -0.453 . . . . 20.399999999999999 110.935 -179.553 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -66.38 -54.05 28.88 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.896 -0.593 . . . . 21.43 111.128 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -61.14 -19.3 61.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.153 -0.476 . . . . 23.370000000000001 111.042 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 52.16 77.38 0.14 Allowed Glycine 0 N--CA 1.453 -0.186 0 C-N-CA 120.904 -0.665 . . . . 24.32 112.753 179.718 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -128.75 -0.3 5.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.825 0.345 . . . . 23.879999999999999 110.667 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 80.74 19.66 67.56 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.9 -0.667 . . . . 22.670000000000002 112.617 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 38.2 mtp -139.33 149.33 44.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.65 0.262 . . . . 22.91 110.419 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.723 HG23 ' HB2' ' A' ' 140' ' ' GLU . 47.4 mm -116.62 142.3 30.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 121.254 0.549 . . . . 18.41 111.95 -179.408 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . 0.543 ' ND2' ' HB2' ' A' ' 139' ' ' GLU . 1.2 p-10 -114.94 158.75 21.58 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.159 -0.928 . . . . 16.82 109.239 178.647 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.699 ' O ' HG23 ' A' ' 142' ' ' VAL . 11.8 t80 -37.72 -27.56 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 112.481 0.549 . . . . 14.65 112.481 -179.067 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . 0.543 ' HB2' ' ND2' ' A' ' 137' ' ' ASN . 43.3 mt-10 -80.54 -55.73 4.66 Favored 'General case' 0 C--N 1.328 -0.327 0 O-C-N 122.155 -0.34 . . . . 14.82 111.236 -179.328 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.723 ' HB2' HG23 ' A' ' 136' ' ' ILE . 71.4 mt-10 -59.15 -29.76 67.66 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.228 -0.442 . . . . 17.460000000000001 110.504 179.819 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.536 ' CE2' HD13 ' A' ' 145' ' ' ILE . 78.7 t80 -70.23 -55.61 8.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.821 -0.627 . . . . 12.93 110.575 179.715 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.699 HG23 ' O ' ' A' ' 138' ' ' TYR . 53.7 t -48.25 -35.86 5.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 115.917 -0.583 . . . . 10.699999999999999 111.972 179.728 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 143' ' ' TRP . . . . . 0.487 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 91.4 t90 -72.23 -56.06 6.16 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.469 0.544 . . . . 13.66 112.469 -179.018 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . 0.694 ' HE2' HG21 ' A' ' 136' ' ' ILE . 18.2 ptt? -61.35 -25.76 67.37 Favored 'General case' 0 N--CA 1.464 0.244 0 N-CA-C 112.93 0.715 . . . . 14.5 112.93 -177.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 145' ' ' ILE . . . . . 0.561 HD11 ' HB3' ' A' ' 85' ' ' MET . 45.6 pt -80.48 -40.78 19.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 112.022 0.378 . . . . 11.25 112.022 -179.559 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 146' ' ' SER . . . . . 0.546 ' N ' HG13 ' A' ' 145' ' ' ILE . 22.6 t -59.7 -14.49 14.34 Favored 'General case' 0 CA--C 1.519 -0.25 0 CA-C-O 121.45 0.643 . . . . 8.5399999999999991 109.841 -179.804 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 147' ' ' GLN . . . . . 0.487 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 2.6 mm-40 -114.63 -15.54 11.95 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.887 -1.051 . . . . 11.869999999999999 110.242 -179.579 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.312 -0.851 . . . . 13.68 110.904 179.822 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.552 HD13 ' SG ' ' A' ' 69' ' ' CYS . 31.3 mt . . . . . 0 CA--C 1.528 0.101 0 CA-C-O 120.792 0.33 . . . . 1.27 110.925 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 76.3 p -70.34 -167.84 0.2 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.259 -0.428 . . . . 1.1200000000000001 111.057 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.426 ' HG3' ' N ' ' A' ' 7' ' ' GLU . 10.0 pt-20 -72.64 -40.46 66.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.908 0.385 . . . . 2.2000000000000002 110.505 -179.91 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.426 ' N ' ' HG3' ' A' ' 6' ' ' GLU . 9.4 pt-20 -74.18 -39.05 63.46 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.936 -0.574 . . . . 1.3500000000000001 110.515 179.733 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -65.13 -48.99 71.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.905 -0.588 . . . . 2.2200000000000002 110.64 179.721 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.53 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 61.9 mt -55.8 -50.59 67.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.389 -0.369 . . . . 0.54000000000000004 110.705 179.829 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.61 -23.11 66.13 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.163 -0.472 . . . . 0.5 111.255 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -69.71 -56.35 7.45 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.295 -0.412 . . . . 2.27 111.828 -179.108 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.53 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 12.3 p90 -78.22 -25.47 46.99 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 120.586 -0.446 . . . . 0.37 110.879 -179.775 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.471 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 20.0 tptm -63.32 -36.23 83.02 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 108.989 -0.745 . . . . 1.23 108.989 178.484 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.463 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 15.7 t70 -68.44 -51.98 37.75 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 108.825 -0.806 . . . . 0.44 108.825 177.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.34 -13.81 22.31 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.399 -0.819 . . . . 0.28999999999999998 110.568 179.069 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.471 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 55.0 t80 -79.43 -51.45 9.35 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.886 -0.597 . . . . 0.47999999999999998 110.597 -179.697 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.442 HG22 ' O ' ' A' ' 14' ' ' ASP . 26.9 m -65.36 -18.92 24.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 121.003 0.43 . . . . 1.1100000000000001 110.294 179.913 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.463 ' HG2' ' O ' ' A' ' 14' ' ' ASP . 29.2 mm-40 -63.2 -29.62 70.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.648 -0.705 . . . . 1.6000000000000001 111.719 179.483 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -105.87 27.1 8.85 Favored 'General case' 0 N--CA 1.463 0.217 0 N-CA-C 112.04 0.385 . . . . 0.64000000000000001 112.04 -179.185 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -113.94 86.74 2.47 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.988 0.423 . . . . 0.44 110.589 179.217 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.546 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -94.85 -38.01 10.94 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.917 -0.583 . . . . 2.1000000000000001 111.438 -179.599 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -56.8 -24.59 51.73 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.307 -0.406 . . . . 1.8 111.477 -179.583 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 87.28 1.92 83.56 Favored Glycine 0 C--N 1.33 0.209 0 C-N-CA 120.793 -0.717 . . . . 0.46000000000000002 112.88 179.62 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 26.8 p -82.35 16.07 2.2 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.688 0.28 . . . . 0.40000000000000002 111.195 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 54.93 25.55 38.17 Favored Glycine 0 C--N 1.331 0.299 0 C-N-CA 120.721 -0.752 . . . . 0.33000000000000002 111.766 -179.539 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.503 ' C ' HE22 ' A' ' 62' ' ' GLN . 35.4 mtmm -132.38 156.61 46.34 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.842 0.353 . . . . 1.1000000000000001 111.067 -179.382 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.711 HG13 ' HB2' ' A' ' 63' ' ' LEU . 31.1 pt -114.33 124.94 71.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 121.001 0.429 . . . . 0.5 111.341 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -51.2 141.19 15.05 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.063 -0.517 . . . . 0.29999999999999999 111.416 179.736 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 8.3 t -65.91 -11.84 50.13 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.94 -0.573 . . . . 1.03 111.313 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.459 ' HD2' ' N ' ' A' ' 30' ' ' ARG . 2.5 mpt_? -90.76 5.25 49.05 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.971 0.415 . . . . 3.0800000000000001 110.492 179.777 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -120.86 -9.43 9.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.923 -0.58 . . . . 2.2599999999999998 110.788 -179.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.521 HD22 HD11 ' A' ' 51' ' ' LEU . 7.9 tt -53.25 -52.46 58.92 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.317 -0.401 . . . . 1.3700000000000001 110.747 179.671 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.482 ' HA2' HD11 ' A' ' 48' ' ' LEU . . . -54.3 -48.01 65.97 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.427 -0.892 . . . . 0.32000000000000001 111.602 179.551 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 30.2 m -58.3 -29.25 65.71 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 121.423 0.63 . . . . 0.31 109.643 178.688 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.475 ' O ' HG22 ' A' ' 38' ' ' THR . 1.2 tt -72.67 -35.07 67.62 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.163 -0.926 . . . . 1.24 109.905 179.391 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.557 ' SD ' ' HG3' ' A' ' 43' ' ' PRO . 7.4 mtp -76.92 -16.9 59.23 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.976 -0.556 . . . . 1.1000000000000001 110.297 179.89 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -80.63 -41.78 23.3 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.977 -0.556 . . . . 2.6899999999999999 110.302 179.049 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.475 HG22 ' O ' ' A' ' 35' ' ' LEU . 10.4 t -67.32 -12.44 60.16 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.991 -0.55 . . . . 1.0600000000000001 110.769 179.568 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 26.4 mt -112.28 155.53 23.9 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.918 -0.583 . . . . 1.26 110.136 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -72.42 16.83 1.62 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.834 -0.698 . . . . 0.68999999999999995 113.462 -179.272 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 85.1 mm-40 -68.09 -63.2 1.11 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.907 0.384 . . . . 1.97 110.932 179.602 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 69.7 m-20 55.57 70.77 1.43 Allowed Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 115.936 -0.574 . . . . 2.6600000000000001 111.061 -179.707 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.557 ' HG3' ' SD ' ' A' ' 36' ' ' MET . 57.5 Cg_endo -67.97 -167.78 0.18 Allowed 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.87 2.38 . . . . 0.51000000000000001 112.307 179.645 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 41.1 m -100.17 144.23 29.44 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.036 -0.529 . . . . 0.72999999999999998 110.489 179.45 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -48.99 -55.14 12.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.742 0.306 . . . . 2.7000000000000002 111.364 -179.442 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -54.49 -48.24 72.09 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.204 -0.453 . . . . 0.46000000000000002 111.622 -179.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.452 ' HG2' HD23 ' A' ' 51' ' ' LEU . 37.8 tt0 -56.4 -47.29 79.27 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.813 0.339 . . . . 2.23 110.651 -179.778 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.482 HD11 ' HA2' ' A' ' 33' ' ' GLY . 13.9 tp -58.83 -41.88 87.92 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.936 -0.575 . . . . 1.3600000000000001 111.112 -179.764 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 82.8 mm-40 -71.12 -31.76 68.15 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.249 -0.432 . . . . 1.22 111.759 -179.384 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.465 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 28.8 m-20 -74.07 -55.88 5.58 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 111.919 0.34 . . . . 0.62 111.919 -179.199 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.521 HD11 HD22 ' A' ' 32' ' ' LEU . 3.1 pp -59.51 -37.29 77.93 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.696 -0.229 . . . . 0.39000000000000001 111.285 -179.314 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 76.8 mt -69.35 -35.39 67.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.754 0.312 . . . . 0.5 110.556 179.539 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.68 -36.55 81.19 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.301 -0.409 . . . . 0.58999999999999997 110.756 179.45 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.465 ' HG2' ' O ' ' A' ' 50' ' ' ASP . 3.3 mm-40 -73.23 -50.38 22.72 Favored 'General case' 0 CA--C 1.516 -0.365 0 N-CA-C 109.623 -0.51 . . . . 2.54 109.623 179.178 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -63.12 -14.36 47.66 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.551 -0.749 . . . . 0.53000000000000003 110.975 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -57.47 -37.26 72.6 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.975 -0.557 . . . . 1.95 111.61 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 6.8 p30 -127.09 -36.95 2.12 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.597 -0.274 . . . . 2.48 111.563 -179.416 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 19.9 m120 -62.0 -15.53 44.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.557 -0.292 . . . . 2.48 111.37 -179.777 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . 0.407 ' C ' ' H ' ' A' ' 61' ' ' GLY . 14.4 m120 -123.24 1.28 9.09 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.436 -0.347 . . . . 2.0499999999999998 110.972 179.861 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 12.5 m120 73.24 -31.24 0.22 Allowed 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.99 -0.55 . . . . 1.47 111.766 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . 0.407 ' H ' ' C ' ' A' ' 59' ' ' ASN . . . 140.5 15.5 0.49 Allowed Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.553 -0.832 . . . . 0.42999999999999999 112.738 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.503 HE22 ' C ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -138.66 151.49 47.24 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.077 0.465 . . . . 0.38 111.195 179.825 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.711 ' HB2' HG13 ' A' ' 27' ' ' ILE . 6.3 mp -119.12 150.02 40.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.627 -0.715 . . . . 1.4299999999999999 110.685 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . 0.446 ' H ' ' HB2' ' A' ' 67' ' ' GLU . 50.0 m-80 -113.94 157.67 22.12 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.961 -0.385 . . . . 1.1899999999999999 109.961 178.876 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.544 ' O ' ' HB2' ' A' ' 69' ' ' CYS . 85.3 t80 -43.68 -35.32 1.76 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.881 0.372 . . . . 0.40000000000000002 110.411 179.147 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -77.08 -37.84 53.64 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.994 -0.548 . . . . 0.81000000000000005 111.748 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.446 ' HB2' ' H ' ' A' ' 64' ' ' ASN . 10.2 mm-40 -59.64 -49.4 77.88 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.144 0.497 . . . . 1.3600000000000001 110.016 179.486 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.487 ' HE2' ' HB2' ' A' ' 12' ' ' PHE . 28.5 t80 -69.08 -52.85 24.2 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.548 -0.751 . . . . 0.51000000000000001 111.087 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.552 ' SG ' HD13 ' A' ' 4' ' ' LEU . 1.4 t -52.44 -45.02 65.82 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 121.002 0.43 . . . . 0.75 110.311 179.788 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . 0.422 ' O ' ' HB3' ' A' ' 73' ' ' ALA . . . -54.26 -50.85 54.46 Favored Glycine 0 N--CA 1.451 -0.32 0 CA-C-N 115.644 -0.707 . . . . 0.40999999999999998 112.046 179.766 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.454 HG23 ' HE3' ' A' ' 74' ' ' LYS . 11.7 mt -62.54 -40.57 88.72 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.375 0 CA-C-O 120.973 0.416 . . . . 0.51000000000000001 110.523 179.296 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . 0.514 ' HA ' HE21 ' A' ' 75' ' ' GLN . 3.6 mtp -58.92 -22.72 60.29 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.784 -0.644 . . . . 1.01 109.998 179.43 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.422 ' HB3' ' O ' ' A' ' 70' ' ' GLY . . . -74.89 -52.23 11.82 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.03 -0.532 . . . . 0.69999999999999996 109.969 178.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.454 ' HE3' HG23 ' A' ' 71' ' ' ILE . 61.2 pttt -67.05 -24.25 65.97 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 121.08 0.467 . . . . 1.3799999999999999 110.07 179.164 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . 0.514 HE21 ' HA ' ' A' ' 72' ' ' MET . 7.7 tt0 -78.08 -49.72 13.41 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.756 -0.657 . . . . 1.98 110.593 178.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . 0.469 ' SD ' HD23 ' A' ' 4' ' ' LEU . 38.9 mtt . . . . . 0 N--CA 1.449 -0.497 0 CA-C-N 115.82 -0.627 . . . . 1.2 110.84 179.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.596 ' O ' ' HG2' ' A' ' 85' ' ' MET . 91.9 m . . . . . 0 N--CA 1.46 0.07 0 CA-C-O 120.825 0.345 . . . . 7.29 110.477 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.435 ' HB3' ' OH ' ' A' ' 138' ' ' TYR . 32.3 mt-10 -59.27 -14.88 12.68 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 113.034 0.753 . . . . 9.7400000000000002 113.034 -178.507 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -64.61 -56.71 12.14 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 120.821 0.344 . . . . 12.109999999999999 111.66 -179.259 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -67.43 -16.55 64.29 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.134 0.492 . . . . 10.869999999999999 110.381 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' MET . . . . . 0.596 ' HG2' ' O ' ' A' ' 81' ' ' THR . 7.1 mmm -80.36 -34.96 36.09 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.646 -0.706 . . . . 11.09 109.768 -179.702 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 17.8 ttm180 -65.82 -42.6 90.42 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.643 -0.708 . . . . 15.52 109.512 179.039 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.425 ' HA ' ' HE3' ' A' ' 90' ' ' LYS . 1.9 tm-20 -59.87 -47.43 85.77 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 109.272 -0.64 . . . . 14.85 109.272 178.62 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.79 -26.08 68.19 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.59 -0.732 . . . . 14.109999999999999 110.553 179.155 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -69.77 -38.22 76.65 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.203 -0.453 . . . . 15.73 110.229 179.481 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . 0.425 ' HE3' ' HA ' ' A' ' 87' ' ' GLU . 9.6 mtmp? -63.09 -48.79 77.09 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.929 -0.578 . . . . 17.66 110.416 179.57 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 84.1 mt -61.21 -46.25 96.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.179 -0.464 . . . . 18.149999999999999 110.882 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.671 ' HA ' HG21 ' A' ' 108' ' ' VAL . 0.9 OUTLIER -60.43 -39.91 89.16 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.147 -0.478 . . . . 18.34 111.132 -179.871 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 36.7 t0 -72.83 95.54 1.95 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.943 0.401 . . . . 19.289999999999999 110.0 179.425 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.444 ' HG3' ' HA ' ' A' ' 104' ' ' GLU . 0.6 OUTLIER -56.75 -16.25 6.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.754 -0.657 . . . . 22.25 111.177 -179.366 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.447 ' HB2' ' OD1' ' A' ' 97' ' ' ASP . 24.2 m-20 -118.14 169.43 9.69 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.94 0.4 . . . . 23.34 110.859 179.73 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.27 5.4 57.45 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.869 -0.681 . . . . 22.0 112.342 179.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.447 ' OD1' ' HB2' ' A' ' 95' ' ' ASP . 5.7 p-10 -62.0 -41.69 98.33 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.716 0.293 . . . . 22.280000000000001 111.147 -179.758 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 117.69 10.94 8.9 Favored Glycine 0 C--N 1.332 0.335 0 C-N-CA 120.717 -0.754 . . . . 19.93 112.767 179.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -137.87 150.84 47.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.786 0.327 . . . . 20.300000000000001 110.948 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 46.6 mt -114.81 139.44 40.97 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.141 0 CA-C-N 116.253 -0.43 . . . . 19.370000000000001 111.315 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 74.2 m -114.53 156.24 44.9 Favored Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 115.894 -0.594 . . . . 22.489999999999998 110.045 179.512 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_exo -44.16 -36.3 8.71 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.304 2.003 . . . . 23.0 112.846 -179.43 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.63 -39.72 88.41 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.223 0.535 . . . . 24.559999999999999 110.884 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . 0.491 ' O ' HG23 ' A' ' 108' ' ' VAL . 42.1 mt-10 -74.51 -44.65 50.31 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.409 -0.814 . . . . 22.23 110.202 -179.847 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.501 HD23 ' HE1' ' A' ' 109' ' ' MET . 2.8 tp -54.32 -51.66 63.98 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.232 -0.894 . . . . 20.359999999999999 110.246 179.733 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.443 ' HA ' ' HE3' ' A' ' 109' ' ' MET . 10.7 ttt85 -57.07 -55.24 37.32 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.337 -0.847 . . . . 27.190000000000001 111.633 -179.749 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 36.0 t80 -46.11 -44.35 15.6 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.102 -0.499 . . . . 25.359999999999999 112.32 -178.753 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.671 HG21 ' HA ' ' A' ' 92' ' ' PHE . 23.0 t -69.62 -54.55 18.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 N-CA-C 112.235 0.457 . . . . 21.059999999999999 112.235 -178.706 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.501 ' HE1' HD23 ' A' ' 105' ' ' LEU . 62.3 mtm -52.51 -37.38 57.31 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 120.886 0.374 . . . . 20.93 110.531 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 72.5 mt -64.88 -36.47 77.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.987 -0.552 . . . . 25.129999999999999 110.162 178.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 14.4 m120 -67.31 -34.92 78.39 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.844 -0.616 . . . . 23.32 110.504 179.448 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 69.5 mt -72.0 -40.83 68.24 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.875 -0.602 . . . . 21.07 110.825 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 129.51 -3.48 6.18 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.759 -0.734 . . . . 23.050000000000001 112.557 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -86.94 93.92 9.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.679 0.276 . . . . 22.59 110.984 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -64.7 119.34 10.38 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.274 -0.421 . . . . 27.960000000000001 110.635 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 4.8 m -137.89 154.9 29.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.992 -0.549 . . . . 24.75 111.398 -179.638 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 71.3 p -98.12 147.37 24.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.804 -0.634 . . . . 27.239999999999998 110.576 179.463 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . 0.427 ' HA ' HG12 ' A' ' 121' ' ' ILE . 21.3 m-20 -53.7 -21.42 7.04 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.23 -0.441 . . . . 26.629999999999999 111.065 -179.908 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -80.5 -50.41 10.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.257 -0.429 . . . . 29.140000000000001 111.106 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.3 -33.62 75.91 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.265 -0.425 . . . . 24.190000000000001 111.121 -179.483 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.453 HG13 ' N ' ' A' ' 122' ' ' ASP . 32.6 pt -79.17 -35.08 16.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.399 -0.364 . . . . 22.329999999999998 110.946 -179.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . 0.453 ' N ' HG13 ' A' ' 121' ' ' ILE . 14.8 t70 -62.13 -32.0 72.54 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.041 0.448 . . . . 24.289999999999999 109.827 179.307 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -72.79 -47.08 49.61 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.763 -0.653 . . . . 24.739999999999998 110.203 179.278 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 49.3 ttp -55.62 -40.13 71.7 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.977 -0.556 . . . . 19.710000000000001 110.526 179.375 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.494 HD11 HD22 ' A' ' 105' ' ' LEU . 85.7 mt -65.89 -41.85 90.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.089 -0.505 . . . . 19.949999999999999 110.27 179.33 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 56.1 ttt180 -59.76 -31.96 70.14 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.697 -0.683 . . . . 24.949999999999999 110.826 179.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -77.79 -28.18 50.39 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.142 -0.481 . . . . 18.690000000000001 111.101 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.639 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -92.7 -14.13 28.44 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.17 -0.468 . . . . 16.469999999999999 111.029 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . 0.447 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 30.0 t70 -100.86 106.64 18.03 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.045 -0.525 . . . . 20.399999999999999 110.613 -179.798 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 74.1 m-85 -93.4 -41.83 9.61 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.739 -0.664 . . . . 21.43 111.499 -179.351 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -56.19 -26.17 49.82 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.417 -0.356 . . . . 23.370000000000001 111.021 -179.76 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 76.26 62.85 2.5 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.879 -0.677 . . . . 24.32 112.432 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . 0.4 ' OD2' ' HB2' ' A' ' 135' ' ' MET . 3.3 p-10 -130.35 -0.73 4.51 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.69 0.281 . . . . 23.879999999999999 111.258 -179.697 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 66.98 18.2 68.54 Favored Glycine 0 C--N 1.33 0.245 0 C-N-CA 120.814 -0.708 . . . . 22.670000000000002 112.731 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' MET . . . . . 0.4 ' HB2' ' OD2' ' A' ' 133' ' ' ASP . 68.4 mtp -134.3 155.36 50.35 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 110.183 -0.303 . . . . 22.91 110.183 179.857 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.696 HG23 ' HB2' ' A' ' 140' ' ' GLU . 47.5 mm -114.12 145.59 19.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 121.497 0.665 . . . . 18.41 112.119 -179.089 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . 0.567 HD22 ' H ' ' A' ' 139' ' ' GLU . 6.5 t30 -118.64 158.41 25.53 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 114.901 -1.045 . . . . 16.82 108.922 178.508 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.576 ' O ' HG23 ' A' ' 142' ' ' VAL . 8.2 t80 -38.72 -26.6 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 112.009 0.374 . . . . 14.65 112.009 -179.664 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . 0.567 ' H ' HD22 ' A' ' 137' ' ' ASN . 45.4 mt-10 -80.68 -55.85 4.55 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.774 0.321 . . . . 14.82 111.097 -179.546 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.696 ' HB2' HG23 ' A' ' 136' ' ' ILE . 27.5 mt-10 -60.87 -24.41 65.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.164 0.507 . . . . 17.460000000000001 110.214 179.712 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.594 ' HA ' ' HE2' ' A' ' 144' ' ' MET . 86.6 t80 -74.0 -55.56 5.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.556 -0.747 . . . . 12.93 110.527 179.857 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.576 HG23 ' O ' ' A' ' 138' ' ' TYR . 42.9 t -48.63 -37.0 7.9 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 CA-C-N 115.9 -0.591 . . . . 10.699999999999999 111.417 179.499 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 76.8 t90 -70.57 -55.0 9.87 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.265 0.469 . . . . 13.66 112.265 -179.165 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . 0.639 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 24.6 ptt? -65.13 -22.22 66.9 Favored 'General case' 0 N--CA 1.464 0.274 0 N-CA-C 113.339 0.866 . . . . 14.5 113.339 -177.611 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 145' ' ' ILE . . . . . 0.642 ' HA ' ' HB2' ' A' ' 148' ' ' LYS . 39.6 pt -80.55 -44.6 21.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 C-N-CA 120.751 -0.38 . . . . 11.25 111.833 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 146' ' ' SER . . . . . 0.538 ' N ' HG13 ' A' ' 145' ' ' ILE . 78.7 p -64.29 -14.19 54.41 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-O 121.448 0.642 . . . . 8.5399999999999991 109.59 179.629 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 8.0 mm-40 -125.35 19.93 8.11 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 114.967 -1.015 . . . . 11.869999999999999 110.245 -179.417 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . 0.642 ' HB2' ' HA ' ' A' ' 145' ' ' ILE . 16.5 ttpp . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.267 -0.873 . . . . 13.68 111.069 -179.451 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 65.2 mt . . . . . 0 CA--C 1.528 0.129 0 CA-C-O 120.767 0.318 . . . . 1.27 110.898 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.402 HG21 ' HB3' ' A' ' 147' ' ' GLN . 67.6 p -87.01 -165.55 1.32 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.242 -0.435 . . . . 1.1200000000000001 111.15 -179.92 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -73.78 -39.78 63.92 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.991 0.424 . . . . 2.2000000000000002 110.762 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -74.46 -41.13 61.32 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.827 -0.624 . . . . 1.3500000000000001 110.813 -179.665 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 -63.74 -49.39 73.2 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.164 -0.471 . . . . 2.2200000000000002 110.79 179.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.538 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 63.8 mt -55.95 -52.44 49.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.445 -0.343 . . . . 0.54000000000000004 110.882 179.76 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.86 -21.54 66.82 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.38 -0.373 . . . . 0.5 111.371 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -71.23 -56.75 5.41 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 116.441 -0.345 . . . . 2.27 111.923 -179.181 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.538 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 17.9 p90 -78.51 -26.11 45.81 Favored 'General case' 0 C--N 1.332 -0.154 0 C-N-CA 120.579 -0.448 . . . . 0.37 110.931 -179.666 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 49.9 tptt -66.15 -34.95 79.22 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.348 -0.612 . . . . 1.23 109.348 178.769 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.449 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 24.8 t70 -68.83 -50.94 45.84 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.349 -0.612 . . . . 0.44 109.349 178.489 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.58 -14.3 57.1 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.823 -0.626 . . . . 0.28999999999999998 110.445 178.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -80.09 -44.38 20.1 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.816 -0.629 . . . . 0.47999999999999998 111.016 -179.442 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.417 HG22 ' O ' ' A' ' 14' ' ' ASP . 34.2 m -73.45 -22.75 19.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.336 -0.393 . . . . 1.1100000000000001 111.021 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.449 ' HG2' ' O ' ' A' ' 14' ' ' ASP . 82.5 mm-40 -63.21 -34.16 77.05 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.137 -0.483 . . . . 1.6000000000000001 111.201 179.74 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 46.9 m-85 -86.95 -13.38 44.79 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.473 -0.331 . . . . 0.64000000000000001 111.579 -179.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -90.35 87.62 6.88 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.832 0.349 . . . . 0.44 110.596 179.777 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 70.4 mmtt -95.0 -19.78 19.91 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.078 -0.51 . . . . 2.1000000000000001 111.292 -179.605 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -78.59 -42.29 29.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.252 -0.431 . . . . 1.8 111.204 -179.669 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.95 3.94 29.77 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.649 -0.786 . . . . 0.46000000000000002 112.735 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 49.4 p -73.06 1.09 9.69 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.628 0.251 . . . . 0.40000000000000002 111.216 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 61.6 23.73 63.24 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.503 -0.856 . . . . 0.33000000000000002 111.679 -179.369 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.661 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 28.9 mtpt -133.83 155.76 49.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.817 0.341 . . . . 1.1000000000000001 111.065 -179.748 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.56 HG13 ' HB3' ' A' ' 63' ' ' LEU . 23.3 pt -117.41 131.77 69.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.108 -0.496 . . . . 0.5 111.714 -179.257 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -54.97 130.46 41.63 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.27 -0.423 . . . . 0.29999999999999999 110.974 179.599 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 81.5 p -62.68 -22.46 66.49 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.154 -0.475 . . . . 1.03 111.13 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 52.6 mtp180 -73.25 -18.03 61.27 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.087 -0.506 . . . . 3.0800000000000001 110.41 179.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -102.6 0.85 33.95 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.75 -0.659 . . . . 2.2599999999999998 110.595 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.488 HD23 HD22 ' A' ' 63' ' ' LEU . 0.5 OUTLIER -60.07 -52.44 65.36 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.939 -0.573 . . . . 1.3700000000000001 110.646 -179.818 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -54.12 -39.54 64.04 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.628 -0.796 . . . . 0.32000000000000001 111.799 179.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.408 ' O ' HG22 ' A' ' 38' ' ' THR . 60.7 m -70.04 -28.11 65.21 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.021 0.439 . . . . 0.31 110.559 179.462 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 52.4 tp -72.23 -34.41 68.3 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.66 -0.7 . . . . 1.24 111.526 -179.324 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.434 ' SD ' ' HG3' ' A' ' 43' ' ' PRO . 26.7 mtp -80.4 -29.02 37.73 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.439 -0.346 . . . . 1.1000000000000001 110.8 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 76.3 mtp180 -68.21 -41.86 80.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.269 -0.423 . . . . 2.6899999999999999 110.466 179.557 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.426 HG23 ' CD1' ' A' ' 39' ' ' LEU . 1.8 t -66.13 -13.07 59.54 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.153 -0.476 . . . . 1.0600000000000001 111.006 179.51 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.426 ' CD1' HG23 ' A' ' 38' ' ' THR . 10.5 mp -113.12 156.06 23.84 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.982 -0.553 . . . . 1.26 110.553 179.574 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -42.32 -33.48 1.38 Allowed Glycine 0 CA--C 1.52 0.378 0 C-N-CA 121.305 -0.474 . . . . 0.68999999999999995 113.817 -179.173 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 24.8 mp0 -52.52 143.7 15.06 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.883 0.373 . . . . 1.97 111.282 -179.544 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -133.43 72.75 74.45 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 115.886 -0.597 . . . . 2.6600000000000001 110.869 179.706 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.434 ' HG3' ' SD ' ' A' ' 36' ' ' MET . 28.0 Cg_endo -60.54 150.08 83.43 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.814 2.343 . . . . 0.51000000000000001 112.482 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.414 HG22 ' N ' ' A' ' 45' ' ' GLU . 9.3 m -78.61 159.92 27.83 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.191 -0.458 . . . . 0.72999999999999998 110.456 179.662 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.414 ' N ' HG22 ' A' ' 44' ' ' THR . 39.7 tt0 -59.52 -55.23 37.17 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.768 0.318 . . . . 2.7000000000000002 111.242 -179.741 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.0 -49.18 77.08 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.303 -0.408 . . . . 0.46000000000000002 111.459 -179.725 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.496 ' O ' HD23 ' A' ' 51' ' ' LEU . 42.2 tt0 -55.06 -43.95 74.31 Favored 'General case' 0 CA--C 1.518 -0.25 0 CA-C-N 116.322 -0.399 . . . . 2.23 110.086 -179.798 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.425 ' HA ' HD21 ' A' ' 51' ' ' LEU . 55.9 tp -56.55 -44.78 81.25 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.577 -0.738 . . . . 1.3600000000000001 110.806 179.765 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -70.59 -25.55 63.12 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.081 -0.509 . . . . 1.22 111.251 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -68.6 -51.54 41.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.539 -0.3 . . . . 0.62 111.39 179.904 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.496 HD23 ' O ' ' A' ' 47' ' ' GLU . 0.9 OUTLIER -70.64 -36.14 73.25 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.502 -0.317 . . . . 0.39000000000000001 111.363 -179.643 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.401 HD12 ' HG ' ' A' ' 48' ' ' LEU . 75.8 mt -65.68 -46.03 90.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.459 -0.337 . . . . 0.5 111.033 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.56 -34.45 78.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.393 -0.367 . . . . 0.58999999999999997 110.882 179.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -65.12 -47.12 78.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.136 -0.484 . . . . 2.54 110.691 179.778 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -79.0 -14.62 59.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.139 -0.482 . . . . 0.53000000000000003 111.383 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -71.33 -37.47 71.72 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.265 -0.425 . . . . 1.95 111.391 -179.556 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 30.5 p-10 -106.91 10.73 30.47 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.503 -0.317 . . . . 2.48 111.654 -179.372 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 24.0 t-20 -125.87 -11.99 6.54 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.91 0.386 . . . . 2.48 110.939 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -138.42 18.8 2.74 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.089 -0.505 . . . . 2.0499999999999998 110.599 179.764 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 21.6 m-80 64.6 -80.26 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 115.672 -0.694 . . . . 1.47 111.544 179.666 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -153.93 4.1 0.29 Allowed Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.502 -0.856 . . . . 0.42999999999999999 112.681 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.661 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -118.46 155.3 31.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.011 0.434 . . . . 0.38 111.271 179.88 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.658 ' HG ' ' HB2' ' A' ' 67' ' ' GLU . 2.4 tp -126.64 155.21 42.92 Favored 'General case' 0 C--O 1.223 -0.304 0 CA-C-N 115.778 -0.647 . . . . 1.4299999999999999 110.554 -179.389 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . 0.477 ' OD1' ' HE3' ' A' ' 26' ' ' LYS . 0.7 OUTLIER -110.43 155.58 22.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.893 0.377 . . . . 1.1899999999999999 111.3 -179.113 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 82.0 t80 -44.93 -46.07 10.79 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.618 -0.719 . . . . 0.40000000000000002 111.424 179.869 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -64.3 -33.89 76.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.433 -0.349 . . . . 0.81000000000000005 111.926 -179.594 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.658 ' HB2' ' HG ' ' A' ' 63' ' ' LEU . 12.3 mm-40 -63.18 -55.84 21.73 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.778 0.323 . . . . 1.3600000000000001 110.446 179.901 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.466 ' HE2' ' HB2' ' A' ' 12' ' ' PHE . 41.6 t80 -59.93 -49.36 77.99 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.262 -0.426 . . . . 0.51000000000000001 110.337 179.142 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 1.7 t -53.22 -45.25 68.61 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.131 -0.486 . . . . 0.75 110.305 179.548 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -51.5 -47.14 52.24 Favored Glycine 0 N--CA 1.448 -0.512 0 N-CA-C 111.103 -0.799 . . . . 0.40999999999999998 111.103 179.135 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.528 HG23 ' HE3' ' A' ' 74' ' ' LYS . 14.1 mt -63.96 -40.99 91.05 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.45 0 CA-C-O 120.851 0.358 . . . . 0.51000000000000001 110.664 179.104 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . 0.431 ' HG2' ' O ' ' A' ' 68' ' ' PHE . 95.3 mmm -51.82 -41.76 61.99 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.986 -0.552 . . . . 1.01 109.659 179.346 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.84 -55.35 35.26 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.561 -0.745 . . . . 0.69999999999999996 110.938 179.12 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.528 ' HE3' HG23 ' A' ' 71' ' ' ILE . 21.8 pttp -64.15 -25.95 68.31 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.422 -0.354 . . . . 1.3799999999999999 111.715 -179.411 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -81.92 -33.7 30.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.352 0.596 . . . . 1.98 110.55 -179.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . 0.404 ' HG3' ' O ' ' A' ' 72' ' ' MET . 54.7 mtt . . . . . 0 C--N 1.325 -0.479 0 CA-C-N 115.055 -0.975 . . . . 1.2 111.053 -179.614 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.588 ' O ' ' HG2' ' A' ' 85' ' ' MET . 52.7 m . . . . . 0 N--CA 1.46 0.075 0 N-CA-C 110.374 -0.232 . . . . 7.29 110.374 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -68.44 -25.12 64.85 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 112.857 0.688 . . . . 9.7400000000000002 112.857 -178.478 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 -54.35 -55.79 25.03 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 111.957 0.354 . . . . 12.109999999999999 111.957 -178.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -63.97 -20.82 66.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.949 0.404 . . . . 10.869999999999999 111.065 -179.743 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' MET . . . . . 0.632 ' HB3' HD11 ' A' ' 145' ' ' ILE . 4.7 mmm -79.89 -25.67 40.54 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.07 -0.514 . . . . 11.09 110.175 -179.336 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 29.2 ttt180 -74.19 -50.09 20.72 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.517 -0.765 . . . . 15.52 109.754 179.619 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -59.86 -36.45 76.9 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.826 -0.624 . . . . 14.85 109.512 178.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -72.16 -35.5 69.05 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-N 115.663 -0.698 . . . . 14.109999999999999 110.897 179.249 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -67.76 -20.57 65.24 Favored 'General case' 0 CA--C 1.52 -0.183 0 CA-C-O 121.326 0.584 . . . . 15.73 110.093 179.49 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 15.6 tttt -79.91 -47.13 15.55 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 115.298 -0.865 . . . . 17.66 110.169 179.775 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 73.7 mt -64.29 -43.47 97.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.496 -0.775 . . . . 18.149999999999999 111.111 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.536 ' HD1' HG11 ' A' ' 108' ' ' VAL . 5.5 m-85 -66.82 -52.66 41.13 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.271 -0.422 . . . . 18.34 111.025 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -59.63 99.83 0.07 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.303 -0.408 . . . . 19.289999999999999 110.386 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.522 ' HG2' ' HB3' ' A' ' 104' ' ' GLU . 22.4 mmm180 -53.04 -37.2 61.37 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.859 -0.61 . . . . 22.25 111.316 -179.393 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -107.84 -176.73 3.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.9 0.381 . . . . 23.34 111.09 -179.697 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.77 4.26 56.25 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.944 -0.646 . . . . 22.0 112.631 179.754 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -63.66 -31.25 72.37 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.64 0.257 . . . . 22.280000000000001 111.29 -179.761 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 92.89 35.18 6.49 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.791 -0.718 . . . . 19.93 112.83 179.771 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . 0.425 ' HA ' ' O ' ' A' ' 136' ' ' ILE . 96.6 m-85 -147.54 142.27 26.7 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.638 0.256 . . . . 20.300000000000001 110.811 179.857 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 59.6 mt -114.35 125.83 71.74 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.162 0 CA-C-O 121.054 0.454 . . . . 19.370000000000001 110.998 179.672 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 23.5 p -114.48 156.07 45.07 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 115.793 -0.639 . . . . 22.489999999999998 110.626 -179.843 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_exo -39.95 -35.61 1.16 Allowed 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.608 2.206 . . . . 23.0 112.681 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.07 -53.43 25.63 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.254 -0.43 . . . . 24.559999999999999 110.973 179.782 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . 0.522 ' HB3' ' HG2' ' A' ' 94' ' ' ARG . 46.8 mt-10 -62.29 -38.78 90.66 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.872 -0.604 . . . . 22.23 110.55 179.87 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.54 HD23 ' HB ' ' A' ' 121' ' ' ILE . 39.9 tp -64.48 -35.6 81.47 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.541 -0.754 . . . . 20.359999999999999 110.869 -179.892 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 10.4 ttp180 -63.97 -52.53 59.25 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.343 -0.389 . . . . 27.190000000000001 110.858 179.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 35.7 t80 -54.27 -47.92 71.79 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.088 -0.506 . . . . 25.359999999999999 111.563 -179.407 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.536 HG11 ' HD1' ' A' ' 92' ' ' PHE . 7.7 p -70.77 -46.98 66.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 N-CA-C 112.144 0.424 . . . . 21.059999999999999 112.144 -179.14 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.516 ' N ' HG13 ' A' ' 108' ' ' VAL . 0.4 OUTLIER -57.2 -20.68 28.37 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 111.728 0.27 . . . . 20.93 111.728 -179.018 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.589 ' HA ' ' HA ' ' A' ' 114' ' ' GLU . 83.0 mt -82.67 -28.71 8.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 120.943 0.402 . . . . 25.129999999999999 110.353 178.915 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -73.87 -36.21 64.79 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.103 -0.499 . . . . 23.32 109.904 178.765 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.47 HD13 HG22 ' A' ' 108' ' ' VAL . 7.0 mp -85.85 -41.69 14.78 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.648 -0.705 . . . . 21.07 109.762 179.223 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -148.93 80.83 0.2 Allowed Glycine 0 C--N 1.33 0.235 0 CA-C-N 115.33 -0.85 . . . . 23.050000000000001 111.769 179.498 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . 0.589 ' HA ' ' HA ' ' A' ' 110' ' ' ILE . 0.0 OUTLIER -48.14 160.48 0.15 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.064 0.459 . . . . 22.59 112.136 -179.356 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 23.6 ttmm 70.67 62.97 0.19 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.238 -0.892 . . . . 27.960000000000001 111.858 179.488 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . 0.495 HG12 ' OE1' ' A' ' 120' ' ' GLU . 1.6 m -125.81 114.73 40.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.165 -0.47 . . . . 24.75 110.625 178.286 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 72.7 p -67.51 147.42 52.84 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.295 -0.411 . . . . 27.239999999999998 110.419 179.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 28.8 m-20 -56.3 -14.73 3.09 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.208 -0.451 . . . . 26.629999999999999 110.581 179.804 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 0.4 ' O ' ' HG2' ' A' ' 123' ' ' GLU . 12.6 mm-40 -79.7 -55.17 5.2 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.032 -0.531 . . . . 29.140000000000001 111.249 -179.876 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . 0.495 ' OE1' HG12 ' A' ' 116' ' ' VAL . 14.0 pt-20 -58.57 -42.56 88.25 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.748 -0.205 . . . . 24.190000000000001 111.46 -179.576 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.54 ' HB ' HD23 ' A' ' 105' ' ' LEU . 2.7 pt -68.37 -42.92 84.5 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-O 120.643 0.259 . . . . 22.329999999999998 111.144 179.487 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . 0.513 ' H ' HG13 ' A' ' 121' ' ' ILE . 17.8 t70 -60.24 -40.42 90.17 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.826 0.346 . . . . 24.289999999999999 110.444 179.666 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . 0.4 ' HG2' ' O ' ' A' ' 119' ' ' GLU . 16.5 mm-40 -58.34 -46.05 86.96 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.002 -0.545 . . . . 24.739999999999998 110.201 179.382 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.42 ' HE1' HD11 ' A' ' 105' ' ' LEU . 58.9 ttp -55.54 -37.17 67.62 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.214 -0.448 . . . . 19.710000000000001 110.328 179.195 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.5 HG23 HD11 ' A' ' 136' ' ' ILE . 78.6 mt -65.92 -42.38 91.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.049 -0.523 . . . . 19.949999999999999 110.337 179.341 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 21.4 tpp180 -63.43 -25.26 68.19 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.806 -0.634 . . . . 24.949999999999999 111.042 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -78.53 -30.02 46.81 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.229 -0.441 . . . . 18.690000000000001 111.308 -179.535 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.709 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -99.73 -12.39 20.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.309 -0.405 . . . . 16.469999999999999 111.479 -179.689 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . 0.457 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 25.4 t0 -100.68 104.03 15.31 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.977 0.418 . . . . 20.399999999999999 110.906 -179.615 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 88.1 m-85 -82.79 -39.46 21.74 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.962 -0.563 . . . . 21.43 111.174 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -69.07 -13.35 62.39 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.381 -0.372 . . . . 23.370000000000001 111.007 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 47.63 82.38 0.03 OUTLIER Glycine 0 C--N 1.331 0.256 0 C-N-CA 121.19 -0.528 . . . . 24.32 113.212 179.629 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -133.22 -24.49 1.84 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.846 0.355 . . . . 23.879999999999999 110.617 179.579 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 105.84 10.62 30.16 Favored Glycine 0 C--N 1.332 0.321 0 C-N-CA 120.794 -0.717 . . . . 22.670000000000002 112.562 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 91.1 mmm -135.37 150.42 49.92 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.805 0.336 . . . . 22.91 110.756 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.587 HG23 ' HB2' ' A' ' 140' ' ' GLU . 46.9 mm -114.83 141.17 32.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.037 0.446 . . . . 18.41 111.486 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . 0.451 ' O ' ' N ' ' A' ' 139' ' ' GLU . 29.2 p-10 -114.78 157.51 23.13 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.002 -0.74 . . . . 16.82 109.002 178.405 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.566 ' O ' HG23 ' A' ' 142' ' ' VAL . 42.4 t80 -40.59 -21.51 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 111.97 0.359 . . . . 14.65 111.97 -179.754 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . 0.451 ' N ' ' O ' ' A' ' 137' ' ' ASN . 44.2 mt-10 -80.76 -56.76 3.92 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.786 0.327 . . . . 14.82 111.261 -179.615 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.587 ' HB2' HG23 ' A' ' 136' ' ' ILE . 45.5 mt-10 -61.16 -29.82 70.02 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 121.0 0.429 . . . . 17.460000000000001 110.102 179.93 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.562 ' CE2' HD13 ' A' ' 145' ' ' ILE . 83.9 t80 -67.09 -55.52 13.93 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.848 -0.614 . . . . 12.93 110.186 179.403 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.566 HG23 ' O ' ' A' ' 138' ' ' TYR . 42.9 t -51.42 -30.77 11.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.667 -0.697 . . . . 10.699999999999999 111.392 179.811 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 143' ' ' TRP . . . . . 0.495 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 90.3 t90 -70.65 -55.84 7.82 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.496 0.554 . . . . 13.66 112.496 -179.122 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . 0.709 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 18.8 ptt? -63.48 -28.79 70.2 Favored 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 113.272 0.842 . . . . 14.5 113.272 -177.771 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 145' ' ' ILE . . . . . 0.632 HD11 ' HB3' ' A' ' 85' ' ' MET . 42.8 pt -80.76 -35.9 15.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 112.383 0.512 . . . . 11.25 112.383 -179.304 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 146' ' ' SER . . . . . 0.493 ' N ' HG13 ' A' ' 145' ' ' ILE . 42.0 t -60.69 -14.12 18.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.198 0.523 . . . . 8.5399999999999991 110.432 -179.679 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 147' ' ' GLN . . . . . 0.495 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 4.0 mm-40 -101.04 -16.22 17.19 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.362 -0.835 . . . . 11.869999999999999 111.089 -179.053 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 65.1 mttm . . . . . 0 C--O 1.25 1.111 0 CA-C-O 118.296 -0.859 . . . . 13.68 110.829 179.685 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.5 mp . . . . . 0 C--O 1.232 0.149 0 CA-C-O 120.878 0.371 . . . . 1.27 110.961 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.52 ' H ' HE21 ' A' ' 8' ' ' GLN . 6.8 m -90.49 158.89 16.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.034 -0.53 . . . . 1.1200000000000001 110.565 179.853 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -47.34 -42.83 22.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.709 0.29 . . . . 2.2000000000000002 111.63 -179.651 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -73.32 -41.41 63.56 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.033 0.444 . . . . 1.3500000000000001 111.005 -179.476 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . 0.52 HE21 ' H ' ' A' ' 5' ' ' THR . 24.1 mt-30 -63.99 -40.43 96.36 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.833 -0.622 . . . . 2.2200000000000002 111.001 -179.879 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.496 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 89.2 mt -62.11 -50.79 78.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.117 -0.492 . . . . 0.54000000000000004 110.628 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.41 -24.81 67.6 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.001 -0.545 . . . . 0.5 111.366 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -69.91 -56.35 7.27 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.39 -0.368 . . . . 2.27 111.939 -179.033 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.496 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 10.5 p90 -78.4 -28.07 46.81 Favored 'General case' 0 C--N 1.332 -0.155 0 C-N-CA 120.603 -0.439 . . . . 0.37 111.009 -179.532 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 21.2 tptm -62.65 -35.62 80.2 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.153 -0.684 . . . . 1.23 109.153 178.669 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.472 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 33.1 t70 -69.44 -50.12 48.66 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 115.706 -0.679 . . . . 0.44 109.179 178.315 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.27 -17.67 54.63 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.68 -0.691 . . . . 0.28999999999999998 110.574 179.058 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -77.96 -48.21 16.78 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.003 -0.544 . . . . 0.47999999999999998 110.638 -179.495 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 23.3 m -70.32 -15.85 19.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.146 -0.479 . . . . 1.1100000000000001 110.532 179.648 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.472 ' HG3' ' O ' ' A' ' 14' ' ' ASP . 73.2 mt-30 -64.01 -44.53 92.3 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.787 -0.642 . . . . 1.6000000000000001 111.111 179.326 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -90.39 31.16 1.04 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.16 -0.473 . . . . 0.64000000000000001 111.71 -179.298 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -118.96 70.96 0.84 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.001 0.429 . . . . 0.44 110.4 179.284 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 33.7 mmtp -76.5 -17.63 59.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.866 -0.606 . . . . 2.1000000000000001 111.205 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -83.05 -10.94 58.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.212 -0.449 . . . . 1.8 110.907 -179.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 65.44 14.3 59.72 Favored Glycine 0 C--N 1.33 0.236 0 C-N-CA 120.869 -0.681 . . . . 0.46000000000000002 112.648 179.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 30.0 p -83.74 11.86 6.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.671 0.272 . . . . 0.40000000000000002 111.205 -179.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 56.22 18.88 22.3 Favored Glycine 0 C--N 1.332 0.361 0 C-N-CA 120.709 -0.758 . . . . 0.33000000000000002 111.596 -179.383 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.633 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 51.7 mtpt -135.43 155.26 50.84 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.501 -0.35 . . . . 1.1000000000000001 110.334 -179.488 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.421 ' N ' HE22 ' A' ' 62' ' ' GLN . 42.4 pt -120.9 140.65 44.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.871 0.367 . . . . 0.5 111.286 -179.799 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -57.97 135.95 57.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.153 -0.476 . . . . 0.29999999999999999 110.612 179.651 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.418 ' HA ' HD23 ' A' ' 63' ' ' LEU . 5.7 t -64.69 -8.56 15.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.19 -0.459 . . . . 1.03 110.994 179.808 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 43.5 mtt180 -89.76 -11.21 42.89 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.043 -0.526 . . . . 3.0800000000000001 110.851 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -107.57 -4.58 18.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.92 -0.582 . . . . 2.2599999999999998 110.908 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.647 HD23 HD21 ' A' ' 63' ' ' LEU . 1.4 tm? -57.72 -51.0 71.32 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.355 -0.384 . . . . 1.3700000000000001 110.311 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -53.59 -42.71 67.25 Favored Glycine 0 C--N 1.332 0.344 0 C-N-CA 120.617 -0.801 . . . . 0.32000000000000001 111.692 179.438 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 94.9 m -63.88 -36.07 82.73 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.226 0.536 . . . . 0.31 109.868 179.038 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 38.8 tp -65.94 -24.05 66.74 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.369 -0.832 . . . . 1.24 110.773 -179.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.462 ' HG2' ' O ' ' A' ' 32' ' ' LEU . 79.9 mmm -80.36 -37.87 31.53 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.252 -0.431 . . . . 1.1000000000000001 110.19 179.346 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 69.6 mtp180 -59.64 -44.34 93.53 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.942 -0.572 . . . . 2.6899999999999999 110.964 179.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.426 HG23 HD13 ' A' ' 39' ' ' LEU . 1.3 t -64.23 -13.52 49.61 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.235 -0.439 . . . . 1.0600000000000001 111.321 179.835 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.426 HD13 HG23 ' A' ' 38' ' ' THR . 10.8 mp -113.75 156.14 24.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.115 -0.493 . . . . 1.26 110.412 179.365 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -58.35 -5.69 2.67 Favored Glycine 0 CA--C 1.518 0.255 0 CA-C-N 116.014 -0.539 . . . . 0.68999999999999995 113.759 -178.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 15.9 mp0 -88.29 130.91 34.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 117.107 0.453 . . . . 1.97 110.972 179.746 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -131.88 87.05 46.06 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.092 -0.503 . . . . 2.6600000000000001 110.775 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -70.47 151.37 64.98 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 122.511 2.141 . . . . 0.51000000000000001 112.275 -179.839 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 27.4 m -64.35 150.06 46.99 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.22 -0.445 . . . . 0.72999999999999998 110.738 179.746 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -48.07 -54.51 12.86 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.562 -0.29 . . . . 2.7000000000000002 111.336 -179.631 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.57 -53.27 54.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.264 -0.426 . . . . 0.46000000000000002 111.745 -179.574 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -53.79 -46.03 70.9 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-O 120.938 0.399 . . . . 2.23 110.446 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.569 HD12 HD11 ' A' ' 51' ' ' LEU . 32.5 tp -57.27 -42.69 82.12 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.741 -0.663 . . . . 1.3600000000000001 110.71 179.837 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -68.46 -30.19 69.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.227 -0.442 . . . . 1.22 111.095 -179.8 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -68.45 -53.55 22.81 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.382 -0.372 . . . . 0.62 110.965 179.551 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.569 HD11 HD12 ' A' ' 48' ' ' LEU . 1.0 OUTLIER -65.38 -34.87 79.34 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.318 -0.401 . . . . 0.39000000000000001 110.979 179.931 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 34.9 mt -59.78 -44.73 94.58 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.134 0 CA-C-N 116.523 -0.308 . . . . 0.5 110.458 179.467 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.68 -32.47 73.81 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.236 -0.438 . . . . 0.58999999999999997 110.53 179.624 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -66.53 -46.04 77.48 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.007 -0.542 . . . . 2.54 110.178 179.352 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . 0.433 ' HB1' ' HB3' ' A' ' 63' ' ' LEU . . . -76.21 -20.76 57.17 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.014 -0.539 . . . . 0.53000000000000003 111.078 179.585 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -80.35 -31.74 37.89 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.277 -0.42 . . . . 1.95 110.985 -179.88 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -91.98 -12.95 31.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.053 -0.522 . . . . 2.48 110.763 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.492 HD22 ' C ' ' A' ' 58' ' ' ASN . 0.2 OUTLIER -81.2 -84.02 0.11 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.098 -0.501 . . . . 2.48 110.785 -179.852 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . 0.492 ' HB2' ' O ' ' A' ' 62' ' ' GLN . 15.7 m-80 -101.54 35.97 2.16 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.885 0.374 . . . . 2.0499999999999998 110.805 -179.914 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.8 m120 62.27 -132.82 0.55 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.883 -0.599 . . . . 1.47 111.116 179.62 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -78.71 29.65 2.04 Favored Glycine 0 C--N 1.334 0.419 0 C-N-CA 120.638 -0.791 . . . . 0.42999999999999999 112.526 -179.706 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.633 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -145.1 155.32 43.25 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.17 0.51 . . . . 0.38 111.338 179.829 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.647 HD21 HD23 ' A' ' 32' ' ' LEU . 2.1 pp -142.07 157.93 44.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.442 -0.799 . . . . 1.4299999999999999 109.084 179.529 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . 0.482 ' OD1' ' HE3' ' A' ' 26' ' ' LYS . 0.7 OUTLIER -110.23 157.37 19.51 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.74 -0.384 . . . . 1.1899999999999999 111.856 -177.411 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -39.28 -33.47 0.15 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.476 -0.784 . . . . 0.40000000000000002 111.846 -179.794 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 2.8 m -64.25 -43.9 93.47 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 111.663 0.245 . . . . 0.81000000000000005 111.663 -179.582 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.535 ' HB2' HD13 ' A' ' 63' ' ' LEU . 22.7 mm-40 -61.96 -55.14 32.49 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.853 0.359 . . . . 1.3600000000000001 110.958 179.818 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -59.39 -49.7 76.78 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.041 -0.527 . . . . 0.51000000000000001 111.376 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 6.3 t -61.14 -39.24 89.3 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-O 120.869 0.366 . . . . 0.75 110.692 -179.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . 0.528 ' O ' ' HB3' ' A' ' 73' ' ' ALA . . . -60.08 -42.86 98.65 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.648 -0.787 . . . . 0.40999999999999998 111.85 179.783 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.56 HD13 HD13 ' A' ' 51' ' ' LEU . 64.8 mt -63.59 -51.23 72.92 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.688 0 CA-C-O 121.657 0.742 . . . . 0.51000000000000001 109.294 177.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . 0.497 ' O ' ' HB2' ' A' ' 76' ' ' MET . 14.2 mtp -53.73 -29.63 40.36 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.027 -0.988 . . . . 1.01 108.729 178.375 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.528 ' HB3' ' O ' ' A' ' 70' ' ' GLY . . . -72.14 -35.39 69.06 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.12 -0.945 . . . . 0.69999999999999996 110.623 179.866 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.555 ' HG2' ' O ' ' A' ' 71' ' ' ILE . 0.1 OUTLIER -80.34 -32.83 37.75 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.338 -0.392 . . . . 1.3799999999999999 111.73 -179.724 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -82.71 -42.72 17.72 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.082 0.468 . . . . 1.98 111.195 -178.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . 0.497 ' HB2' ' O ' ' A' ' 72' ' ' MET . 80.7 mtp . . . . . 0 C--N 1.324 -0.522 0 CA-C-N 115.574 -0.739 . . . . 1.2 112.005 -179.299 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.509 ' O ' ' HG2' ' A' ' 85' ' ' MET . 3.9 t . . . . . 0 N--CA 1.468 0.432 0 CA-C-O 120.988 0.423 . . . . 7.29 111.298 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -47.32 -24.23 0.72 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.51 -0.768 . . . . 9.7400000000000002 112.3 -179.138 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -64.14 -55.28 22.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.753 0.311 . . . . 12.109999999999999 111.391 -179.78 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -64.03 -18.3 64.19 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.379 -0.373 . . . . 10.869999999999999 110.908 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' MET . . . . . 0.554 ' HB3' HD11 ' A' ' 145' ' ' ILE . 4.1 mmm -78.81 -48.03 15.55 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.104 -0.498 . . . . 11.09 110.059 -179.662 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 21.0 ttt180 -55.71 -39.0 70.45 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.517 -0.765 . . . . 15.52 110.134 179.272 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -65.2 -47.66 76.15 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.989 -0.551 . . . . 14.85 110.228 179.158 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -65.57 -24.26 67.05 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.057 -0.52 . . . . 14.109999999999999 111.332 179.781 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 86.7 t80 -73.83 -46.91 42.18 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.95 0.405 . . . . 15.73 110.852 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -60.65 -38.31 84.42 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.991 -0.549 . . . . 17.66 110.866 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 67.7 mt -70.98 -46.27 68.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.863 -0.608 . . . . 18.149999999999999 111.166 -179.631 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.514 ' HA ' HG21 ' A' ' 108' ' ' VAL . 0.7 OUTLIER -66.96 -26.67 66.94 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.382 -0.372 . . . . 18.34 111.099 -179.885 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 23.7 t0 -96.16 93.92 7.21 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.153 -0.476 . . . . 19.289999999999999 110.237 179.69 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -69.61 -11.46 60.85 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.083 -0.508 . . . . 22.25 111.354 -179.386 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 47.8 m-20 -101.71 167.75 9.9 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.341 -0.391 . . . . 23.34 110.94 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.07 5.18 57.66 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.842 -0.694 . . . . 22.0 112.072 179.513 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -70.84 -31.47 68.19 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.682 0.277 . . . . 22.280000000000001 111.267 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 92.37 27.25 15.81 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.686 -0.768 . . . . 19.93 112.519 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 90.1 m-85 -139.47 147.23 41.04 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.498 0.19 . . . . 20.300000000000001 110.632 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.466 ' HB ' ' HB ' ' A' ' 136' ' ' ILE . 71.1 mt -113.92 131.37 66.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 121.149 0.5 . . . . 19.370000000000001 111.223 179.789 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 79.4 p -114.02 157.8 41.09 Favored Pre-proline 0 C--N 1.326 -0.42 0 CA-C-N 115.509 -0.769 . . . . 22.489999999999998 110.049 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_exo -47.94 -31.55 15.9 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.068 1.845 . . . . 23.0 111.676 -179.658 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.57 -36.86 79.33 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.726 -0.67 . . . . 24.559999999999999 111.11 179.668 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . 0.431 ' O ' HG23 ' A' ' 108' ' ' VAL . 39.0 mt-10 -80.26 -36.68 34.23 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.938 -0.574 . . . . 22.23 109.889 -179.477 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.563 HD22 ' HB ' ' A' ' 121' ' ' ILE . 5.5 tt -62.12 -43.57 98.54 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.331 -0.85 . . . . 20.359999999999999 110.267 179.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.432 ' O ' HG13 ' A' ' 110' ' ' ILE . 61.1 ttt180 -65.59 -54.63 25.24 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.933 -0.576 . . . . 27.190000000000001 110.89 179.783 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 4.3 m-85 -49.38 -49.46 44.46 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.137 -0.483 . . . . 25.359999999999999 111.973 -179.454 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.514 HG21 ' HA ' ' A' ' 92' ' ' PHE . 83.6 t -64.46 -50.72 74.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.695 -0.23 . . . . 21.059999999999999 111.557 -179.475 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.464 ' HG3' HD23 ' A' ' 105' ' ' LEU . 0.3 OUTLIER -53.15 -39.22 63.38 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.741 0.305 . . . . 20.93 110.739 -179.951 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.432 HG13 ' O ' ' A' ' 106' ' ' ARG . 82.7 mt -70.74 -29.59 38.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 120.999 0.428 . . . . 25.129999999999999 110.28 179.329 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -71.13 -39.73 71.83 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.828 -0.624 . . . . 23.32 110.741 179.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.433 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 38.2 mt -65.33 -32.57 74.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.043 -0.526 . . . . 21.07 110.664 179.879 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 126.87 -11.98 6.92 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.828 -0.701 . . . . 23.050000000000001 112.271 -179.854 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -91.06 114.49 27.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.743 0.306 . . . . 22.59 111.127 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.43 ' HD3' ' N ' ' A' ' 115' ' ' LYS . 3.8 mppt? -84.08 125.65 32.32 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.225 -0.443 . . . . 27.960000000000001 110.779 179.848 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . 0.403 HG12 ' OE1' ' A' ' 120' ' ' GLU . 2.4 m -135.57 147.27 28.79 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.241 -0.436 . . . . 24.75 111.44 -179.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 82.2 p -87.99 147.24 25.11 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.935 -0.575 . . . . 27.239999999999998 110.198 179.105 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . 0.408 ' O ' ' HB2' ' A' ' 122' ' ' ASP . 8.1 m-20 -53.64 -19.93 4.63 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.259 -0.428 . . . . 26.629999999999999 111.576 -179.529 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 23.1 mm-40 -77.61 -55.69 5.15 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.01 0.374 . . . . 29.140000000000001 112.01 -179.264 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . 0.403 ' OE1' HG12 ' A' ' 116' ' ' VAL . 14.6 pt-20 -58.47 -41.69 85.82 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.636 0.255 . . . . 24.190000000000001 111.563 -179.306 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.563 ' HB ' HD22 ' A' ' 105' ' ' LEU . 45.7 pt -70.74 -33.59 53.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 C-N-CA 120.903 -0.319 . . . . 22.329999999999998 110.749 179.67 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . 0.408 ' HB2' ' O ' ' A' ' 118' ' ' ASP . 16.2 t70 -56.03 -50.98 69.41 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 120.768 0.318 . . . . 24.289999999999999 110.617 179.401 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.55 -43.35 99.02 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.204 -0.453 . . . . 24.739999999999998 110.736 179.797 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 51.0 ttp -54.66 -38.6 67.13 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.174 -0.466 . . . . 19.710000000000001 110.915 179.65 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.551 HG23 HD11 ' A' ' 136' ' ' ILE . 85.0 mt -68.47 -37.07 77.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.232 -0.44 . . . . 19.949999999999999 110.742 179.682 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 70.3 ttt180 -65.94 -30.08 70.59 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.155 -0.475 . . . . 24.949999999999999 110.637 179.677 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -74.67 -24.86 58.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.077 -0.511 . . . . 18.690000000000001 111.173 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.613 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -100.58 -13.63 18.52 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.183 -0.462 . . . . 16.469999999999999 111.118 179.855 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -97.14 105.31 17.43 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.052 -0.522 . . . . 20.399999999999999 110.931 -179.684 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 -97.96 -33.94 11.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.931 -0.577 . . . . 21.43 111.153 -179.651 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -66.02 -13.86 60.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.365 -0.38 . . . . 23.370000000000001 110.777 -179.835 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.13 85.31 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.834 -0.698 . . . . 24.32 112.521 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -153.8 -19.53 0.14 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.661 0.267 . . . . 23.879999999999999 111.475 -179.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 87.21 16.25 61.09 Favored Glycine 0 N--CA 1.453 -0.211 0 C-N-CA 120.67 -0.776 . . . . 22.670000000000002 112.6 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 70.3 mtp -132.72 155.54 48.65 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.625 0.25 . . . . 22.91 110.539 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.742 HG23 ' HB2' ' A' ' 140' ' ' GLU . 50.5 mm -114.61 138.65 44.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.367 0.604 . . . . 18.41 112.076 -179.238 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . 0.472 ' O ' ' N ' ' A' ' 139' ' ' GLU . 21.8 p30 -115.5 159.06 21.69 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.194 -0.912 . . . . 16.82 108.644 177.893 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.611 ' O ' HG23 ' A' ' 142' ' ' VAL . 47.0 t80 -38.21 -24.67 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 112.416 0.524 . . . . 14.65 112.416 -178.789 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . 0.472 ' N ' ' O ' ' A' ' 137' ' ' ASN . 47.2 mt-10 -80.44 -55.27 5.0 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.742 0.306 . . . . 14.82 111.19 -179.636 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.742 ' HB2' HG23 ' A' ' 136' ' ' ILE . 30.2 mt-10 -60.69 -28.4 68.6 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.319 -0.4 . . . . 17.460000000000001 110.738 -179.851 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.681 ' HA ' ' HE2' ' A' ' 144' ' ' MET . 86.5 t80 -72.46 -56.12 5.93 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.292 -0.413 . . . . 12.93 110.703 179.841 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.611 HG23 ' O ' ' A' ' 138' ' ' TYR . 50.3 t -48.32 -37.01 7.09 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 CA-C-N 115.939 -0.573 . . . . 10.699999999999999 111.589 179.478 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 143' ' ' TRP . . . . . 0.522 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 92.7 t90 -71.11 -55.58 7.91 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.296 0.48 . . . . 13.66 112.296 -178.872 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . 0.681 ' HE2' ' HA ' ' A' ' 141' ' ' PHE . 22.8 ptt? -63.11 -24.38 67.87 Favored 'General case' 0 N--CA 1.464 0.237 0 N-CA-C 112.957 0.725 . . . . 14.5 112.957 -177.808 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 145' ' ' ILE . . . . . 0.554 HD11 ' HB3' ' A' ' 85' ' ' MET . 48.6 pt -80.73 -40.48 19.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 N-CA-C 112.182 0.438 . . . . 11.25 112.182 -179.513 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 146' ' ' SER . . . . . 0.521 ' N ' HG13 ' A' ' 145' ' ' ILE . 86.4 p -59.38 -13.61 9.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.275 0.559 . . . . 8.5399999999999991 110.436 -179.759 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 147' ' ' GLN . . . . . 0.522 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 4.4 mm-40 -105.34 26.71 9.08 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.304 -0.862 . . . . 11.869999999999999 111.529 -178.692 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 9.6 mtmp? . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.158 -0.925 . . . . 13.68 110.721 179.593 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 20.1 mt . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.851 0.358 . . . . 1.27 110.806 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 6.2 m -84.0 158.99 21.31 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.139 -0.482 . . . . 1.1200000000000001 110.801 -179.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -47.63 -30.84 4.0 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 111.818 0.303 . . . . 2.2000000000000002 111.818 -179.624 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.413 ' HG3' ' N ' ' A' ' 8' ' ' GLN . 11.0 pt-20 -76.58 -51.29 11.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.947 0.403 . . . . 1.3500000000000001 110.916 -179.567 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . 0.413 ' N ' ' HG3' ' A' ' 7' ' ' GLU . 26.1 mt-30 -63.18 -36.08 82.44 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.025 -0.534 . . . . 2.2200000000000002 110.682 179.924 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.559 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 97.1 mt -62.68 -52.09 63.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.959 -0.564 . . . . 0.54000000000000004 110.65 179.859 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.25 -26.48 67.78 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.888 -0.596 . . . . 0.5 111.4 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -69.61 -56.93 5.91 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 111.889 0.329 . . . . 2.27 111.889 -179.161 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.559 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 4.1 p90 -76.47 -23.6 53.83 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 120.54 -0.464 . . . . 0.37 110.92 -179.557 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.442 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 18.1 tptm -66.33 -35.59 80.76 Favored 'General case' 0 C--N 1.332 -0.163 0 N-CA-C 109.145 -0.687 . . . . 1.23 109.145 178.911 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.44 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 23.5 t70 -68.03 -49.82 59.1 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 108.777 -0.823 . . . . 0.44 108.777 177.995 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.28 -13.95 52.82 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.303 -0.862 . . . . 0.28999999999999998 110.453 178.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.519 ' HA ' HD11 ' A' ' 35' ' ' LEU . 83.4 t80 -79.65 -48.9 12.96 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.842 -0.617 . . . . 0.47999999999999998 110.823 -179.629 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 19.7 m -67.89 -20.88 26.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 120.974 0.416 . . . . 1.1100000000000001 110.415 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.44 ' HG2' ' O ' ' A' ' 14' ' ' ASP . 77.6 mm-40 -60.36 -32.82 71.63 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.827 -0.624 . . . . 1.6000000000000001 111.455 179.334 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 82.3 m-85 -93.93 4.02 54.52 Favored 'General case' 0 N--CA 1.463 0.191 0 N-CA-C 111.721 0.267 . . . . 0.64000000000000001 111.721 -179.578 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -101.79 87.21 3.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.002 0.43 . . . . 0.44 110.672 179.672 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -97.4 -15.0 20.88 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.9 -0.591 . . . . 2.1000000000000001 111.322 -179.878 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -83.58 1.14 43.58 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.225 -0.443 . . . . 1.8 111.365 -179.547 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 63.67 16.07 58.43 Favored Glycine 0 C--N 1.331 0.268 0 C-N-CA 120.987 -0.625 . . . . 0.46000000000000002 113.032 179.645 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 46.1 p -92.65 8.34 39.55 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.642 0.258 . . . . 0.40000000000000002 111.124 179.838 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 57.1 18.19 26.35 Favored Glycine 0 C--N 1.331 0.304 0 C-N-CA 120.823 -0.703 . . . . 0.33000000000000002 111.822 -179.677 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.492 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 35.7 mtpt -127.4 155.54 43.47 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.82 0.343 . . . . 1.1000000000000001 111.06 -179.512 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.445 ' N ' HE22 ' A' ' 62' ' ' GLN . 43.6 pt -116.67 134.72 59.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.272 -0.422 . . . . 0.5 111.601 -179.711 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -53.47 138.91 32.49 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.083 -0.508 . . . . 0.29999999999999999 111.282 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.585 ' HA ' HD11 ' A' ' 63' ' ' LEU . 7.7 t -68.98 -5.39 21.35 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.073 -0.512 . . . . 1.03 111.161 -179.901 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 49.6 mtp180 -97.53 4.93 50.22 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.954 -0.566 . . . . 3.0800000000000001 110.385 179.717 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -128.7 -1.49 5.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.864 -0.607 . . . . 2.2599999999999998 110.824 -179.862 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.461 HD21 ' CD1' ' A' ' 68' ' ' PHE . 2.6 tm? -55.3 -54.15 47.11 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.158 -0.474 . . . . 1.3700000000000001 110.495 179.834 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.411 ' O ' ' HG3' ' A' ' 37' ' ' ARG . . . -56.01 -42.25 86.59 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.578 -0.82 . . . . 0.32000000000000001 111.815 179.433 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 56.6 m -55.63 -37.19 67.86 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.023 0.44 . . . . 0.31 110.256 179.291 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.519 HD11 ' HA ' ' A' ' 16' ' ' PHE . 1.2 tt -65.36 -36.23 83.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.681 -0.69 . . . . 1.24 110.031 179.386 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.495 ' SD ' ' HG3' ' A' ' 43' ' ' PRO . 25.1 mtp -78.2 -20.35 52.04 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.788 -0.642 . . . . 1.1000000000000001 110.853 179.887 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.411 ' HG3' ' O ' ' A' ' 33' ' ' GLY . 62.3 mtp180 -77.57 -38.52 48.28 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.315 -0.402 . . . . 2.6899999999999999 110.498 179.527 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.444 HG23 ' CD1' ' A' ' 39' ' ' LEU . 1.5 t -71.39 -13.31 61.81 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.222 -0.444 . . . . 1.0600000000000001 110.943 179.588 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.449 ' HB3' ' OE1' ' A' ' 41' ' ' GLN . 10.9 mp -113.28 156.23 23.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.096 -0.502 . . . . 1.26 110.701 179.691 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -49.5 -20.69 2.67 Favored Glycine 0 CA--C 1.521 0.46 0 CA-C-N 115.679 -0.691 . . . . 0.68999999999999995 114.303 -178.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.701 ' HG2' HE22 ' A' ' 75' ' ' GLN . 20.0 mp0 -60.78 139.06 58.04 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 117.382 0.591 . . . . 1.97 111.09 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 74.9 m-20 -130.97 78.51 73.32 Favored Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 116.179 -0.464 . . . . 2.6600000000000001 110.966 179.851 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.495 ' HG3' ' SD ' ' A' ' 36' ' ' MET . 59.9 Cg_endo -68.97 147.59 68.3 Favored 'Trans proline' 0 C--N 1.343 0.259 0 C-N-CA 122.767 2.311 . . . . 0.51000000000000001 112.256 179.757 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 63.5 m -68.9 143.34 54.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.339 -0.391 . . . . 0.72999999999999998 110.59 179.505 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.47 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 8.9 tp10 -47.93 -55.32 10.2 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.612 0.244 . . . . 2.7000000000000002 111.051 -179.601 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -55.09 -45.08 75.41 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.296 -0.411 . . . . 0.46000000000000002 111.164 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -53.27 -53.8 45.49 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.278 -0.419 . . . . 2.23 110.704 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.442 ' HA ' HD21 ' A' ' 51' ' ' LEU . 12.3 mt -56.6 -38.14 71.62 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.313 -0.403 . . . . 1.3600000000000001 110.47 179.44 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.47 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 84.0 mm-40 -67.25 -27.17 66.99 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.394 -0.366 . . . . 1.22 110.585 179.603 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 38.5 m-20 -77.35 -55.35 5.48 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.207 -0.451 . . . . 0.62 111.8 -179.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.56 HD13 HD13 ' A' ' 71' ' ' ILE . 1.1 pp -65.8 -35.88 81.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.497 -0.319 . . . . 0.39000000000000001 111.8 -179.19 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 82.6 mt -71.21 -43.22 74.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.698 0.285 . . . . 0.5 111.016 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.58 -49.94 71.39 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.406 -0.361 . . . . 0.58999999999999997 111.0 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -58.91 -36.15 74.23 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.892 0.377 . . . . 2.54 110.072 179.474 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . 0.451 ' HA ' HD22 ' A' ' 59' ' ' ASN . . . -76.23 -19.63 58.18 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.077 -0.511 . . . . 0.53000000000000003 110.767 179.217 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -79.16 -31.21 43.91 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.164 -0.471 . . . . 1.95 110.802 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 14.4 m120 -111.5 41.75 1.83 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.145 -0.48 . . . . 2.48 110.875 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.456 HD22 ' C ' ' A' ' 58' ' ' ASN . 0.2 OUTLIER -158.03 -63.42 0.09 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.076 -0.511 . . . . 2.48 110.519 179.985 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . 0.451 HD22 ' HA ' ' A' ' 55' ' ' ALA . 25.2 m-80 -87.42 23.1 1.98 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.122 -0.49 . . . . 2.0499999999999998 110.803 179.827 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 11.3 m120 66.27 -76.69 0.05 OUTLIER 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.009 -0.541 . . . . 1.47 111.086 -179.814 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -165.15 21.01 0.12 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.842 -0.694 . . . . 0.42999999999999999 112.373 179.767 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.492 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -132.14 155.22 48.56 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.982 0.42 . . . . 0.38 111.406 -179.814 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.585 HD11 ' HA ' ' A' ' 29' ' ' THR . 24.1 mt -123.88 152.38 42.43 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.837 -0.619 . . . . 1.4299999999999999 110.403 179.858 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 19.9 m-80 -113.2 157.77 21.29 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.884 0.373 . . . . 1.1899999999999999 111.132 -179.757 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -42.3 -37.71 1.6 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.67 -0.695 . . . . 0.40000000000000002 111.158 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -72.32 -38.96 68.56 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.206 -0.452 . . . . 0.81000000000000005 111.544 179.8 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -58.07 -51.2 70.66 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.026 0.441 . . . . 1.3600000000000001 110.4 179.744 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.461 ' CD1' HD21 ' A' ' 32' ' ' LEU . 29.5 t80 -67.1 -46.83 73.03 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.739 -0.664 . . . . 0.51000000000000001 110.797 179.904 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 10.6 m -55.12 -50.82 68.29 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.148 -0.478 . . . . 0.75 111.038 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -52.82 -52.4 39.1 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.891 -0.671 . . . . 0.40999999999999998 112.007 179.799 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.687 HG23 ' HE2' ' A' ' 74' ' ' LYS . 70.2 mt -58.24 -50.28 78.95 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.601 0 CA-C-O 120.967 0.413 . . . . 0.51000000000000001 110.8 179.204 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 2.3 mtp -43.39 -37.63 2.39 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.569 -0.741 . . . . 1.01 110.819 179.625 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.27 -55.28 10.98 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.118 -0.492 . . . . 0.69999999999999996 111.133 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.687 ' HE2' HG23 ' A' ' 71' ' ' ILE . 57.7 pttt -59.8 -30.26 68.79 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.963 -0.562 . . . . 1.3799999999999999 111.411 -179.389 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . 0.701 HE22 ' HG2' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -81.59 -46.46 14.39 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.289 -0.414 . . . . 1.98 111.919 -179.369 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 32.4 mtt . . . . . 0 N--CA 1.452 -0.356 0 CA-C-N 116.328 -0.396 . . . . 1.2 111.632 -179.431 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.53 ' O ' ' HG2' ' A' ' 85' ' ' MET . 1.7 t . . . . . 0 N--CA 1.466 0.339 0 CA-C-O 120.972 0.415 . . . . 7.29 110.723 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.426 ' HA ' ' HG2' ' A' ' 85' ' ' MET . 43.8 mt-10 -49.34 -19.88 0.58 Allowed 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 113.353 0.871 . . . . 9.7400000000000002 113.353 -178.221 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -62.28 -55.87 24.05 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 120.992 0.425 . . . . 12.109999999999999 111.461 -179.423 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -69.63 -16.01 63.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.131 -0.486 . . . . 10.869999999999999 111.17 -179.525 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' MET . . . . . 0.537 ' HB3' HG22 ' A' ' 142' ' ' VAL . 2.8 mmm -82.61 -32.12 28.53 Favored 'General case' 0 CA--C 1.508 -0.639 0 CA-C-O 121.979 0.895 . . . . 11.09 108.84 -179.24 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 25.9 tpt180 -64.67 -50.12 68.28 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 113.655 -1.611 . . . . 15.52 110.037 179.404 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -65.54 -37.09 85.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.8 -0.636 . . . . 14.85 110.195 179.164 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.79 -31.13 69.92 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.973 -0.558 . . . . 14.109999999999999 111.128 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 87.6 t80 -68.04 -39.59 83.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.137 0.494 . . . . 15.73 110.373 179.789 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 65.7 mttm -65.83 -39.51 90.88 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.543 -0.753 . . . . 17.66 110.918 179.769 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 78.2 mt -70.46 -45.43 74.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.059 -0.518 . . . . 18.149999999999999 111.59 -179.755 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.534 ' HD1' HG11 ' A' ' 108' ' ' VAL . 1.9 m-85 -67.51 -55.46 13.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.452 -0.34 . . . . 18.34 111.511 -179.503 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 27.9 t0 -58.35 109.14 0.72 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.879 0.371 . . . . 19.289999999999999 110.523 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.516 ' HG2' ' HB3' ' A' ' 104' ' ' GLU . 22.4 mmm180 -57.88 -37.0 73.18 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.967 -0.56 . . . . 22.25 111.129 -179.464 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.418 ' HB2' ' OD1' ' A' ' 97' ' ' ASP . 0.3 OUTLIER -107.8 176.46 5.14 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.22 -0.445 . . . . 23.34 110.784 -179.78 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.03 5.34 57.79 Favored Glycine 0 N--CA 1.449 -0.433 0 C-N-CA 120.896 -0.668 . . . . 22.0 112.157 179.721 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.437 ' OD2' ' HB2' ' A' ' 99' ' ' PHE . 11.6 p-10 -58.8 -38.79 79.38 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.808 0.337 . . . . 22.280000000000001 110.98 -179.875 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 105.21 28.15 5.62 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.858 -0.687 . . . . 19.93 113.076 179.427 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . 0.437 ' HB2' ' OD2' ' A' ' 97' ' ' ASP . 59.8 m-85 -145.39 139.06 26.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.012 0.435 . . . . 20.300000000000001 111.622 179.89 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.426 ' HB ' ' HB ' ' A' ' 136' ' ' ILE . 84.3 mt -114.84 124.59 71.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 115.774 -0.648 . . . . 19.370000000000001 110.619 179.414 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 58.4 m -114.21 156.55 44.1 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.154 -0.475 . . . . 22.489999999999998 110.958 -179.56 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -41.25 -32.54 1.18 Allowed 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 122.723 2.282 . . . . 23.0 112.181 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.55 -51.08 62.53 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.1 0.476 . . . . 24.559999999999999 110.531 179.299 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . 0.543 ' O ' HG12 ' A' ' 108' ' ' VAL . 45.0 mt-10 -69.57 -26.99 64.75 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.674 -0.694 . . . . 22.23 110.875 179.851 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.493 HD23 ' C ' ' A' ' 105' ' ' LEU . 5.8 tt -69.13 -55.83 9.51 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.333 -0.394 . . . . 20.359999999999999 111.161 -179.583 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 7.1 ppt_? -62.49 -30.57 71.36 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.034 0.445 . . . . 27.190000000000001 110.597 -179.679 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -74.19 -36.59 64.02 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.785 -0.643 . . . . 25.359999999999999 112.043 -179.866 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.543 HG12 ' O ' ' A' ' 104' ' ' GLU . 7.2 p -80.0 -44.88 22.85 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 N-CA-C 111.947 0.351 . . . . 21.059999999999999 111.947 -179.352 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.473 ' N ' HG13 ' A' ' 108' ' ' VAL . 12.0 mmt -52.69 -38.98 61.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.49 -0.323 . . . . 20.93 111.429 -179.587 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 89.6 mt -65.65 -34.48 70.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.843 0.354 . . . . 25.129999999999999 110.538 179.488 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 69.7 m-20 -65.64 -22.93 66.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.09 -0.505 . . . . 23.32 110.444 179.559 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 7.5 mt -88.42 -27.87 21.28 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.954 -0.566 . . . . 21.07 110.531 179.722 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 106.22 10.8 29.02 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.896 -0.668 . . . . 23.050000000000001 112.217 -179.741 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -74.61 -34.86 62.9 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.65 0.262 . . . . 22.59 111.306 -179.737 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 57.3 tptt 53.85 90.69 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.119 -0.491 . . . . 27.960000000000001 110.76 -179.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . 0.414 ' HB ' HG23 ' A' ' 121' ' ' ILE . 3.3 m -124.23 156.33 31.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.919 -0.582 . . . . 24.75 111.698 -179.525 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . 0.45 ' O ' HG12 ' A' ' 121' ' ' ILE . 61.9 p -99.22 147.16 25.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.696 -0.683 . . . . 27.239999999999998 110.272 179.676 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . 0.436 ' O ' ' HB2' ' A' ' 122' ' ' ASP . 14.8 m-20 -53.55 -17.67 2.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.258 -0.428 . . . . 26.629999999999999 111.439 -179.593 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -79.93 -55.71 4.77 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.739 0.304 . . . . 29.140000000000001 111.381 -179.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . 0.401 ' OE1' HG12 ' A' ' 116' ' ' VAL . 14.7 pt-20 -61.79 -35.03 76.99 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.412 -0.358 . . . . 24.190000000000001 111.44 -179.539 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.462 ' O ' HG13 ' A' ' 125' ' ' ILE . 7.4 pt -78.01 -33.52 18.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 C-N-CA 120.976 -0.289 . . . . 22.329999999999998 111.174 -179.909 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . 0.442 ' N ' HG13 ' A' ' 121' ' ' ILE . 12.7 t70 -55.85 -44.83 78.37 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.598 -0.519 . . . . 24.289999999999999 109.598 178.819 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -67.66 -42.59 81.95 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.621 -0.718 . . . . 24.739999999999998 110.214 179.073 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 54.7 ttp -58.1 -37.06 73.82 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.026 -0.533 . . . . 19.710000000000001 110.99 179.643 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.462 HG13 ' O ' ' A' ' 121' ' ' ILE . 77.3 mt -65.87 -45.32 91.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.278 -0.419 . . . . 19.949999999999999 110.38 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 61.3 ttt180 -58.68 -38.05 77.38 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.81 -0.632 . . . . 24.949999999999999 111.089 179.753 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -63.01 -28.12 69.89 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.205 -0.452 . . . . 18.690000000000001 111.076 -179.88 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.536 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -103.44 -6.61 21.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.259 -0.428 . . . . 16.469999999999999 111.038 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 54.4 t0 -109.34 100.96 10.0 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.15 -0.477 . . . . 20.399999999999999 111.071 -179.583 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 92.6 m-85 -70.38 -48.82 54.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.948 -0.569 . . . . 21.43 111.018 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -64.99 -21.85 66.91 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.182 -0.463 . . . . 23.370000000000001 110.863 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 55.26 55.51 28.01 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.941 -0.647 . . . . 24.32 112.698 179.74 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -101.73 -7.07 22.93 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.826 0.346 . . . . 23.879999999999999 110.765 179.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 89.93 9.49 65.85 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.844 -0.693 . . . . 22.670000000000002 112.305 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 68.3 mtp -134.93 154.38 51.71 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.843 0.354 . . . . 22.91 110.835 -179.901 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.554 HG23 ' HB2' ' A' ' 140' ' ' GLU . 27.8 mm -114.87 144.0 23.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.1 -0.5 . . . . 18.41 111.812 -179.516 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . 0.582 HD22 ' H ' ' A' ' 139' ' ' GLU . 6.3 t30 -114.59 157.15 23.43 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.43 -0.805 . . . . 16.82 108.993 178.437 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.683 ' O ' HG23 ' A' ' 142' ' ' VAL . 39.4 t80 -40.85 -24.08 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 111.821 0.304 . . . . 14.65 111.821 -179.828 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . 0.582 ' H ' HD22 ' A' ' 137' ' ' ASN . 10.6 mm-40 -80.8 -56.25 4.26 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 120.818 0.342 . . . . 14.82 110.983 -179.359 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.554 ' HB2' HG23 ' A' ' 136' ' ' ILE . 39.5 mt-10 -59.09 -29.45 67.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.134 0.492 . . . . 17.460000000000001 109.892 179.539 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.451 ' CZ ' HG21 ' A' ' 145' ' ' ILE . 86.5 t80 -66.37 -55.41 16.0 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.585 -0.734 . . . . 12.93 109.834 179.141 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.683 HG23 ' O ' ' A' ' 138' ' ' TYR . 55.3 t -47.67 -36.53 5.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.65 -0.704 . . . . 10.699999999999999 111.273 179.022 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 79.4 t90 -67.81 -55.97 10.98 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.833 0.679 . . . . 13.66 112.833 -178.656 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . 0.536 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 15.5 ptt? -65.72 -28.72 69.26 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 113.348 0.87 . . . . 14.5 113.348 -177.564 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 145' ' ' ILE . . . . . 0.542 ' O ' ' HG2' ' A' ' 148' ' ' LYS . 49.2 pt -73.19 -42.05 58.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 C-N-CA 120.832 -0.347 . . . . 11.25 111.763 -179.388 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 146' ' ' SER . . . . . 0.538 ' N ' HG13 ' A' ' 145' ' ' ILE . 79.0 p -64.6 -13.03 51.52 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.227 0.536 . . . . 8.5399999999999991 109.845 179.374 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 11.1 mm-40 -122.11 13.1 10.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.265 -0.88 . . . . 11.869999999999999 111.839 -178.355 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . 0.542 ' HG2' ' O ' ' A' ' 145' ' ' ILE . 19.2 pttp . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.162 -0.923 . . . . 13.68 110.914 179.611 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.442 HD13 ' SG ' ' A' ' 69' ' ' CYS . 56.2 mt . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.754 0.311 . . . . 1.27 110.674 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 58.8 p -80.02 -170.71 2.58 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.261 -0.427 . . . . 1.1200000000000001 111.423 -179.679 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -66.15 -46.79 76.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.277 -0.42 . . . . 2.2000000000000002 111.259 -179.829 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -71.9 -38.81 69.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.235 -0.439 . . . . 1.3500000000000001 110.947 -179.519 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 15.9 mm100 -64.64 -44.38 90.65 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.108 -0.496 . . . . 2.2200000000000002 110.676 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.519 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 45.7 mt -59.35 -50.47 79.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.376 -0.374 . . . . 0.54000000000000004 110.484 179.598 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.89 -19.78 65.79 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.111 -0.495 . . . . 0.5 111.08 179.888 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -71.44 -56.2 6.42 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.231 -0.44 . . . . 2.27 111.887 -178.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.519 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 20.1 p90 -78.67 -27.96 45.24 Favored 'General case' 0 C--N 1.333 -0.122 0 C-N-CA 120.565 -0.454 . . . . 0.37 110.863 -179.823 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 27.3 tptp -61.83 -37.65 85.23 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.272 -0.64 . . . . 1.23 109.272 178.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.412 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 22.8 t70 -69.39 -49.93 50.82 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.719 -0.673 . . . . 0.44 109.488 178.483 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.26 -14.82 42.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.617 -0.72 . . . . 0.28999999999999998 110.79 179.389 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 47.3 t80 -80.5 -51.84 8.32 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.975 -0.557 . . . . 0.47999999999999998 110.863 -179.61 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 13.6 m -66.1 -19.55 25.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.091 0.472 . . . . 1.1100000000000001 110.629 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.412 ' HG2' ' O ' ' A' ' 14' ' ' ASP . 73.5 mm-40 -65.22 -21.8 66.8 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.648 -0.706 . . . . 1.6000000000000001 111.37 179.588 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 -110.85 12.34 22.34 Favored 'General case' 0 N--CA 1.462 0.174 0 N-CA-C 112.026 0.38 . . . . 0.64000000000000001 112.026 -179.499 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -100.96 92.55 5.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.023 0.44 . . . . 0.44 110.716 179.483 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -99.7 -1.13 38.66 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.885 -0.598 . . . . 2.1000000000000001 111.222 -179.883 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -95.29 -23.19 17.33 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.186 -0.461 . . . . 1.8 111.465 -179.299 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.1 7.21 87.69 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.831 -0.7 . . . . 0.46000000000000002 112.796 179.784 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 24.3 p -84.53 17.36 2.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.589 0.233 . . . . 0.40000000000000002 111.172 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 57.48 18.0 28.27 Favored Glycine 0 C--N 1.332 0.332 0 C-N-CA 120.718 -0.753 . . . . 0.33000000000000002 111.841 -179.475 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.667 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 44.8 mtpt -136.82 154.71 50.45 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.598 -0.301 . . . . 1.1000000000000001 110.444 -179.443 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.48 ' CD1' HD12 ' A' ' 35' ' ' LEU . 44.1 pt -119.68 135.45 59.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 120.612 0.244 . . . . 0.5 111.048 179.948 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -49.17 132.12 19.54 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.499 -0.319 . . . . 0.29999999999999999 110.894 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 5.9 t -61.03 -17.05 50.19 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.129 -0.487 . . . . 1.03 111.019 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 69.3 mtt180 -79.23 -2.67 42.22 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.826 -0.625 . . . . 3.0800000000000001 110.653 179.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -116.83 -8.8 11.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.79 -0.641 . . . . 2.2599999999999998 110.799 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.402 ' O ' ' HG3' ' A' ' 36' ' ' MET . 0.8 OUTLIER -55.64 -48.09 75.55 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.155 -0.475 . . . . 1.3700000000000001 110.228 179.916 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.595 ' HA2' HD11 ' A' ' 48' ' ' LEU . . . -56.1 -41.34 85.44 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.503 -0.856 . . . . 0.32000000000000001 111.485 179.28 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 77.3 m -65.54 -28.91 69.51 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.066 0.46 . . . . 0.31 110.314 179.069 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.48 HD12 ' CD1' ' A' ' 27' ' ' ILE . 0.2 OUTLIER -70.83 -35.07 72.31 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.751 -0.659 . . . . 1.24 110.593 -179.982 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.441 ' SD ' ' HG3' ' A' ' 43' ' ' PRO . 26.7 mtp -80.27 -21.62 42.53 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.224 -0.444 . . . . 1.1000000000000001 110.648 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -77.0 -37.33 55.3 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.069 -0.514 . . . . 2.6899999999999999 110.224 179.277 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 5.9 t -73.41 -12.17 60.72 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.802 -0.636 . . . . 1.0600000000000001 110.636 179.266 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 65.5 mt -111.86 155.71 23.18 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.798 -0.637 . . . . 1.26 110.366 -179.895 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -50.73 -18.12 2.49 Favored Glycine 0 CA--C 1.52 0.352 0 CA-C-N 115.929 -0.578 . . . . 0.68999999999999995 114.358 -178.737 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 26.7 mp0 -65.54 141.61 58.4 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 117.354 0.577 . . . . 1.97 111.352 -179.859 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 48.9 m-80 -129.29 72.65 81.96 Favored Pre-proline 0 C--N 1.331 -0.225 0 CA-C-N 116.196 -0.456 . . . . 2.6600000000000001 110.857 179.393 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.441 ' HG3' ' SD ' ' A' ' 36' ' ' MET . 29.4 Cg_endo -60.83 148.96 90.54 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.719 2.28 . . . . 0.51000000000000001 112.309 179.806 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 32.3 m -77.34 150.02 35.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.167 -0.469 . . . . 0.72999999999999998 110.6 179.565 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.409 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 1.0 OUTLIER -49.41 -55.23 13.79 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.573 0.225 . . . . 2.7000000000000002 111.483 -179.556 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -55.89 -42.79 76.49 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.443 -0.344 . . . . 0.46000000000000002 111.735 -179.497 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -62.29 -53.89 48.62 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.375 -0.375 . . . . 2.23 110.95 -179.57 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.595 HD11 ' HA2' ' A' ' 33' ' ' GLY . 14.5 tp -55.57 -42.22 74.42 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.009 -0.541 . . . . 1.3600000000000001 111.168 -179.745 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.409 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 85.2 mm-40 -69.27 -32.13 71.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.47 -0.332 . . . . 1.22 111.281 -179.686 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 76.6 m-20 -70.62 -51.5 27.7 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.527 -0.306 . . . . 0.62 111.638 -179.727 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.489 HD21 ' HA ' ' A' ' 48' ' ' LEU . 1.8 pp -65.85 -41.16 92.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.624 -0.262 . . . . 0.39000000000000001 111.508 -179.516 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 60.5 mt -62.79 -49.2 84.65 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-O 120.808 0.337 . . . . 0.5 110.477 179.51 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.77 -34.19 76.73 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.214 -0.448 . . . . 0.58999999999999997 110.381 179.471 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -63.85 -50.22 69.7 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.008 -0.542 . . . . 2.54 110.145 179.305 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -71.99 -14.59 61.93 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.93 -0.577 . . . . 0.53000000000000003 110.984 179.446 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -68.99 -55.4 10.98 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.303 -0.408 . . . . 1.95 111.301 -179.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 7.6 p30 -97.03 48.58 1.05 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.033 0.444 . . . . 2.48 111.083 -179.757 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 10.4 m120 -156.21 -41.31 0.08 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.721 -0.672 . . . . 2.48 110.719 179.887 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 21.6 m-80 -115.17 23.33 12.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.967 -0.56 . . . . 2.0499999999999998 110.694 179.866 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 12.3 m120 65.87 -78.21 0.04 OUTLIER 'General case' 0 C--O 1.232 0.178 0 CA-C-N 115.869 -0.605 . . . . 1.47 111.052 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -159.24 23.21 0.3 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.671 -0.776 . . . . 0.42999999999999999 112.729 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.667 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -126.93 155.19 43.47 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.348 0.594 . . . . 0.38 111.639 -179.938 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.492 HD13 ' N ' ' A' ' 64' ' ' ASN . 1.2 tm? -121.97 148.25 45.03 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.108 -0.951 . . . . 1.4299999999999999 109.002 -179.714 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . 0.518 ' OD1' ' HE3' ' A' ' 26' ' ' LYS . 0.1 OUTLIER -111.35 155.67 22.75 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.587 -0.445 . . . . 1.1899999999999999 111.965 -178.561 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.482 ' O ' ' HB2' ' A' ' 69' ' ' CYS . 70.0 t80 -51.99 -31.52 29.83 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.638 -0.71 . . . . 0.40000000000000002 110.713 179.491 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -77.13 -36.6 55.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.327 -0.397 . . . . 0.81000000000000005 111.868 -179.914 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -63.68 -46.46 85.44 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 110.043 -0.354 . . . . 1.3600000000000001 110.043 179.767 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.451 ' HE2' ' HB2' ' A' ' 12' ' ' PHE . 31.0 t80 -68.44 -51.52 42.76 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.183 -0.462 . . . . 0.51000000000000001 110.472 179.263 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.482 ' HB2' ' O ' ' A' ' 65' ' ' PHE . 2.1 t -53.43 -45.86 69.57 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-O 120.945 0.402 . . . . 0.75 110.121 179.739 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -52.61 -51.27 44.84 Favored Glycine 0 N--CA 1.448 -0.542 0 CA-C-N 115.666 -0.697 . . . . 0.40999999999999998 111.68 179.463 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.472 ' HA ' ' HG2' ' A' ' 74' ' ' LYS . 13.0 mt -61.9 -39.44 83.57 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.316 0 CA-C-O 121.026 0.441 . . . . 0.51000000000000001 110.602 179.429 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 3.4 mtp -57.88 -30.21 65.66 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.802 -0.635 . . . . 1.01 110.096 179.618 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.25 -45.72 65.87 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.965 -0.561 . . . . 0.69999999999999996 110.799 179.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.472 ' HG2' ' HA ' ' A' ' 71' ' ' ILE . 58.2 pttt -75.52 -25.46 57.26 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.194 -0.457 . . . . 1.3799999999999999 111.767 -179.667 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . 0.43 HE21 ' HB2' ' A' ' 75' ' ' GLN . 4.4 tt0 -82.53 -43.95 16.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.056 0.455 . . . . 1.98 110.851 -179.533 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . 0.433 ' SD ' HD23 ' A' ' 4' ' ' LEU . 29.0 mtt . . . . . 0 C--N 1.325 -0.472 0 CA-C-N 115.787 -0.642 . . . . 1.2 111.41 179.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.577 ' O ' ' HG3' ' A' ' 85' ' ' MET . 61.9 m . . . . . 0 N--CA 1.469 0.501 0 N-CA-C 111.993 0.368 . . . . 7.29 111.993 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.459 ' HA ' ' SD ' ' A' ' 85' ' ' MET . 38.6 tt0 -44.88 -41.73 7.39 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.002 -0.544 . . . . 9.7400000000000002 112.456 -179.163 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -55.92 -54.02 49.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.786 0.327 . . . . 12.109999999999999 111.623 -179.372 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.528 ' H ' HG22 ' A' ' 81' ' ' THR . 37.0 tt0 -63.24 -18.75 63.89 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.305 -0.407 . . . . 10.869999999999999 111.386 -179.467 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' MET . . . . . 0.577 ' HG3' ' O ' ' A' ' 81' ' ' THR . 6.6 mtp -74.74 -35.62 62.62 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-O 121.185 0.517 . . . . 11.09 109.894 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 15.9 ttm180 -68.63 -51.46 41.97 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.542 -0.754 . . . . 15.52 110.295 179.457 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.438 ' HA ' ' HD3' ' A' ' 90' ' ' LYS . 16.2 mm-40 -58.41 -39.16 78.98 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.11 -0.496 . . . . 14.85 110.501 179.32 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -69.87 -33.02 71.68 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.006 -0.543 . . . . 14.109999999999999 110.568 179.543 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 52.8 t80 -66.78 -29.05 68.9 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.949 -0.568 . . . . 15.73 110.234 179.594 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . 0.438 ' HD3' ' HA ' ' A' ' 87' ' ' GLU . 24.9 mtpp -73.32 -46.48 49.19 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.475 -0.784 . . . . 17.66 110.945 179.783 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 75.2 mt -58.6 -50.52 78.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.164 -0.471 . . . . 18.149999999999999 111.245 -179.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.553 ' HD1' HG11 ' A' ' 108' ' ' VAL . 22.3 m-85 -64.08 -43.4 95.51 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.36 -0.382 . . . . 18.34 110.976 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 30.7 t0 -64.47 93.28 0.1 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.997 0.427 . . . . 19.289999999999999 110.297 179.621 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -56.48 -29.42 61.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.778 -0.646 . . . . 22.25 111.532 -179.269 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -101.12 177.97 4.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.874 0.369 . . . . 23.34 111.028 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -101.0 0.27 54.99 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.949 -0.643 . . . . 22.0 112.002 179.364 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -70.36 -22.36 62.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.701 0.286 . . . . 22.280000000000001 111.659 -179.691 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 86.39 45.45 5.56 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.705 -0.76 . . . . 19.93 112.492 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . 0.43 ' HA ' ' O ' ' A' ' 136' ' ' ILE . 99.6 m-85 -147.64 138.86 23.62 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.595 0.236 . . . . 20.300000000000001 111.04 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 53.7 mt -114.13 117.43 55.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 121.009 0.433 . . . . 19.370000000000001 110.756 179.407 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 68.1 m -114.11 157.32 42.49 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 115.736 -0.666 . . . . 22.489999999999998 111.046 -179.296 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . 0.434 ' HG3' HD12 ' A' ' 125' ' ' ILE . 94.4 Cg_exo -41.45 -36.57 2.92 Favored 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 122.602 2.201 . . . . 23.0 112.742 -179.832 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.32 -40.9 81.52 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.161 -0.472 . . . . 24.559999999999999 111.17 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . 0.487 ' O ' HG12 ' A' ' 108' ' ' VAL . 43.2 mt-10 -78.02 -22.85 48.64 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.835 -0.62 . . . . 22.23 109.878 -179.473 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.563 HD22 ' HB ' ' A' ' 121' ' ' ILE . 3.4 tt -77.0 -43.04 36.3 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 115.215 -0.902 . . . . 20.359999999999999 111.128 -179.445 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.414 ' O ' HG13 ' A' ' 110' ' ' ILE . 54.2 ttt180 -66.57 -48.27 70.15 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.468 -0.333 . . . . 27.190000000000001 110.346 179.463 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 8.5 m-85 -55.86 -50.69 69.9 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.159 -0.473 . . . . 25.359999999999999 111.492 -179.681 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.553 HG11 ' HD1' ' A' ' 92' ' ' PHE . 9.3 p -63.99 -43.13 97.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.582 0.229 . . . . 21.059999999999999 111.568 -179.623 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.472 ' N ' HG13 ' A' ' 108' ' ' VAL . 9.0 mmt -58.98 -43.19 91.37 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 120.773 0.32 . . . . 20.93 111.013 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.414 HG13 ' O ' ' A' ' 106' ' ' ARG . 90.9 mt -67.33 -21.6 28.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.144 -0.48 . . . . 25.129999999999999 110.313 179.704 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 84.1 m-20 -79.74 -37.64 35.06 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.861 -0.609 . . . . 23.32 110.495 179.345 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.451 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 58.2 mt -59.64 -36.02 75.54 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.103 -0.499 . . . . 21.07 110.422 179.754 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 133.84 -15.88 4.55 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.858 -0.687 . . . . 23.050000000000001 112.22 -179.808 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -93.62 165.2 12.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.863 0.363 . . . . 22.59 111.227 -179.689 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -124.07 128.06 48.76 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.064 -0.517 . . . . 27.960000000000001 110.676 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . 0.424 ' HB ' HG23 ' A' ' 121' ' ' ILE . 2.8 m -135.57 146.79 29.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.207 -0.451 . . . . 24.75 111.624 -179.885 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 59.5 p -89.32 147.15 24.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.734 -0.666 . . . . 27.239999999999998 110.223 179.331 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -53.74 -19.04 3.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.21 -0.45 . . . . 26.629999999999999 111.411 -179.521 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -78.5 -54.64 5.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.405 -0.362 . . . . 29.140000000000001 111.575 -179.51 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . 0.413 ' OE1' HG12 ' A' ' 116' ' ' VAL . 14.0 pt-20 -61.46 -37.92 85.34 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.557 -0.292 . . . . 24.190000000000001 111.769 -179.063 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.563 ' HB ' HD22 ' A' ' 105' ' ' LEU . 47.8 pt -74.32 -35.88 41.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 C-N-CA 120.689 -0.404 . . . . 22.329999999999998 111.062 179.99 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -58.72 -37.6 76.5 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.915 0.388 . . . . 24.289999999999999 110.365 179.251 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -69.53 -47.1 64.85 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.912 -0.585 . . . . 24.739999999999998 110.709 179.693 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 56.5 ttp -53.37 -38.71 63.59 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 116.246 -0.433 . . . . 19.710000000000001 110.76 179.658 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.535 HG23 HD11 ' A' ' 136' ' ' ILE . 79.7 mt -67.42 -42.99 87.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.118 -0.492 . . . . 19.949999999999999 110.473 179.686 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 3.2 tmt_? -61.87 -30.52 70.92 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.989 -0.551 . . . . 24.949999999999999 110.942 179.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -69.87 -28.01 65.29 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.354 -0.385 . . . . 18.690000000000001 111.127 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.652 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -104.66 -6.73 20.17 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.087 -0.506 . . . . 16.469999999999999 111.347 -179.808 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . 0.409 ' OD1' ' N ' ' A' ' 132' ' ' GLY . 3.0 t0 -112.36 105.0 13.18 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.033 0.444 . . . . 20.399999999999999 111.431 -179.102 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 74.3 m-85 -71.51 -7.58 48.44 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.749 -0.659 . . . . 21.43 111.031 179.597 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -128.21 -7.62 5.35 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.091 -0.504 . . . . 23.370000000000001 110.718 179.914 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . 0.412 ' O ' ' N ' ' A' ' 134' ' ' GLY . . . 61.31 -84.93 0.03 OUTLIER Glycine 0 N--CA 1.447 -0.607 0 CA-C-N 115.703 -0.68 . . . . 24.32 112.049 -179.484 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . 0.474 ' O ' ' HG3' ' A' ' 135' ' ' MET . 0.8 OUTLIER 44.08 17.14 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 123.43 0.692 . . . . 23.879999999999999 111.809 -179.669 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . 0.412 ' N ' ' O ' ' A' ' 132' ' ' GLY . . . 53.33 23.56 19.01 Favored Glycine 0 CA--C 1.522 0.487 0 CA-C-N 115.923 -0.58 . . . . 22.670000000000002 114.085 179.547 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 135' ' ' MET . . . . . 0.474 ' HG3' ' O ' ' A' ' 133' ' ' ASP . 40.3 mtp -145.35 142.73 29.65 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 117.431 0.616 . . . . 22.91 110.828 179.408 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.61 HG23 ' HB2' ' A' ' 140' ' ' GLU . 29.9 mm -113.56 146.82 17.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 121.233 0.539 . . . . 18.41 111.586 -179.091 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -114.65 156.96 23.77 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.413 -0.812 . . . . 16.82 109.525 179.025 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 49.1 t80 -43.14 -21.48 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 111.789 0.292 . . . . 14.65 111.789 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -80.95 -56.35 4.17 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 120.949 0.404 . . . . 14.82 111.032 -179.517 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.61 ' HB2' HG23 ' A' ' 136' ' ' ILE . 58.6 mt-10 -61.9 -32.79 73.2 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.216 0.532 . . . . 17.460000000000001 110.104 179.797 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.455 ' CZ ' HG21 ' A' ' 145' ' ' ILE . 81.2 t80 -65.28 -54.15 33.48 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.586 -0.734 . . . . 12.93 109.854 178.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.524 HG13 ' SD ' ' A' ' 85' ' ' MET . 2.5 t -48.89 -35.21 6.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.39 -0.823 . . . . 10.699999999999999 111.555 179.265 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 143' ' ' TRP . . . . . 0.511 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 92.0 t90 -69.27 -55.94 9.03 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.588 0.588 . . . . 13.66 112.588 -179.066 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . 0.652 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 21.9 ptt? -64.26 -24.93 67.84 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 113.324 0.861 . . . . 14.5 113.324 -177.674 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 145' ' ' ILE . . . . . 0.534 HG13 ' N ' ' A' ' 146' ' ' SER . 39.7 pt -80.61 -38.27 17.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 111.993 0.368 . . . . 11.25 111.993 -179.51 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 146' ' ' SER . . . . . 0.534 ' N ' HG13 ' A' ' 145' ' ' ILE . 39.9 t -59.67 -13.55 10.25 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.225 0.536 . . . . 8.5399999999999991 110.559 -179.883 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 147' ' ' GLN . . . . . 0.511 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 2.8 mm-40 -94.51 -22.8 18.0 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.402 -0.817 . . . . 11.869999999999999 111.032 -179.152 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 99.1 mttt . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.223 -0.894 . . . . 13.68 111.003 179.808 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 18.5 mt . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.863 0.364 . . . . 1.27 110.684 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.55 HG22 ' H ' ' A' ' 6' ' ' GLU . 0.2 OUTLIER -84.87 176.17 8.66 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.006 -0.543 . . . . 1.1200000000000001 110.857 -179.813 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.55 ' H ' HG22 ' A' ' 5' ' ' THR . 33.6 tt0 -62.59 -37.75 87.42 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.251 0.548 . . . . 2.2000000000000002 110.32 179.883 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -75.38 -45.76 37.17 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.377 -0.829 . . . . 1.3500000000000001 110.923 -179.634 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -62.46 -45.73 91.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.056 -0.52 . . . . 2.2200000000000002 110.909 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.543 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 80.7 mt -57.46 -54.74 27.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.123 -0.49 . . . . 0.54000000000000004 111.096 179.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.78 -24.08 65.5 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.246 -0.434 . . . . 0.5 111.88 -179.525 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -72.54 -56.19 5.76 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 112.135 0.42 . . . . 2.27 112.135 -179.08 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.543 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 5.2 p90 -76.98 -24.29 52.26 Favored 'General case' 0 C--N 1.332 -0.158 0 C-N-CA 120.614 -0.434 . . . . 0.37 110.728 -179.591 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.429 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 18.6 tptp -65.62 -39.77 91.85 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.259 -0.645 . . . . 1.23 109.259 178.87 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.456 ' O ' HG22 ' A' ' 17' ' ' VAL . 17.9 t70 -68.1 -44.33 76.47 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 108.994 -0.743 . . . . 0.44 108.994 177.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.09 -15.11 62.8 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 115.249 -0.887 . . . . 0.28999999999999998 110.42 179.275 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.429 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 74.1 t80 -79.6 -48.28 14.04 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.821 -0.627 . . . . 0.47999999999999998 110.527 -179.734 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.456 HG22 ' O ' ' A' ' 14' ' ' ASP . 30.1 m -66.01 -23.1 31.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 121.0 0.428 . . . . 1.1100000000000001 110.253 179.822 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.45 ' HG2' ' O ' ' A' ' 14' ' ' ASP . 26.5 mm-40 -57.02 -45.79 82.82 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 115.791 -0.641 . . . . 1.6000000000000001 111.799 179.358 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -85.63 22.5 1.58 Allowed 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 112.053 0.39 . . . . 0.64000000000000001 112.053 -179.252 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -120.87 78.82 1.43 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.026 0.441 . . . . 0.44 110.815 179.646 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 11.4 mmmm -89.86 -24.71 21.33 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.854 -0.612 . . . . 2.1000000000000001 110.999 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -67.54 -35.66 79.48 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.963 -0.562 . . . . 1.8 111.23 -179.608 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 101.83 3.51 52.17 Favored Glycine 0 C--N 1.331 0.255 0 C-N-CA 120.686 -0.768 . . . . 0.46000000000000002 112.819 179.847 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 53.6 p -80.2 7.12 10.02 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.731 0.3 . . . . 0.40000000000000002 111.202 179.885 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 56.96 19.42 30.11 Favored Glycine 0 C--N 1.333 0.405 0 C-N-CA 120.746 -0.74 . . . . 0.33000000000000002 111.986 -179.611 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.467 ' C ' HE22 ' A' ' 62' ' ' GLN . 29.6 mtpt -126.34 155.7 41.64 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.696 0.284 . . . . 1.1000000000000001 111.104 -179.593 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.466 HG13 ' HB2' ' A' ' 63' ' ' LEU . 41.3 pt -114.69 130.12 69.64 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 CA-C-O 120.915 0.388 . . . . 0.5 111.591 -179.843 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -54.53 134.36 46.35 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.091 -0.504 . . . . 0.29999999999999999 111.161 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.486 ' HA ' HD11 ' A' ' 63' ' ' LEU . 6.1 t -66.82 -8.22 27.15 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.055 -0.52 . . . . 1.03 111.053 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 53.9 mtp180 -89.34 -1.19 57.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.912 -0.586 . . . . 3.0800000000000001 110.491 179.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -127.62 2.05 6.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.808 -0.633 . . . . 2.2599999999999998 110.971 -179.658 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.464 HD21 ' CD1' ' A' ' 68' ' ' PHE . 2.7 tm? -57.09 -51.8 67.82 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.396 -0.365 . . . . 1.3700000000000001 110.581 -179.791 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.466 ' O ' ' HG3' ' A' ' 37' ' ' ARG . . . -55.55 -44.22 85.75 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.376 -0.916 . . . . 0.32000000000000001 111.443 179.236 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 87.9 m -56.32 -36.17 68.41 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.105 0.478 . . . . 0.31 110.22 179.124 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.449 ' HB3' ' O ' ' A' ' 32' ' ' LEU . 42.2 tp -65.92 -32.4 73.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.635 -0.712 . . . . 1.24 110.347 179.483 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 16.6 mtp -80.91 -20.17 42.72 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.744 -0.662 . . . . 1.1000000000000001 110.812 179.793 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.466 ' HG3' ' O ' ' A' ' 33' ' ' GLY . 71.8 mtp180 -74.72 -43.36 55.47 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.344 -0.389 . . . . 2.6899999999999999 110.646 179.753 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.3 t -65.74 -14.0 60.45 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.168 -0.469 . . . . 1.0600000000000001 110.981 179.658 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.507 ' HB3' ' OE1' ' A' ' 41' ' ' GLN . 9.7 mp -113.9 156.14 24.5 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.028 -0.533 . . . . 1.26 110.539 179.491 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -55.15 -7.37 1.14 Allowed Glycine 0 CA--C 1.521 0.455 0 N-CA-C 114.931 0.732 . . . . 0.68999999999999995 114.931 -178.497 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.507 ' OE1' ' HB3' ' A' ' 39' ' ' LEU . 16.0 mp0 -59.44 -79.72 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 117.86 0.83 . . . . 1.97 110.998 179.697 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 53.69 74.24 0.79 Allowed Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.216 -0.447 . . . . 2.6600000000000001 111.118 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -71.42 -167.76 0.31 Allowed 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.509 2.14 . . . . 0.51000000000000001 112.442 179.79 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.9 m -86.27 157.16 19.99 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.125 -0.489 . . . . 0.72999999999999998 110.934 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -61.32 -55.05 36.1 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.677 0.275 . . . . 2.7000000000000002 111.056 -179.745 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.57 -53.09 56.66 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.216 -0.447 . . . . 0.46000000000000002 111.374 -179.843 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -54.87 -41.66 71.1 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.207 -0.451 . . . . 2.23 110.247 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.451 ' HA ' HD21 ' A' ' 51' ' ' LEU . 27.3 tp -60.61 -39.44 88.19 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.722 -0.672 . . . . 1.3600000000000001 110.641 179.68 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 86.2 mm-40 -70.49 -30.8 67.68 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.145 -0.48 . . . . 1.22 110.823 179.769 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 30.4 m-20 -67.08 -49.31 65.48 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.208 -0.451 . . . . 0.62 111.481 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.451 HD21 ' HA ' ' A' ' 48' ' ' LEU . 1.0 OUTLIER -71.06 -38.96 72.49 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.637 -0.256 . . . . 0.39000000000000001 111.401 -179.586 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 73.4 mt -65.88 -32.19 57.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 120.74 0.305 . . . . 0.5 110.636 179.607 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -68.66 -50.8 48.29 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.254 -0.43 . . . . 0.58999999999999997 110.839 179.695 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -65.24 -32.91 74.82 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.892 0.377 . . . . 2.54 110.277 179.526 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . 0.45 ' HB1' HD21 ' A' ' 63' ' ' LEU . . . -79.85 -14.83 58.37 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.044 -0.525 . . . . 0.53000000000000003 110.838 179.415 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -70.09 -39.41 75.6 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.189 -0.459 . . . . 1.95 110.84 179.838 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -82.64 -22.83 34.53 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.145 -0.48 . . . . 2.48 110.969 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -91.42 136.74 32.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.201 -0.454 . . . . 2.48 111.015 -179.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . 0.418 ' C ' ' H ' ' A' ' 61' ' ' GLY . 88.0 m-20 64.01 6.46 2.85 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.957 -0.565 . . . . 2.0499999999999998 111.362 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 18.6 m-80 71.01 -27.03 0.17 Allowed 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 112.474 0.546 . . . . 1.47 112.474 179.244 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . 0.418 ' H ' ' C ' ' A' ' 59' ' ' ASN . . . 160.91 34.97 0.02 OUTLIER Glycine 0 C--N 1.33 0.23 0 C-N-CA 120.301 -0.952 . . . . 0.42999999999999999 112.933 -179.937 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.513 HE21 ' HA ' ' A' ' 62' ' ' GLN . 0.0 OUTLIER -141.65 154.69 45.52 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.929 0.395 . . . . 0.38 111.167 179.663 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.486 HD11 ' HA ' ' A' ' 29' ' ' THR . 17.9 mt -127.96 153.84 46.26 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.876 -0.602 . . . . 1.4299999999999999 110.332 179.908 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -113.43 156.99 22.5 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 110.288 -0.264 . . . . 1.1899999999999999 110.288 -179.91 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.494 ' O ' ' HB2' ' A' ' 69' ' ' CYS . 77.6 t80 -44.32 -34.6 2.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.813 0.34 . . . . 0.40000000000000002 110.44 179.339 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.97 -33.7 57.62 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.088 -0.505 . . . . 0.81000000000000005 111.926 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -64.67 -50.13 68.27 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.012 0.434 . . . . 1.3600000000000001 110.062 179.208 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.466 ' HE2' ' HB2' ' A' ' 12' ' ' PHE . 31.3 t80 -64.8 -53.54 45.26 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.902 -0.59 . . . . 0.51000000000000001 110.518 179.64 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.494 ' HB2' ' O ' ' A' ' 65' ' ' PHE . 0.1 OUTLIER -55.13 -41.38 71.65 Favored 'General case' 0 CA--C 1.521 -0.168 0 CA-C-O 120.827 0.346 . . . . 0.75 110.429 179.691 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -53.06 -46.56 61.58 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.791 -0.718 . . . . 0.40999999999999998 111.392 179.375 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.492 HG23 ' CE ' ' A' ' 74' ' ' LYS . 11.3 mt -65.15 -38.53 82.91 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.421 0 CA-C-O 120.936 0.398 . . . . 0.51000000000000001 110.314 178.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . 0.5 ' O ' ' HG3' ' A' ' 76' ' ' MET . 79.4 mmm -61.99 -30.58 71.04 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.075 -0.511 . . . . 1.01 109.796 179.282 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -67.82 -43.31 79.9 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.807 -0.633 . . . . 0.69999999999999996 110.278 179.512 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.492 ' CE ' HG23 ' A' ' 71' ' ' ILE . 64.1 pttt -75.63 -29.83 59.3 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.32 -0.4 . . . . 1.3799999999999999 110.762 179.572 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 4.6 tt0 -73.0 -55.95 5.82 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.306 -0.406 . . . . 1.98 110.794 179.426 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . 0.5 ' HG3' ' O ' ' A' ' 72' ' ' MET . 43.1 mtt . . . . . 0 N--CA 1.445 -0.712 0 CA-C-O 120.933 0.397 . . . . 1.2 110.584 179.375 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.474 ' O ' ' HG3' ' A' ' 85' ' ' MET . 2.6 t . . . . . 0 N--CA 1.469 0.503 0 CA-C-O 120.987 0.422 . . . . 7.29 111.736 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.49 ' HA ' ' SD ' ' A' ' 85' ' ' MET . 11.7 pt-20 -80.16 -15.85 56.16 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.044 -0.526 . . . . 9.7400000000000002 112.29 -178.895 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -59.74 -55.71 30.87 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 120.988 0.423 . . . . 12.109999999999999 110.991 -179.829 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -67.99 -15.76 63.75 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.976 -0.556 . . . . 10.869999999999999 110.558 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' MET . . . . . 0.555 ' SD ' HG13 ' A' ' 142' ' ' VAL . 8.5 mtt -80.4 -34.44 36.29 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.089 -0.505 . . . . 11.09 110.302 -179.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 37.3 ttt180 -68.78 -46.76 67.89 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.747 -0.66 . . . . 15.52 109.875 179.454 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.464 ' O ' HG12 ' A' ' 91' ' ' ILE . 38.3 tt0 -59.45 -45.19 92.3 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.886 -0.597 . . . . 14.85 109.818 178.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.88 -35.28 80.64 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.832 -0.622 . . . . 14.109999999999999 111.074 179.755 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -58.55 -39.2 79.57 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.099 0.476 . . . . 15.73 110.237 179.637 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 58.7 mttp -68.41 -40.1 81.4 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.665 -0.698 . . . . 17.66 110.682 179.497 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.464 HG12 ' O ' ' A' ' 87' ' ' GLU . 42.0 mm -60.06 -38.54 77.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.086 -0.506 . . . . 18.149999999999999 111.287 -179.826 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.573 ' HA ' HG21 ' A' ' 108' ' ' VAL . 12.8 m-85 -79.21 -35.37 41.78 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.386 -0.37 . . . . 18.34 111.333 -179.798 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 46.4 t0 -79.22 108.16 12.51 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.9 0.381 . . . . 19.289999999999999 110.946 -179.64 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.13 -9.55 58.82 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.979 -0.555 . . . . 22.25 111.313 -179.639 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.433 ' HB2' ' OD1' ' A' ' 97' ' ' ASP . 22.0 m-20 -117.18 168.08 10.62 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.888 0.375 . . . . 23.34 110.85 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -99.76 5.28 58.19 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.781 -0.723 . . . . 22.0 112.081 179.659 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.453 ' OD2' ' HB2' ' A' ' 99' ' ' PHE . 6.0 p-10 -63.27 -39.66 95.23 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.726 0.298 . . . . 22.280000000000001 111.061 -179.612 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 110.99 15.71 10.51 Favored Glycine 0 C--N 1.332 0.324 0 C-N-CA 120.659 -0.781 . . . . 19.93 112.921 179.727 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . 0.453 ' HB2' ' OD2' ' A' ' 97' ' ' ASP . 82.3 m-85 -139.69 152.12 46.45 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.892 0.377 . . . . 20.300000000000001 111.263 179.795 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.449 ' HB ' ' HB ' ' A' ' 136' ' ' ILE . 63.5 mt -114.68 132.13 64.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 115.964 -0.562 . . . . 19.370000000000001 110.8 179.71 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 35.2 p -114.35 155.96 45.06 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.206 -0.452 . . . . 22.489999999999998 110.756 -179.841 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_exo -40.54 -37.6 2.2 Favored 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 122.586 2.191 . . . . 23.0 112.567 -179.842 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.07 -49.52 77.02 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.131 0.491 . . . . 24.559999999999999 110.59 179.461 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . 0.432 ' O ' HG23 ' A' ' 108' ' ' VAL . 40.8 mt-10 -69.46 -32.75 71.88 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.612 -0.722 . . . . 22.23 110.694 179.922 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.55 HD12 HD12 ' A' ' 121' ' ' ILE . 3.4 tm? -62.24 -56.03 22.56 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.018 -0.537 . . . . 20.359999999999999 110.359 -179.775 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 3.2 ttp180 -56.06 -40.59 73.77 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.193 -0.458 . . . . 27.190000000000001 111.03 179.712 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -58.38 -46.9 85.47 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.189 0.44 . . . . 25.359999999999999 112.189 -179.316 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.573 HG21 ' HA ' ' A' ' 92' ' ' PHE . 17.6 t -78.77 -54.06 12.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 N-CA-C 111.967 0.358 . . . . 21.059999999999999 111.967 -179.1 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.495 ' HG3' ' CD1' ' A' ' 105' ' ' LEU . 1.1 mmt -47.03 -22.22 0.31 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 120.706 0.289 . . . . 20.93 111.4 -179.77 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 78.1 mt -95.26 -38.83 9.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 121.023 0.439 . . . . 25.129999999999999 110.354 178.88 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -58.57 -33.16 69.63 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.681 -0.69 . . . . 23.32 110.893 179.858 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.534 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 19.1 mt -66.7 -24.93 66.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.139 -0.482 . . . . 21.07 110.832 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 117.34 -7.99 15.92 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.945 -0.645 . . . . 23.050000000000001 112.49 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -82.54 127.43 33.32 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.718 0.294 . . . . 22.59 110.918 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -87.17 104.38 16.3 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.229 -0.441 . . . . 27.960000000000001 110.713 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . 0.483 ' HB ' HG23 ' A' ' 121' ' ' ILE . 3.2 m -123.42 149.94 27.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.158 -0.474 . . . . 24.75 111.504 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . 0.453 ' O ' HG12 ' A' ' 121' ' ' ILE . 67.5 p -98.73 144.54 27.86 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.791 -0.64 . . . . 27.239999999999998 110.061 179.182 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . 0.464 ' HA ' HD11 ' A' ' 121' ' ' ILE . 5.7 m-20 -48.65 -23.08 0.9 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.051 -0.522 . . . . 26.629999999999999 111.775 -179.492 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -77.31 -55.74 5.15 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 111.743 0.275 . . . . 29.140000000000001 111.743 -179.394 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . 0.406 ' OE1' HG12 ' A' ' 116' ' ' VAL . 13.2 pt-20 -59.52 -38.43 80.96 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.624 -0.262 . . . . 24.190000000000001 111.588 -179.19 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.55 HD12 HD12 ' A' ' 105' ' ' LEU . 33.5 pt -73.15 -34.53 45.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 C-N-CA 120.996 -0.282 . . . . 22.329999999999998 111.515 -179.946 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . 0.415 ' N ' HG13 ' A' ' 121' ' ' ILE . 15.5 t70 -57.05 -46.23 82.61 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.91 -0.404 . . . . 24.289999999999999 109.91 179.513 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.86 -37.69 88.47 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.068 -0.515 . . . . 24.739999999999998 110.119 179.038 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 5.2 ttp -53.16 -48.41 68.01 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.034 -0.53 . . . . 19.710000000000001 110.676 179.237 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.418 HG23 HD11 ' A' ' 136' ' ' ILE . 76.8 mt -61.05 -43.13 95.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.026 -0.534 . . . . 19.949999999999999 110.449 179.711 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 29.3 ttm180 -61.76 -33.82 74.76 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.957 -0.565 . . . . 24.949999999999999 110.87 179.841 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -69.06 -19.17 64.08 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.983 -0.553 . . . . 18.690000000000001 111.171 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.634 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -113.5 -5.06 13.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.228 -0.442 . . . . 16.469999999999999 111.217 -179.922 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 18.9 t0 -107.02 101.61 11.02 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.071 0.462 . . . . 20.399999999999999 110.903 -179.679 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 85.6 m-85 -86.77 -42.72 13.1 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.797 -0.638 . . . . 21.43 111.374 -179.784 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -59.69 -23.72 63.35 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.314 -0.403 . . . . 23.370000000000001 110.909 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 64.25 78.21 0.21 Allowed Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.857 -0.687 . . . . 24.32 112.739 179.632 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -143.38 6.56 1.49 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.844 0.354 . . . . 23.879999999999999 110.794 179.568 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 67.58 20.06 71.58 Favored Glycine 0 C--N 1.331 0.289 0 C-N-CA 120.87 -0.681 . . . . 22.670000000000002 112.698 179.888 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 72.8 mtp -136.76 155.24 50.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.805 0.336 . . . . 22.91 110.636 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.715 HG23 ' HB2' ' A' ' 140' ' ' GLU . 43.6 mm -114.7 144.76 21.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 121.163 0.506 . . . . 18.41 111.51 -179.566 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . 0.435 ' ND2' ' H ' ' A' ' 138' ' ' TYR . 4.0 t-20 -114.58 156.59 24.39 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.44 -0.8 . . . . 16.82 109.031 178.744 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.435 ' H ' ' ND2' ' A' ' 137' ' ' ASN . 34.1 t80 -41.8 -24.07 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 120.864 0.364 . . . . 14.65 111.141 179.82 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . 0.412 ' N ' ' O ' ' A' ' 137' ' ' ASN . 47.3 mt-10 -81.02 -55.35 4.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.113 -0.494 . . . . 14.82 110.632 179.928 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.715 ' HB2' HG23 ' A' ' 136' ' ' ILE . 36.9 mt-10 -57.38 -29.22 63.89 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.905 -0.589 . . . . 17.460000000000001 110.487 179.786 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.648 ' HA ' ' HE2' ' A' ' 144' ' ' MET . 86.0 t80 -71.68 -55.57 7.45 Favored 'General case' 0 C--N 1.334 -0.108 0 CA-C-N 116.06 -0.518 . . . . 12.93 110.122 179.322 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.555 HG13 ' SD ' ' A' ' 85' ' ' MET . 6.7 t -46.69 -35.13 2.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 CA-C-N 115.748 -0.66 . . . . 10.699999999999999 111.507 179.217 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 143' ' ' TRP . . . . . 0.569 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 84.1 t90 -73.35 -55.82 5.89 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.215 0.45 . . . . 13.66 112.215 -179.092 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . 0.648 ' HE2' ' HA ' ' A' ' 141' ' ' PHE . 20.1 ptt? -63.11 -19.97 64.93 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.916 0.709 . . . . 14.5 112.916 -177.884 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 145' ' ' ILE . . . . . 0.57 HG13 ' N ' ' A' ' 146' ' ' SER . 33.3 pt -81.44 -48.73 18.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 N-CA-C 112.02 0.378 . . . . 11.25 112.02 179.851 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 146' ' ' SER . . . . . 0.57 ' N ' HG13 ' A' ' 145' ' ' ILE . 29.3 t -63.95 -14.29 52.66 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-O 121.264 0.554 . . . . 8.5399999999999991 109.999 -179.711 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 147' ' ' GLN . . . . . 0.569 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 7.6 mm-40 -124.67 18.25 8.74 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.188 -0.915 . . . . 11.869999999999999 110.268 -179.235 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . 0.549 ' HB2' ' HA ' ' A' ' 145' ' ' ILE . 14.8 ttpp . . . . . 0 C--O 1.249 1.043 0 CA-C-N 115.289 -0.869 . . . . 13.68 111.053 -179.684 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.499 HD13 ' SG ' ' A' ' 69' ' ' CYS . 72.5 mt . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.928 0.394 . . . . 1.27 110.631 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -77.79 166.62 22.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.986 -0.552 . . . . 1.1200000000000001 111.008 -179.653 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -52.52 -52.31 55.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.512 -0.313 . . . . 2.2000000000000002 111.677 179.822 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -68.58 -40.16 80.65 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.049 0.452 . . . . 1.3500000000000001 110.838 -179.374 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -60.63 -40.88 93.54 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.644 -0.707 . . . . 2.2200000000000002 111.014 -179.837 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.518 ' HA ' ' CZ ' ' A' ' 12' ' ' PHE . 72.7 mt -63.58 -49.4 82.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.264 -0.426 . . . . 0.54000000000000004 110.414 179.821 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.98 -18.96 65.63 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.949 -0.569 . . . . 0.5 110.849 179.658 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -71.76 -56.96 4.81 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 116.06 -0.518 . . . . 2.27 111.646 -179.117 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.518 ' CZ ' ' HA ' ' A' ' 9' ' ' ILE . 9.3 p90 -77.76 -26.65 49.97 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.595 -0.442 . . . . 0.37 110.751 -179.714 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.419 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 20.0 tptm -64.23 -36.71 84.97 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.234 -0.654 . . . . 1.23 109.234 178.639 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.423 ' O ' HG22 ' A' ' 17' ' ' VAL . 19.7 t70 -67.46 -48.18 67.95 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.772 -0.649 . . . . 0.44 109.393 178.374 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.18 -14.81 61.5 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.884 -0.598 . . . . 0.28999999999999998 110.952 179.002 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.419 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 36.9 t80 -79.16 -47.49 15.96 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.866 -0.606 . . . . 0.47999999999999998 110.807 -179.4 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.423 HG22 ' O ' ' A' ' 14' ' ' ASP . 31.6 m -70.18 -24.75 26.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.135 -0.484 . . . . 1.1100000000000001 110.849 -179.916 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.415 ' HG2' ' O ' ' A' ' 14' ' ' ASP . 76.6 mm-40 -60.58 -32.14 71.24 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.96 -0.564 . . . . 1.6000000000000001 111.365 179.816 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 20.5 m-85 -85.93 -20.96 28.2 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.569 -0.287 . . . . 0.64000000000000001 111.537 -179.57 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -80.19 90.13 5.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.934 0.397 . . . . 0.44 110.855 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 12.3 mmmm -100.18 4.49 44.43 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.03 -0.532 . . . . 2.1000000000000001 111.218 -179.688 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -99.41 -36.72 9.49 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.225 -0.443 . . . . 1.8 111.233 -179.434 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 96.85 30.06 7.75 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.774 -0.727 . . . . 0.46000000000000002 112.811 179.614 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 31.1 p -103.57 10.79 36.85 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.655 0.264 . . . . 0.40000000000000002 111.166 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.93 15.96 30.12 Favored Glycine 0 C--N 1.331 0.282 0 C-N-CA 120.715 -0.755 . . . . 0.33000000000000002 112.045 -179.67 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.508 ' HE3' ' HB3' ' A' ' 62' ' ' GLN . 5.1 mtmt -139.79 151.95 46.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.661 0.267 . . . . 1.1000000000000001 110.712 -179.769 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.418 ' N ' HE22 ' A' ' 62' ' ' GLN . 50.3 pt -119.28 136.25 57.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.49 -0.323 . . . . 0.5 111.251 -179.839 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -50.39 125.9 13.81 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.356 -0.384 . . . . 0.29999999999999999 110.949 179.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 6.9 t -62.62 -16.15 55.23 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.119 -0.491 . . . . 1.03 111.036 -179.869 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 65.8 mtp180 -75.99 -18.79 59.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.082 -0.508 . . . . 3.0800000000000001 110.353 179.701 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -104.28 0.57 29.45 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.707 -0.678 . . . . 2.2599999999999998 110.478 179.621 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.419 ' O ' ' HG2' ' A' ' 36' ' ' MET . 0.9 OUTLIER -60.85 -49.49 77.26 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.025 -0.534 . . . . 1.3700000000000001 110.311 179.936 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.584 ' HA2' HD11 ' A' ' 48' ' ' LEU . . . -54.18 -39.17 63.24 Favored Glycine 0 C--N 1.332 0.343 0 C-N-CA 120.502 -0.856 . . . . 0.32000000000000001 111.347 179.077 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 94.2 m -66.24 -33.03 74.83 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.243 0.544 . . . . 0.31 109.963 178.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 65.6 tp -70.96 -20.68 62.42 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.536 -0.756 . . . . 1.24 110.701 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.419 ' HG2' ' O ' ' A' ' 32' ' ' LEU . 90.8 mmm -80.29 -49.64 11.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.259 -0.428 . . . . 1.1000000000000001 111.104 179.757 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 10.6 ptm180 -60.62 -34.39 74.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.446 -0.343 . . . . 2.6899999999999999 110.983 179.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 14.5 t -72.25 -13.16 61.45 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.065 0.46 . . . . 1.0600000000000001 110.611 179.295 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 86.1 mt -113.11 156.91 22.34 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.581 -0.736 . . . . 1.26 110.487 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -44.35 -31.73 2.42 Favored Glycine 0 CA--C 1.52 0.345 0 C-N-CA 120.686 -0.769 . . . . 0.68999999999999995 112.689 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -64.14 160.07 19.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.827 0.346 . . . . 1.97 110.965 179.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 17.6 p-10 -164.28 76.23 1.59 Allowed Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.153 -0.476 . . . . 2.6600000000000001 110.739 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -66.19 150.18 85.07 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.642 2.228 . . . . 0.51000000000000001 112.562 -179.712 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 19.6 m -71.29 157.06 38.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.04 -0.527 . . . . 0.72999999999999998 110.469 179.588 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.425 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 0.9 OUTLIER -48.48 -54.76 13.01 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 111.608 0.225 . . . . 2.7000000000000002 111.608 -179.703 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -48.16 -55.49 10.23 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.569 -0.287 . . . . 0.46000000000000002 111.749 -179.496 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -56.74 -48.44 77.78 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.318 -0.401 . . . . 2.23 110.564 -179.785 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.584 HD11 ' HA2' ' A' ' 33' ' ' GLY . 14.3 tp -57.26 -35.65 70.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.116 -0.493 . . . . 1.3600000000000001 110.888 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.425 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 37.0 mm-40 -72.57 -33.33 66.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.386 -0.37 . . . . 1.22 110.509 179.663 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 63.1 m-20 -69.31 -54.11 16.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.083 -0.508 . . . . 0.62 111.707 -179.725 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.54 HD21 ' HA ' ' A' ' 48' ' ' LEU . 1.2 pp -63.78 -44.08 94.44 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 112.077 0.399 . . . . 0.39000000000000001 112.077 -179.123 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 76.8 mt -64.1 -44.94 97.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.742 0.306 . . . . 0.5 111.081 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.77 -52.42 63.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.322 -0.399 . . . . 0.58999999999999997 111.152 -179.821 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -60.38 -34.05 73.34 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.423 -0.353 . . . . 2.54 110.637 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -77.78 -15.8 58.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.366 -0.379 . . . . 0.53000000000000003 110.914 179.553 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -80.3 -51.3 9.07 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.252 -0.431 . . . . 1.95 111.309 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 9.5 p30 -88.44 30.4 0.89 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.423 -0.353 . . . . 2.48 111.504 -179.416 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -149.34 -18.09 0.28 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.39 -0.368 . . . . 2.48 110.971 179.534 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 25.2 m-80 -135.79 21.38 3.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.217 -0.447 . . . . 2.0499999999999998 110.731 179.887 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 11.2 m120 61.49 -86.38 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.928 -0.578 . . . . 1.47 111.522 179.821 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -146.53 4.28 1.07 Allowed Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.564 -0.827 . . . . 0.42999999999999999 112.833 -179.683 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.508 ' HB3' ' HE3' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -114.96 150.41 35.79 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.03 0.443 . . . . 0.38 111.093 179.863 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.434 ' HG ' ' HB2' ' A' ' 67' ' ' GLU . 0.5 OUTLIER -118.02 153.02 34.38 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.603 -0.726 . . . . 1.4299999999999999 109.96 -179.939 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . 0.454 ' OD1' ' N ' ' A' ' 64' ' ' ASN . 0.6 OUTLIER -112.59 156.49 22.59 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.648 0.261 . . . . 1.1899999999999999 111.304 -178.388 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -48.54 -38.93 21.71 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.142 -0.481 . . . . 0.40000000000000002 110.919 179.862 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.22 -33.07 71.23 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.502 -0.317 . . . . 0.81000000000000005 111.065 179.779 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.434 ' HB2' ' HG ' ' A' ' 63' ' ' LEU . 12.9 mm-40 -66.32 -47.42 73.57 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.312 0.577 . . . . 1.3600000000000001 109.547 178.616 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.42 ' HE2' ' HB2' ' A' ' 12' ' ' PHE . 27.1 t80 -63.3 -55.35 25.45 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.297 -0.865 . . . . 0.51000000000000001 110.504 179.282 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.499 ' SG ' HD13 ' A' ' 4' ' ' LEU . 0.5 OUTLIER -56.18 -39.1 71.86 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.001 -0.545 . . . . 0.75 110.222 179.609 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -53.27 -50.25 53.02 Favored Glycine 0 N--CA 1.451 -0.343 0 CA-C-N 115.637 -0.711 . . . . 0.40999999999999998 112.148 179.682 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.546 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 11.6 mt -65.48 -44.09 94.29 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.36 0 CA-C-O 121.136 0.494 . . . . 0.51000000000000001 110.66 179.632 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . 0.456 ' O ' ' HB2' ' A' ' 76' ' ' MET . 21.4 mtp -53.27 -33.07 51.63 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.9 -0.591 . . . . 1.01 109.654 179.613 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.11 -44.63 68.6 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.99 -0.55 . . . . 0.69999999999999996 110.791 179.479 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.546 ' HG2' ' O ' ' A' ' 71' ' ' ILE . 0.0 OUTLIER -65.96 -33.25 75.38 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.394 -0.366 . . . . 1.3799999999999999 111.58 -179.355 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -83.16 -55.42 4.36 Favored 'General case' 0 CA--C 1.521 -0.135 0 CA-C-O 121.235 0.541 . . . . 1.98 111.14 -179.153 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . 0.456 ' HB2' ' O ' ' A' ' 72' ' ' MET . 84.0 mtp . . . . . 0 C--N 1.325 -0.461 0 CA-C-N 115.12 -0.946 . . . . 1.2 112.633 -178.82 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.507 ' O ' ' HG2' ' A' ' 85' ' ' MET . 5.2 t . . . . . 0 N--CA 1.469 0.497 0 CA-C-O 121.039 0.447 . . . . 7.29 111.64 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -41.33 -41.84 2.05 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.552 -0.749 . . . . 9.7400000000000002 112.743 -179.025 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -55.52 -53.37 57.25 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 111.861 0.319 . . . . 12.109999999999999 111.861 -179.171 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -64.26 -15.64 60.52 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.36 -0.382 . . . . 10.869999999999999 111.572 -179.308 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' MET . . . . . 0.507 ' HG2' ' O ' ' A' ' 81' ' ' THR . 13.3 mmm -81.02 -36.6 30.39 Favored 'General case' 0 CA--C 1.511 -0.537 0 CA-C-O 121.738 0.78 . . . . 11.09 109.304 -178.837 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 6.2 tpt180 -64.2 -52.67 57.75 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.246 -1.343 . . . . 15.52 110.353 179.351 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -58.6 -36.11 73.48 Favored 'General case' 0 C--O 1.233 0.187 0 N-CA-C 109.754 -0.462 . . . . 14.85 109.754 178.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.75 -36.47 80.6 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.049 -0.523 . . . . 14.109999999999999 110.589 178.688 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 94.7 t80 -72.3 -16.82 61.9 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 116.014 -0.539 . . . . 15.73 110.465 179.711 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 16.8 tttt -79.46 -49.03 12.92 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 115.572 -0.74 . . . . 17.66 110.684 -179.625 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 65.7 mt -71.71 -44.79 68.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.809 -0.632 . . . . 18.149999999999999 111.517 -179.708 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.566 ' HD1' HG11 ' A' ' 108' ' ' VAL . 2.5 m-85 -61.11 -44.29 97.58 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.396 -0.365 . . . . 18.34 111.314 -179.656 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 45.7 t0 -72.33 105.03 3.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.386 -0.37 . . . . 19.289999999999999 110.354 179.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.543 ' HG2' ' HB3' ' A' ' 104' ' ' GLU . 19.7 mmm180 -59.42 -53.79 54.07 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.007 -0.542 . . . . 22.25 110.933 -179.561 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.43 ' HB2' ' OD1' ' A' ' 97' ' ' ASP . 0.6 OUTLIER -86.24 170.82 11.76 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.068 -0.515 . . . . 23.34 110.722 -179.88 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -97.74 5.53 62.06 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.901 -0.666 . . . . 22.0 112.155 179.866 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.43 ' OD1' ' HB2' ' A' ' 95' ' ' ASP . 6.5 p-10 -56.97 -43.82 82.02 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.734 0.302 . . . . 22.280000000000001 111.109 -179.777 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 114.61 20.84 5.65 Favored Glycine 0 CA--C 1.518 0.241 0 C-N-CA 120.837 -0.697 . . . . 19.93 112.869 179.633 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . 0.408 ' HA ' ' O ' ' A' ' 136' ' ' ILE . 98.5 m-85 -144.98 145.76 31.66 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.785 0.326 . . . . 20.300000000000001 111.071 179.861 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 56.2 mt -114.6 130.4 69.03 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 CA-C-N 116.208 -0.451 . . . . 19.370000000000001 110.679 179.429 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 68.6 m -114.41 156.06 45.0 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-N 116.148 -0.478 . . . . 22.489999999999998 110.684 -179.666 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_exo -43.59 -37.55 8.2 Favored 'Trans proline' 0 C--N 1.349 0.564 0 C-N-CA 122.38 2.053 . . . . 23.0 112.492 -179.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -62.21 -43.5 98.68 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.096 0.474 . . . . 24.559999999999999 110.657 179.569 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . 0.543 ' HB3' ' HG2' ' A' ' 94' ' ' ARG . 43.8 mt-10 -73.82 -35.91 64.91 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.636 -0.711 . . . . 22.23 110.545 179.827 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.693 HD23 ' HB ' ' A' ' 121' ' ' ILE . 35.7 tp -60.75 -40.6 93.06 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.625 -0.716 . . . . 20.359999999999999 110.873 -179.606 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 8.7 ttm180 -69.98 -46.57 64.9 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.28 -0.418 . . . . 27.190000000000001 110.449 179.16 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -56.18 -41.83 76.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.992 -0.549 . . . . 25.359999999999999 111.58 -179.511 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.566 HG11 ' HD1' ' A' ' 92' ' ' PHE . 5.3 p -73.2 -49.23 39.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 C-N-CA 121.057 -0.257 . . . . 21.059999999999999 111.627 -179.516 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.464 ' N ' HG13 ' A' ' 108' ' ' VAL . 0.4 OUTLIER -50.5 -45.75 56.65 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.804 0.335 . . . . 20.93 110.667 179.936 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 42.4 mt -70.06 -30.16 42.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.174 -0.467 . . . . 25.129999999999999 110.185 179.31 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -68.18 -29.71 68.64 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.735 -0.666 . . . . 23.32 110.538 179.475 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.531 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 62.6 mt -72.97 -40.63 65.13 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.02 -0.536 . . . . 21.07 110.451 179.829 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 136.8 -1.59 3.21 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.941 -0.647 . . . . 23.050000000000001 112.331 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -117.02 130.73 56.87 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.926 0.393 . . . . 22.59 111.298 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 9.8 ptpp? -88.18 153.3 21.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.136 -0.484 . . . . 27.960000000000001 110.928 179.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . 0.435 ' HB ' HG23 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -152.1 155.6 6.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.03 -0.532 . . . . 24.75 111.314 -179.814 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . 0.467 ' O ' HG12 ' A' ' 121' ' ' ILE . 73.0 p -94.42 138.41 32.39 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.935 -0.575 . . . . 27.239999999999998 110.186 179.671 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . 0.414 ' HA ' HD11 ' A' ' 121' ' ' ILE . 22.2 m-20 -50.0 -19.63 0.76 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.017 -0.538 . . . . 26.629999999999999 111.571 -179.49 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -77.48 -55.24 5.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.47 -0.332 . . . . 29.140000000000001 111.842 -179.414 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -62.48 -41.15 98.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.479 -0.328 . . . . 24.190000000000001 111.773 -179.091 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.693 ' HB ' HD23 ' A' ' 105' ' ' LEU . 15.1 pt -70.35 -38.14 73.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 C-N-CA 120.982 -0.287 . . . . 22.329999999999998 111.412 -179.431 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . 0.421 ' N ' HG13 ' A' ' 121' ' ' ILE . 17.0 t70 -63.16 -32.87 74.36 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.928 0.394 . . . . 24.289999999999999 110.27 179.303 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 22.3 mm-40 -65.79 -46.97 76.7 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.012 -0.54 . . . . 24.739999999999998 110.53 179.541 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 55.5 ttp -56.73 -39.14 73.4 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.084 -0.507 . . . . 19.710000000000001 110.853 179.526 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.42 HD11 HD22 ' A' ' 105' ' ' LEU . 66.6 mt -64.92 -42.05 93.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.983 0.421 . . . . 19.949999999999999 110.301 179.61 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 35.2 ttp180 -59.14 -46.12 89.18 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.745 -0.662 . . . . 24.949999999999999 110.875 179.517 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -63.43 -29.73 70.97 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.832 -0.622 . . . . 18.690000000000001 111.237 -179.551 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.603 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -91.48 -13.84 31.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.852 0.358 . . . . 16.469999999999999 111.079 179.829 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . 0.42 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 5.9 t70 -101.04 105.86 17.1 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.123 -0.49 . . . . 20.399999999999999 110.924 -179.723 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -89.6 -41.36 12.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.951 -0.568 . . . . 21.43 111.609 -179.6 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -59.95 -26.14 65.75 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.867 0.365 . . . . 23.370000000000001 110.769 -179.614 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 72.05 79.34 0.44 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.804 -0.712 . . . . 24.32 112.87 179.782 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 13.3 p-10 -138.83 -33.28 0.65 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.651 0.263 . . . . 23.879999999999999 111.031 179.641 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 108.21 7.91 29.99 Favored Glycine 0 N--CA 1.452 -0.233 0 C-N-CA 120.799 -0.715 . . . . 22.670000000000002 112.669 179.892 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 63.9 mtp -130.71 155.53 46.46 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.622 0.249 . . . . 22.91 110.508 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.566 HG23 ' HB2' ' A' ' 140' ' ' GLU . 46.6 mm -114.69 143.34 24.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 121.207 0.527 . . . . 18.41 111.973 -179.501 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . 0.443 ' O ' ' N ' ' A' ' 139' ' ' GLU . 28.9 p-10 -115.71 157.94 23.54 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.282 -0.872 . . . . 16.82 108.749 178.257 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.669 ' O ' HG23 ' A' ' 142' ' ' VAL . 48.7 t80 -39.33 -24.23 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 112.312 0.486 . . . . 14.65 112.312 -179.358 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . 0.443 ' N ' ' O ' ' A' ' 137' ' ' ASN . 12.8 mm-40 -80.77 -56.29 4.24 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 120.742 0.306 . . . . 14.82 111.45 -179.55 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.566 ' HB2' HG23 ' A' ' 136' ' ' ILE . 44.0 mt-10 -62.1 -25.57 67.79 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.149 0.499 . . . . 17.460000000000001 110.015 179.788 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.549 ' CE2' HD13 ' A' ' 145' ' ' ILE . 63.7 t80 -70.13 -55.29 9.78 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.618 -0.719 . . . . 12.93 110.111 179.235 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.669 HG23 ' O ' ' A' ' 138' ' ' TYR . 43.6 t -47.83 -44.21 10.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.697 -0.683 . . . . 10.699999999999999 111.463 179.736 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 84.2 t90 -63.77 -55.34 23.89 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.406 0.521 . . . . 13.66 112.406 -178.883 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . 0.603 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 18.8 ptt? -61.31 -35.48 77.49 Favored 'General case' 0 N--CA 1.463 0.191 0 N-CA-C 112.726 0.639 . . . . 14.5 112.726 -177.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 145' ' ' ILE . . . . . 0.549 HD13 ' CE2' ' A' ' 141' ' ' PHE . 13.9 pt -76.53 -23.07 15.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 C-N-CA 120.809 -0.357 . . . . 11.25 111.721 -179.388 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 146' ' ' SER . . . . . 0.418 ' HB3' ' NE2' ' A' ' 147' ' ' GLN . 48.0 t -67.64 -29.84 69.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.99 0.424 . . . . 8.5399999999999991 110.245 179.945 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 147' ' ' GLN . . . . . 0.418 ' NE2' ' HB3' ' A' ' 146' ' ' SER . 13.9 mm-40 -91.61 -21.9 20.57 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.728 -0.669 . . . . 11.869999999999999 111.38 -179.759 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . 0.446 ' HG3' ' O ' ' A' ' 144' ' ' MET . 88.1 mttt . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.264 -0.874 . . . . 13.68 111.098 179.653 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.9 mp . . . . . 0 C--O 1.232 0.159 0 CA-C-O 120.699 0.285 . . . . 1.27 110.624 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -66.19 -153.71 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.846 0.355 . . . . 1.1200000000000001 111.242 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -80.3 -54.95 5.26 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.116 0.484 . . . . 2.2000000000000002 110.537 -179.561 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -70.29 -28.59 65.31 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.722 -0.672 . . . . 1.3500000000000001 110.199 179.812 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -66.57 -48.17 70.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.675 -0.693 . . . . 2.2200000000000002 110.565 179.575 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.541 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 64.5 mt -60.28 -40.68 84.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.08 -0.509 . . . . 0.54000000000000004 110.885 179.831 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -77.12 -18.79 57.66 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.979 0.418 . . . . 0.5 110.673 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -72.24 -56.26 5.83 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.865 -0.607 . . . . 2.27 111.751 -179.154 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.541 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 8.3 p90 -75.99 -26.83 57.1 Favored 'General case' 0 C--N 1.333 -0.152 0 C-N-CA 120.577 -0.449 . . . . 0.37 110.758 -179.843 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 26.1 tptp -64.12 -37.05 86.04 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 109.467 -0.568 . . . . 1.23 109.467 178.74 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -70.12 -46.79 64.06 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.857 -0.61 . . . . 0.44 109.691 178.666 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.69 -19.9 66.01 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.903 -0.59 . . . . 0.28999999999999998 110.392 179.246 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -79.4 -39.15 33.16 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.573 -0.739 . . . . 0.47999999999999998 110.522 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -71.57 -26.04 25.63 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.701 0 CA-C-N 115.939 -0.573 . . . . 1.1100000000000001 111.05 -179.888 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 82.2 mm-40 -61.13 -29.48 69.8 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.793 -0.64 . . . . 1.6000000000000001 111.357 -179.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 47.9 m-85 -93.16 -6.95 46.71 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.596 -0.275 . . . . 0.64000000000000001 111.338 -179.792 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -97.85 89.62 4.66 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.889 0.376 . . . . 0.44 110.697 179.395 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -99.52 -21.18 16.03 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.042 -0.526 . . . . 2.1000000000000001 111.266 -179.759 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -78.05 -11.08 59.88 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.262 -0.426 . . . . 1.8 111.193 -179.711 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.5 7.45 87.1 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.765 -0.731 . . . . 0.46000000000000002 112.814 179.702 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 76.2 p -76.67 5.36 7.68 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.674 0.273 . . . . 0.40000000000000002 111.146 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 56.15 23.84 41.58 Favored Glycine 0 C--N 1.332 0.331 0 C-N-CA 120.811 -0.709 . . . . 0.33000000000000002 111.73 -179.608 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.675 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 36.1 mtpt -136.09 155.87 49.56 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.725 0.298 . . . . 1.1000000000000001 111.346 -179.244 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.493 HG13 HD12 ' A' ' 63' ' ' LEU . 44.3 pt -117.93 129.8 73.77 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.2 0 CA-C-O 120.951 0.405 . . . . 0.5 111.367 179.876 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -52.47 141.3 20.33 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.186 -0.461 . . . . 0.29999999999999999 111.29 -179.732 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.511 ' HA ' HD11 ' A' ' 63' ' ' LEU . 38.7 p -66.69 -12.84 60.09 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.852 -0.613 . . . . 1.03 111.254 -179.896 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 39.0 mtp180 -89.43 5.34 45.73 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.974 -0.557 . . . . 3.0800000000000001 110.676 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -124.57 -7.92 7.43 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.081 -0.509 . . . . 2.2599999999999998 111.296 -179.537 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.669 HD23 HD13 ' A' ' 63' ' ' LEU . 1.2 tm? -56.15 -52.73 63.31 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.553 -0.294 . . . . 1.3700000000000001 110.746 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -53.95 -44.9 72.16 Favored Glycine 0 C--N 1.33 0.244 0 C-N-CA 120.598 -0.81 . . . . 0.32000000000000001 111.979 179.701 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 45.2 m -60.55 -32.52 71.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.037 0.446 . . . . 0.31 110.512 179.432 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -69.06 -31.36 70.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.815 -0.63 . . . . 1.24 110.701 -179.99 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.401 ' HG2' ' O ' ' A' ' 32' ' ' LEU . 69.7 mmm -76.96 -24.86 52.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.205 -0.452 . . . . 1.1000000000000001 110.325 179.766 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -71.32 -48.43 50.52 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.256 -0.429 . . . . 2.6899999999999999 110.581 179.319 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.2 t -64.52 -13.81 54.28 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.037 -0.529 . . . . 1.0600000000000001 111.21 179.847 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 10.4 mp -113.54 156.38 23.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.187 -0.46 . . . . 1.26 110.441 179.778 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -50.2 -18.32 2.14 Favored Glycine 0 CA--C 1.52 0.38 0 CA-C-N 115.827 -0.624 . . . . 0.68999999999999995 114.175 -179.014 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 11.8 mp0 -64.61 163.09 14.35 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 117.42 0.61 . . . . 1.97 111.105 -179.881 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -165.21 72.27 1.41 Allowed Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 115.932 -0.576 . . . . 2.6600000000000001 110.834 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -66.61 164.22 29.81 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.648 2.232 . . . . 0.51000000000000001 112.437 -179.833 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 44.2 m -82.58 152.05 26.12 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.028 -0.533 . . . . 0.72999999999999998 110.752 179.757 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -45.47 -52.52 10.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.441 -0.345 . . . . 2.7000000000000002 111.344 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.95 -47.82 70.9 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.215 -0.448 . . . . 0.46000000000000002 111.592 -179.738 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -53.38 -55.0 28.54 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.391 -0.368 . . . . 2.23 111.282 -179.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.408 HD23 HD21 ' A' ' 51' ' ' LEU . 39.6 mt -57.98 -44.86 87.35 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.537 -0.302 . . . . 1.3600000000000001 110.955 -179.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 83.5 mm-40 -62.56 -29.88 70.91 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.728 0.299 . . . . 1.22 111.288 -179.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -76.09 -52.59 9.83 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.345 -0.389 . . . . 0.62 111.903 -179.285 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.408 HD21 HD23 ' A' ' 48' ' ' LEU . 2.2 pp -68.94 -38.19 79.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.567 -0.288 . . . . 0.39000000000000001 111.602 -179.133 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 85.0 mt -65.06 -53.28 43.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.628 -0.26 . . . . 0.5 110.969 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.5 -35.47 79.47 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.799 0.333 . . . . 0.58999999999999997 111.145 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -62.92 -55.16 28.48 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.319 -0.401 . . . . 2.54 110.535 179.734 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -71.18 -14.83 62.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.076 -0.511 . . . . 0.53000000000000003 111.348 179.777 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -65.98 -51.93 54.01 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.435 -0.348 . . . . 1.95 110.979 -179.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 28.7 p-10 -94.58 22.22 6.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.215 -0.448 . . . . 2.48 111.352 -179.649 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 12.1 m120 -134.36 -5.26 2.62 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.371 -0.377 . . . . 2.48 110.979 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 34.3 m-80 -146.4 14.35 1.26 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.34 -0.391 . . . . 2.0499999999999998 111.046 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 28.4 m-80 62.96 7.69 2.79 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.027 -0.533 . . . . 1.47 111.845 179.578 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 108.0 38.66 1.97 Allowed Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.617 -0.801 . . . . 0.42999999999999999 112.945 179.49 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.675 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -144.21 155.51 43.92 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.974 0.416 . . . . 0.38 111.195 179.749 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.669 HD13 HD23 ' A' ' 32' ' ' LEU . 8.4 mt -128.37 153.99 46.47 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-N 116.033 -0.53 . . . . 1.4299999999999999 110.395 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -112.43 156.38 22.64 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 121.143 -0.223 . . . . 1.1899999999999999 110.696 -179.633 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -42.74 -32.44 0.6 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.285 -0.416 . . . . 0.40000000000000002 111.074 179.646 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.49 -41.27 55.82 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.209 -0.45 . . . . 0.81000000000000005 112.012 -179.727 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -63.36 -52.76 60.38 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.323 -0.399 . . . . 1.3600000000000001 110.493 -179.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.488 ' HD1' HD21 ' A' ' 32' ' ' LEU . 17.8 t80 -59.69 -55.16 37.87 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.933 -0.576 . . . . 0.51000000000000001 110.478 179.312 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 8.4 t -55.72 -41.96 74.61 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-N 116.077 -0.51 . . . . 0.75 110.468 179.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -48.81 -55.36 11.5 Favored Glycine 0 N--CA 1.45 -0.378 0 CA-C-N 115.462 -0.79 . . . . 0.40999999999999998 111.952 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.424 ' HA ' ' HG2' ' A' ' 74' ' ' LYS . 9.3 mt -64.41 -36.9 78.57 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 CA-C-O 120.897 0.379 . . . . 0.51000000000000001 110.422 179.386 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . 0.471 ' HG3' ' O ' ' A' ' 68' ' ' PHE . 42.4 mtp -60.57 -28.67 68.64 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.87 -0.604 . . . . 1.01 110.055 179.27 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.31 -47.23 62.06 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.672 -0.694 . . . . 0.69999999999999996 110.433 179.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.424 ' HG2' ' HA ' ' A' ' 71' ' ' ILE . 54.2 pttt -75.14 -24.71 58.02 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.196 -0.457 . . . . 1.3799999999999999 111.203 179.671 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -80.13 -55.39 4.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.18 -0.464 . . . . 1.98 111.452 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 11.5 mtm . . . . . 0 N--CA 1.449 -0.495 0 CA-C-N 116.296 -0.411 . . . . 1.2 111.16 -179.754 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.622 ' O ' ' HG3' ' A' ' 85' ' ' MET . 96.7 m . . . . . 0 C--O 1.226 -0.156 0 N-CA-C 110.249 -0.278 . . . . 7.29 110.249 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.512 ' HA ' ' SD ' ' A' ' 85' ' ' MET . 11.8 pt-20 -76.9 -20.65 55.97 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 113.362 0.875 . . . . 9.7400000000000002 113.362 -177.895 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.421 ' HG3' ' N ' ' A' ' 84' ' ' GLU . 10.9 pt-20 -59.61 -54.8 42.31 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.949 -0.3 . . . . 12.109999999999999 111.579 -179.245 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.499 ' HG2' HG22 ' A' ' 81' ' ' THR . 13.0 pt-20 -68.21 -14.39 62.95 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.772 0.32 . . . . 10.869999999999999 111.099 -179.678 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' MET . . . . . 0.622 ' HG3' ' O ' ' A' ' 81' ' ' THR . 20.2 mtt -77.66 -52.66 8.62 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.224 -0.444 . . . . 11.09 110.75 -179.5 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.403 ' O ' ' HG3' ' A' ' 90' ' ' LYS . 28.2 ttp180 -58.48 -46.92 85.65 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.961 -0.563 . . . . 15.52 110.402 179.862 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.46 ' HA ' ' HE2' ' A' ' 90' ' ' LYS . 1.4 tm-20 -55.78 -48.97 74.41 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 121.146 0.498 . . . . 14.85 109.976 178.917 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -63.76 -28.3 69.78 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.823 -0.626 . . . . 14.109999999999999 110.984 179.631 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 70.6 t80 -67.97 -38.02 82.24 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.018 0.437 . . . . 15.73 110.315 179.586 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . 0.46 ' HE2' ' HA ' ' A' ' 87' ' ' GLU . 44.1 mtmt -64.05 -43.77 94.53 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.837 -0.62 . . . . 17.66 110.496 179.583 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 58.2 mt -63.76 -45.59 96.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.172 -0.467 . . . . 18.149999999999999 111.254 -179.922 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.606 ' HA ' HG21 ' A' ' 108' ' ' VAL . 6.3 m-85 -70.82 -14.7 62.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.473 -0.33 . . . . 18.34 111.449 -179.688 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -105.8 106.3 16.73 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.897 0.379 . . . . 19.289999999999999 110.868 179.791 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.67 -49.56 18.0 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.006 -0.543 . . . . 22.25 111.106 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -74.36 167.52 21.49 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.206 -0.452 . . . . 23.34 110.907 -179.884 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -94.19 5.16 71.42 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.886 -0.673 . . . . 22.0 112.033 179.609 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -67.89 -27.23 66.48 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.757 0.313 . . . . 22.280000000000001 111.189 -179.914 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 87.43 34.41 10.49 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.796 -0.716 . . . . 19.93 112.506 179.658 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . 0.502 ' HA ' ' O ' ' A' ' 136' ' ' ILE . 96.4 m-85 -141.08 147.46 38.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.663 0.268 . . . . 20.300000000000001 110.982 -179.954 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.523 ' HB ' ' HB ' ' A' ' 136' ' ' ILE . 58.3 mt -114.48 122.44 68.6 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 CA-C-N 116.24 -0.436 . . . . 19.370000000000001 111.265 -179.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 23.3 m -115.04 156.7 44.93 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 115.781 -0.645 . . . . 22.489999999999998 110.338 179.796 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 92.1 Cg_exo -41.18 -33.16 1.26 Allowed 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.408 2.072 . . . . 23.0 112.764 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.76 -41.73 87.29 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.249 -0.432 . . . . 24.559999999999999 111.498 -179.776 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . 0.435 ' O ' HG23 ' A' ' 108' ' ' VAL . 44.4 mt-10 -79.87 -49.53 11.81 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.863 -0.608 . . . . 22.23 110.114 -179.482 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.526 HD11 ' HE3' ' A' ' 109' ' ' MET . 49.3 tp -51.95 -32.56 33.78 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.274 -0.875 . . . . 20.359999999999999 110.922 179.515 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 7.3 tmm_? -77.39 -48.23 17.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.754 -0.657 . . . . 27.190000000000001 110.987 -179.747 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 66.2 t80 -58.82 -34.41 71.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.215 -0.448 . . . . 25.359999999999999 111.557 -179.636 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.606 HG21 ' HA ' ' A' ' 92' ' ' PHE . 46.5 t -80.26 -53.71 12.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 N-CA-C 112.352 0.501 . . . . 21.059999999999999 112.352 -178.719 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.526 ' HE3' HD11 ' A' ' 105' ' ' LEU . 1.5 mtt -47.06 -37.44 9.47 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 111.858 0.318 . . . . 20.93 111.858 -179.333 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 89.2 mt -64.7 -35.02 73.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.773 0.32 . . . . 25.129999999999999 110.928 179.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -67.61 -39.1 84.77 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.185 -0.461 . . . . 23.32 110.598 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.411 HD12 ' N ' ' A' ' 112' ' ' LEU . 8.6 mp -67.29 -43.25 82.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.987 -0.551 . . . . 21.07 110.822 -179.971 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 117.98 21.16 4.26 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.771 -0.728 . . . . 23.050000000000001 112.617 179.636 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -83.16 -23.01 33.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.566 0.222 . . . . 22.59 111.352 -179.841 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp 50.21 85.39 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.278 -0.419 . . . . 27.960000000000001 110.994 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . 0.434 HG12 ' OE1' ' A' ' 120' ' ' GLU . 8.8 m -129.17 155.79 41.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.138 -0.483 . . . . 24.75 111.844 -179.545 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . 0.471 ' O ' HG12 ' A' ' 121' ' ' ILE . 57.8 p -100.62 148.48 24.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.673 -0.694 . . . . 27.239999999999998 110.084 179.072 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . 0.455 ' HA ' HD11 ' A' ' 121' ' ' ILE . 9.2 m-20 -51.83 -19.48 1.72 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.363 -0.38 . . . . 26.629999999999999 111.727 -179.37 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -78.95 -55.43 5.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.441 -0.345 . . . . 29.140000000000001 111.755 -179.443 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . 0.434 ' OE1' HG12 ' A' ' 116' ' ' VAL . 14.5 pt-20 -60.84 -39.33 88.7 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.569 -0.287 . . . . 24.190000000000001 111.754 -179.245 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.564 HG13 ' N ' ' A' ' 122' ' ' ASP . 9.5 pt -69.86 -46.69 73.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 120.918 -0.313 . . . . 22.329999999999998 111.517 -179.69 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . 0.564 ' N ' HG13 ' A' ' 121' ' ' ILE . 13.7 t70 -50.95 -41.11 58.83 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.835 0.35 . . . . 24.289999999999999 110.529 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -61.84 -54.37 43.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.045 -0.525 . . . . 24.739999999999998 110.131 179.189 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.431 ' CE ' HD21 ' A' ' 105' ' ' LEU . 5.4 tmm? -51.2 -34.26 31.04 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 115.817 -0.629 . . . . 19.710000000000001 110.745 179.357 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.46 HG13 ' O ' ' A' ' 121' ' ' ILE . 69.9 mt -65.01 -41.3 91.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.0 -0.546 . . . . 19.949999999999999 110.448 179.519 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 55.3 ttt180 -57.62 -38.26 74.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.745 -0.661 . . . . 24.949999999999999 110.402 179.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -61.69 -48.21 81.81 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.647 -0.706 . . . . 18.690000000000001 111.186 179.622 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.57 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -81.73 -7.38 59.59 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.097 -0.502 . . . . 16.469999999999999 111.167 -179.674 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -100.42 107.23 18.92 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.221 -0.445 . . . . 20.399999999999999 110.857 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 68.9 m-85 -94.06 -42.76 8.84 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.684 -0.689 . . . . 21.43 111.128 -179.748 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -55.9 -34.48 65.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.053 -0.521 . . . . 23.370000000000001 111.048 -179.627 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 81.17 72.24 1.24 Allowed Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.858 -0.686 . . . . 24.32 112.589 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -143.08 -5.54 0.87 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.717 0.294 . . . . 23.879999999999999 111.305 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 77.47 8.8 87.1 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.795 -0.717 . . . . 22.670000000000002 112.536 179.839 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 61.9 mtp -121.34 155.33 34.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.752 0.311 . . . . 22.91 110.516 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.712 HG23 ' HB2' ' A' ' 140' ' ' GLU . 38.7 mm -115.61 142.33 29.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 121.217 0.532 . . . . 18.41 112.092 -179.434 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . 0.443 ' O ' ' N ' ' A' ' 139' ' ' GLU . 54.3 t30 -115.71 157.54 24.12 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.323 -0.853 . . . . 16.82 108.985 178.431 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 45.7 t80 -39.7 -24.62 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 120.628 0.251 . . . . 14.65 111.604 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . 0.443 ' N ' ' O ' ' A' ' 137' ' ' ASN . 46.7 mt-10 -80.79 -55.42 4.82 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.724 0.297 . . . . 14.82 110.803 -179.871 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.712 ' HB2' HG23 ' A' ' 136' ' ' ILE . 29.6 mt-10 -58.66 -35.64 72.87 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.152 0.501 . . . . 17.460000000000001 110.256 179.614 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.473 ' CE2' HD13 ' A' ' 145' ' ' ILE . 86.9 t80 -65.39 -55.43 18.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.658 -0.701 . . . . 12.93 110.296 179.484 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.587 HG13 ' SD ' ' A' ' 85' ' ' MET . 2.6 t -48.53 -34.18 5.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.55 -0.75 . . . . 10.699999999999999 111.78 179.366 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 143' ' ' TRP . . . . . 0.515 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 92.5 t90 -71.53 -55.51 7.69 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.577 0.584 . . . . 13.66 112.577 -178.79 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . 0.57 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 21.5 ptt? -63.33 -26.53 68.8 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 112.819 0.674 . . . . 14.5 112.819 -177.675 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 145' ' ' ILE . . . . . 0.525 HG13 ' N ' ' A' ' 146' ' ' SER . 47.4 pt -81.01 -37.67 16.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 112.318 0.488 . . . . 11.25 112.318 -179.525 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 146' ' ' SER . . . . . 0.525 ' N ' HG13 ' A' ' 145' ' ' ILE . 33.2 t -59.32 -14.25 10.92 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.32 0.581 . . . . 8.5399999999999991 110.583 -179.537 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 147' ' ' GLN . . . . . 0.515 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 3.5 mm-40 -100.58 -20.5 15.66 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.298 -0.865 . . . . 11.869999999999999 111.245 -178.993 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 68.5 mttm . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.179 -0.915 . . . . 13.68 110.87 179.744 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.53 HD12 ' SG ' ' A' ' 69' ' ' CYS . 15.6 mt . . . . . 0 C--O 1.232 0.135 0 CA-C-O 120.843 0.354 . . . . 1.27 111.051 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 75.0 p -69.41 -169.11 0.19 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.103 -0.499 . . . . 1.1200000000000001 111.44 -179.65 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -76.25 -38.26 56.54 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.35 -0.386 . . . . 2.2000000000000002 111.025 -179.565 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -72.75 -42.45 64.04 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.143 -0.48 . . . . 1.3500000000000001 110.928 -179.837 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -60.16 -47.81 84.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.144 -0.48 . . . . 2.2200000000000002 110.645 179.758 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.571 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 82.4 mt -57.38 -52.23 59.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.863 -0.608 . . . . 0.54000000000000004 111.195 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.91 -23.67 65.41 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.276 -0.42 . . . . 0.5 112.024 -179.411 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -71.42 -57.36 4.51 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 111.865 0.32 . . . . 2.27 111.865 -179.124 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.571 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 17.2 p90 -77.52 -23.43 50.19 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 120.47 -0.492 . . . . 0.37 110.645 -179.546 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.452 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 19.9 tptm -66.94 -36.07 81.4 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 109.229 -0.656 . . . . 1.23 109.229 178.528 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -67.89 -46.3 72.02 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 108.75 -0.833 . . . . 0.44 108.75 178.081 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.03 -14.46 61.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.488 -0.778 . . . . 0.28999999999999998 110.188 178.628 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.452 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 49.9 t80 -80.0 -52.16 8.18 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.819 -0.628 . . . . 0.47999999999999998 110.683 -179.839 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 24.6 m -63.43 -24.95 37.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.118 -0.492 . . . . 1.1100000000000001 110.516 -179.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 61.3 mm-40 -57.7 -28.67 64.04 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.671 -0.695 . . . . 1.6000000000000001 111.331 179.544 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -105.23 36.53 2.45 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.665 0.269 . . . . 0.64000000000000001 111.472 -179.692 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -129.69 68.9 1.42 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.157 0.503 . . . . 0.44 110.396 179.398 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -83.07 5.14 23.4 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.655 -0.702 . . . . 2.1000000000000001 111.222 -179.727 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -103.0 -2.77 27.03 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.367 -0.379 . . . . 1.8 111.193 -179.519 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 63.23 17.89 59.85 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.828 -0.701 . . . . 0.46000000000000002 112.812 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 37.5 p -92.18 8.39 38.24 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.71 0.291 . . . . 0.40000000000000002 111.242 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 54.14 21.45 18.26 Favored Glycine 0 C--N 1.333 0.383 0 C-N-CA 120.732 -0.747 . . . . 0.33000000000000002 111.79 -179.445 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.664 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 36.5 mtpt -133.96 155.76 49.37 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.549 -0.326 . . . . 1.1000000000000001 110.551 -179.295 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.508 ' N ' HE22 ' A' ' 62' ' ' GLN . 49.1 pt -118.73 130.89 72.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 120.901 0.382 . . . . 0.5 111.684 -179.781 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -54.1 135.68 43.1 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.226 -0.443 . . . . 0.29999999999999999 111.025 179.897 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.505 ' HA ' HD11 ' A' ' 63' ' ' LEU . 7.3 t -63.11 -22.2 66.7 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.047 -0.524 . . . . 1.03 111.223 -179.851 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 41.1 mtp180 -77.74 -3.89 43.56 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.082 -0.508 . . . . 3.0800000000000001 110.459 179.774 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -113.53 -5.43 13.45 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.942 -0.572 . . . . 2.2599999999999998 111.142 -179.804 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.57 -44.76 95.84 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 110.15 -0.315 . . . . 1.3700000000000001 110.15 179.65 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -58.43 -43.39 95.86 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.332 -0.937 . . . . 0.32000000000000001 110.976 178.828 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 44.8 m -65.16 -30.72 71.66 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.494 -0.558 . . . . 0.31 109.494 178.544 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 13.7 tp -64.21 -35.4 80.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.382 -0.826 . . . . 1.24 109.506 179.247 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.529 ' HG3' ' HG3' ' A' ' 43' ' ' PRO . 20.3 mmt -66.4 -41.28 89.56 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 115.535 -0.757 . . . . 1.1000000000000001 109.895 178.852 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 59.8 mtp180 -63.5 -26.95 68.95 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.628 -0.715 . . . . 2.6899999999999999 109.93 179.075 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.521 HG22 HD12 ' A' ' 39' ' ' LEU . 2.5 m -79.32 -16.56 56.16 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.536 -0.757 . . . . 1.0600000000000001 110.025 179.322 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.521 HD12 HG22 ' A' ' 38' ' ' THR . 10.3 mp -113.99 157.74 22.07 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.261 -0.881 . . . . 1.26 110.225 179.861 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -74.03 36.33 0.91 Allowed Glycine 0 CA--C 1.519 0.319 0 C-N-CA 120.498 -0.858 . . . . 0.68999999999999995 112.439 179.485 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.427 ' HG2' ' HB3' ' A' ' 39' ' ' LEU . 4.5 mm100 -89.29 -70.57 0.65 Allowed 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.831 0.348 . . . . 1.97 111.306 -179.88 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 60.24 67.48 1.64 Allowed Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 115.945 -0.57 . . . . 2.6600000000000001 110.488 -179.189 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.529 ' HG3' ' HG3' ' A' ' 36' ' ' MET . 69.3 Cg_endo -72.8 -172.86 1.04 Allowed 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.68 2.253 . . . . 0.51000000000000001 112.466 -179.88 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -93.01 150.35 20.6 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.936 -0.574 . . . . 0.72999999999999998 111.003 179.684 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.482 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 15.6 mt-10 -54.6 -46.13 73.77 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.524 -0.307 . . . . 2.7000000000000002 110.645 179.685 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -55.69 -52.94 62.16 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.302 -0.408 . . . . 0.46000000000000002 111.067 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -54.62 -47.26 73.65 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.182 -0.463 . . . . 2.23 110.893 -179.884 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.478 HD22 HD11 ' A' ' 52' ' ' ILE . 15.3 mt -60.39 -45.29 94.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.323 -0.399 . . . . 1.3600000000000001 110.971 179.746 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.482 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 33.0 mm-40 -63.08 -33.67 75.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.693 0.282 . . . . 1.22 111.145 -179.717 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -72.12 -54.03 10.97 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.214 0.45 . . . . 0.62 112.214 -179.299 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 3.2 pp -69.99 -41.26 74.63 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.127 0.417 . . . . 0.39000000000000001 112.127 -178.768 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.478 HD11 HD22 ' A' ' 48' ' ' LEU . 86.6 mt -65.3 -38.72 83.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-O 120.485 0.183 . . . . 0.5 111.093 -179.654 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.65 -37.91 83.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.89 0.376 . . . . 0.58999999999999997 110.516 179.487 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -64.38 -40.89 96.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.069 -0.514 . . . . 2.54 109.994 179.164 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -80.16 -14.76 58.22 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.968 -0.56 . . . . 0.53000000000000003 111.021 179.241 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -66.57 -49.96 64.69 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.262 -0.426 . . . . 1.95 110.948 -179.885 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 34.9 m-80 -85.88 34.85 0.61 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.151 -0.477 . . . . 2.48 110.806 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -157.41 151.57 24.73 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.165 -0.47 . . . . 2.48 110.757 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 4.1 m120 63.25 10.3 4.57 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.981 -0.554 . . . . 2.0499999999999998 111.404 179.847 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 15.2 m120 62.74 13.33 6.34 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.336 -0.393 . . . . 1.47 111.845 179.702 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 104.67 38.5 2.55 Favored Glycine 0 C--N 1.33 0.247 0 C-N-CA 120.551 -0.833 . . . . 0.42999999999999999 112.763 179.419 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.664 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -142.5 155.61 45.06 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.991 0.424 . . . . 0.38 110.886 179.688 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.505 HD11 ' HA ' ' A' ' 29' ' ' THR . 29.0 mt -127.19 154.22 45.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.233 -0.44 . . . . 1.4299999999999999 110.92 -179.805 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . 0.501 ' OD1' ' HE3' ' A' ' 26' ' ' LYS . 0.3 OUTLIER -114.37 157.33 22.98 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.665 -0.494 . . . . 1.1899999999999999 109.665 179.113 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 90.6 t80 -41.19 -33.88 0.41 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.578 0.228 . . . . 0.40000000000000002 111.361 179.871 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 8.2 m -70.78 -39.84 72.95 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.505 -0.316 . . . . 0.81000000000000005 111.622 -179.766 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.468 ' HG2' HD22 ' A' ' 64' ' ' ASN . 13.6 mm-40 -59.71 -55.75 30.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.126 0.489 . . . . 1.3600000000000001 110.804 179.668 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 25.3 t80 -63.77 -52.26 61.15 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.649 -0.705 . . . . 0.51000000000000001 111.145 -179.646 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.53 ' SG ' HD12 ' A' ' 4' ' ' LEU . 19.4 t -53.87 -40.85 66.92 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-O 121.378 0.609 . . . . 0.75 109.886 179.577 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -53.38 -46.6 64.09 Favored Glycine 0 CA--C 1.503 -0.704 0 CA-C-N 114.909 -1.041 . . . . 0.40999999999999998 111.719 179.523 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.537 ' HA ' ' HG2' ' A' ' 74' ' ' LYS . 44.8 mt -73.42 -45.86 50.89 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.93 0 CA-C-O 120.863 0.364 . . . . 0.51000000000000001 111.44 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . 0.442 ' HB3' ' HE2' ' A' ' 76' ' ' MET . 0.1 OUTLIER -52.18 -33.45 40.73 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.816 -0.629 . . . . 1.01 110.181 179.235 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.91 -51.07 43.88 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.729 -0.669 . . . . 0.69999999999999996 110.874 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.537 ' HG2' ' HA ' ' A' ' 71' ' ' ILE . 63.6 pttt -69.63 -27.27 64.92 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 120.85 0.357 . . . . 1.3799999999999999 111.622 -179.82 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . 0.468 ' NE2' ' HB3' ' A' ' 43' ' ' PRO . 30.8 tt0 -80.63 -55.11 5.07 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.24 -0.436 . . . . 1.98 111.816 -179.141 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . 0.442 ' HE2' ' HB3' ' A' ' 72' ' ' MET . 31.6 mtm . . . . . 0 N--CA 1.451 -0.42 0 CA-C-N 116.313 -0.403 . . . . 1.2 111.166 -179.514 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.422 ' O ' ' HG3' ' A' ' 85' ' ' MET . 75.4 m . . . . . 0 N--CA 1.461 0.105 0 CA-C-O 120.644 0.259 . . . . 7.29 110.571 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.55 ' HA ' ' SD ' ' A' ' 85' ' ' MET . 44.9 mt-10 -79.78 -16.69 55.07 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 112.534 0.568 . . . . 9.7400000000000002 112.534 -178.713 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -69.18 -55.85 9.38 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.697 0.284 . . . . 12.109999999999999 111.638 -179.402 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -63.42 -15.23 56.99 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.922 0.392 . . . . 10.869999999999999 111.061 -179.798 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' MET . . . . . 0.657 ' SD ' HG13 ' A' ' 142' ' ' VAL . 19.0 mtt -80.18 -53.81 6.33 Favored 'General case' 0 CA--C 1.514 -0.405 0 CA-C-N 116.087 -0.506 . . . . 11.09 110.224 -179.65 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.449 ' O ' ' HG3' ' A' ' 90' ' ' LYS . 38.4 ttt180 -51.56 -41.04 60.84 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.28 -0.873 . . . . 15.52 110.378 179.362 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -72.15 -35.17 69.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.122 -0.49 . . . . 14.85 110.423 179.274 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -69.17 -28.3 66.29 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.123 -0.49 . . . . 14.109999999999999 111.051 179.713 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 86.3 t80 -73.82 -46.21 46.6 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.322 -0.399 . . . . 15.73 110.445 179.904 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . 0.449 ' HG3' ' O ' ' A' ' 86' ' ' ARG . 90.5 mttt -58.25 -38.14 76.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.015 -0.539 . . . . 17.66 110.309 179.32 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 86.2 mt -75.69 -38.63 38.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.697 -0.683 . . . . 18.149999999999999 111.314 -179.782 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.4 ' O ' ' NE ' ' A' ' 94' ' ' ARG . 0.2 OUTLIER -66.14 -56.85 9.37 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.494 -0.321 . . . . 18.34 111.108 -179.621 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . 0.571 ' HA ' HH21 ' A' ' 94' ' ' ARG . 44.1 t0 -49.11 123.44 7.25 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-O 120.789 0.328 . . . . 19.289999999999999 110.253 -179.884 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.687 ' HE ' ' N ' ' A' ' 94' ' ' ARG . 0.0 OUTLIER -91.84 -7.44 49.41 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.209 -0.45 . . . . 22.25 111.848 -178.513 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -126.55 -176.68 3.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.921 0.391 . . . . 23.34 110.904 179.788 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.45 0.7 55.71 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.916 -0.659 . . . . 22.0 112.229 179.643 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.93 -37.98 89.44 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.758 0.313 . . . . 22.280000000000001 111.239 -179.86 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 95.55 20.53 26.71 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.853 -0.689 . . . . 19.93 112.6 179.899 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . 0.42 ' HA ' ' O ' ' A' ' 136' ' ' ILE . 95.7 m-85 -136.32 151.77 49.96 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.702 0.286 . . . . 20.300000000000001 110.803 179.855 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.497 ' HB ' ' HB ' ' A' ' 136' ' ' ILE . 45.7 mt -114.96 133.04 62.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-O 121.096 0.474 . . . . 19.370000000000001 111.66 -179.606 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 75.7 m -114.57 156.06 45.19 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 115.576 -0.738 . . . . 22.489999999999998 110.119 179.2 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_exo -42.45 -47.53 7.38 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.529 2.153 . . . . 23.0 112.699 -179.454 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -59.61 -42.89 93.66 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.199 0.523 . . . . 24.559999999999999 111.045 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -65.51 -55.13 19.49 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.655 -0.702 . . . . 22.23 109.796 -179.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.449 ' CD2' ' HB ' ' A' ' 121' ' ' ILE . 40.6 tp -49.26 -34.63 15.6 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.002 -0.999 . . . . 20.359999999999999 110.325 179.443 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.405 ' HD3' HH11 ' A' ' 106' ' ' ARG . 2.4 tmm_? -69.86 -35.99 75.15 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.591 -0.732 . . . . 27.190000000000001 110.873 -179.781 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 68.0 t80 -67.0 -48.53 68.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.064 -0.516 . . . . 25.359999999999999 112.213 -179.389 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.446 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 99.3 t -67.92 -48.79 73.65 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 N-CA-C 112.103 0.408 . . . . 21.059999999999999 112.103 -179.045 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 2.2 mmt -45.23 -33.92 2.57 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 120.839 0.352 . . . . 20.93 110.833 179.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 67.2 mt -74.05 -44.38 50.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.105 -0.498 . . . . 25.129999999999999 110.766 179.501 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 81.2 m-20 -59.56 -24.97 64.16 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.947 -0.57 . . . . 23.32 110.699 179.641 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 64.0 mt -75.67 -32.52 60.19 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.94 -0.573 . . . . 21.07 110.626 179.997 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 121.71 -2.77 11.03 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.821 -0.704 . . . . 23.050000000000001 112.847 179.596 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -109.87 122.5 47.67 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.896 0.379 . . . . 22.59 111.379 -179.76 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 63.8 tttm -80.24 142.71 34.37 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.073 -0.512 . . . . 27.960000000000001 110.601 179.65 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . 0.468 ' HB ' HG23 ' A' ' 121' ' ' ILE . 1.9 m -150.09 155.51 7.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 121.074 0.464 . . . . 24.75 111.791 -179.697 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . 0.432 ' O ' HG12 ' A' ' 121' ' ' ILE . 61.5 p -100.03 144.13 29.43 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.706 -0.679 . . . . 27.239999999999998 110.153 179.169 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -51.38 -18.98 1.16 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.265 -0.425 . . . . 26.629999999999999 111.698 -179.449 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -78.23 -54.08 6.63 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.575 -0.284 . . . . 29.140000000000001 111.647 -179.579 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -63.86 -40.34 96.35 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 111.808 0.299 . . . . 24.190000000000001 111.808 -179.146 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.532 HG13 ' N ' ' A' ' 122' ' ' ASP . 11.4 pt -70.64 -41.65 77.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 C-N-CA 121.025 -0.27 . . . . 22.329999999999998 111.588 -179.524 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . 0.532 ' N ' HG13 ' A' ' 121' ' ' ILE . 21.4 t70 -58.7 -37.36 75.92 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.975 0.417 . . . . 24.289999999999999 110.161 179.568 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -65.82 -41.87 91.32 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.973 -0.558 . . . . 24.739999999999998 110.067 179.285 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 67.7 ttp -57.97 -36.56 72.76 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.069 -0.514 . . . . 19.710000000000001 110.057 178.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.457 HG23 HD11 ' A' ' 136' ' ' ILE . 84.1 mt -63.21 -42.64 97.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.799 -0.637 . . . . 19.949999999999999 109.822 179.203 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 1.8 tmm_? -58.06 -52.0 67.35 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.512 -0.767 . . . . 24.949999999999999 110.335 179.406 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -54.59 -23.57 17.5 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.124 -0.944 . . . . 18.690000000000001 111.78 -179.894 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.644 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -107.53 -10.58 15.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.839 0.352 . . . . 16.469999999999999 111.497 -179.776 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 27.6 t0 -98.36 106.14 18.38 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.218 -0.446 . . . . 20.399999999999999 110.932 -179.529 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 34.5 m-85 -85.41 -48.47 8.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.845 -0.616 . . . . 21.43 111.287 -179.59 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -60.14 -21.9 62.17 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.174 -0.466 . . . . 23.370000000000001 111.38 -179.656 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 60.75 77.01 0.2 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.654 -0.784 . . . . 24.32 112.614 179.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 13.1 p-10 -133.82 -15.83 2.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.848 0.356 . . . . 23.879999999999999 110.786 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 93.14 10.43 59.67 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.854 -0.688 . . . . 22.670000000000002 112.391 -179.887 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 38.1 mtp -131.31 154.52 48.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.606 0.241 . . . . 22.91 110.551 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.715 HG23 ' HB2' ' A' ' 140' ' ' GLU . 36.9 mm -114.86 144.23 22.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 121.331 0.586 . . . . 18.41 111.992 -179.256 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . 0.425 ' O ' ' N ' ' A' ' 139' ' ' GLU . 48.9 t30 -114.8 157.06 23.77 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.069 -0.969 . . . . 16.82 108.94 178.364 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 7.9 t80 -41.71 -23.14 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 120.663 0.268 . . . . 14.65 111.524 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . 0.425 ' N ' ' O ' ' A' ' 137' ' ' ASN . 44.5 mt-10 -80.22 -56.01 4.52 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.684 0.278 . . . . 14.82 110.946 -179.806 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.715 ' HB2' HG23 ' A' ' 136' ' ' ILE . 34.1 mt-10 -59.23 -31.39 69.01 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.155 0.502 . . . . 17.460000000000001 110.23 179.629 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.646 ' HA ' ' HE2' ' A' ' 144' ' ' MET . 89.0 t80 -69.34 -55.48 10.29 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.503 -0.771 . . . . 12.93 110.271 179.568 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.657 HG13 ' SD ' ' A' ' 85' ' ' MET . 2.4 t -44.43 -42.38 2.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.569 -0.741 . . . . 10.699999999999999 112.036 179.075 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 143' ' ' TRP . . . . . 0.511 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 92.6 t90 -69.94 -56.09 7.94 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.329 0.492 . . . . 13.66 112.329 -178.849 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . 0.646 ' HE2' ' HA ' ' A' ' 141' ' ' PHE . 20.3 ptt? -61.72 -21.17 64.26 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 113.27 0.841 . . . . 14.5 113.27 -177.723 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 145' ' ' ILE . . . . . 0.629 ' HA ' ' HB2' ' A' ' 148' ' ' LYS . 38.0 pt -80.79 -43.9 21.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 C-N-CA 120.619 -0.432 . . . . 11.25 111.813 -179.939 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 146' ' ' SER . . . . . 0.486 ' N ' HG13 ' A' ' 145' ' ' ILE . 31.2 t -63.07 -14.69 51.33 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.297 0.57 . . . . 8.5399999999999991 109.933 179.602 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 147' ' ' GLN . . . . . 0.511 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 2.4 mm-40 -119.52 2.8 11.25 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.171 -0.922 . . . . 11.869999999999999 110.488 -179.232 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . 0.629 ' HB2' ' HA ' ' A' ' 145' ' ' ILE . 26.3 ttpp . . . . . 0 C--O 1.25 1.084 0 CA-C-O 118.249 -0.882 . . . . 13.68 110.987 -179.793 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.411 ' HG ' ' HE2' ' A' ' 12' ' ' PHE . 7.9 mp . . . . . 0 CA--C 1.528 0.134 0 CA-C-O 120.764 0.316 . . . . 1.27 110.896 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 36.9 p -78.63 -173.39 3.38 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.208 -0.451 . . . . 1.1200000000000001 111.538 -179.77 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -63.68 -42.91 97.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.272 -0.422 . . . . 2.2000000000000002 111.515 -179.664 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.408 ' HG3' ' N ' ' A' ' 8' ' ' GLN . 11.1 pt-20 -69.83 -42.44 73.6 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.082 0.467 . . . . 1.3500000000000001 110.51 -179.615 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . 0.408 ' N ' ' HG3' ' A' ' 7' ' ' GLU . 28.0 mt-30 -63.84 -41.39 97.83 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.564 -0.744 . . . . 2.2200000000000002 110.671 179.825 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.494 ' HA ' ' CZ ' ' A' ' 12' ' ' PHE . 45.8 mt -60.71 -51.95 67.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.034 -0.53 . . . . 0.54000000000000004 110.57 179.592 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.94 -23.19 66.2 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.022 -0.535 . . . . 0.5 111.376 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -69.8 -56.64 6.6 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 111.903 0.334 . . . . 2.27 111.903 -179.224 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.494 ' CZ ' ' HA ' ' A' ' 9' ' ' ILE . 11.0 p90 -78.83 -26.92 44.2 Favored 'General case' 0 C--N 1.332 -0.187 0 C-N-CA 120.491 -0.484 . . . . 0.37 110.879 -179.78 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 19.4 tptm -63.67 -34.68 78.4 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.208 -0.664 . . . . 1.23 109.208 178.701 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.43 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 18.2 t70 -70.23 -53.34 17.4 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.644 -0.707 . . . . 0.44 109.206 178.384 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.0 -14.29 22.03 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.535 -0.757 . . . . 0.28999999999999998 110.749 179.165 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 41.8 t80 -80.34 -52.84 7.21 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.957 -0.565 . . . . 0.47999999999999998 110.961 -179.746 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 23.3 m -66.97 -17.92 23.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.076 -0.511 . . . . 1.1100000000000001 110.787 -179.595 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.43 ' HG2' ' O ' ' A' ' 14' ' ' ASP . 74.0 mm-40 -65.95 -29.52 69.93 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.81 -0.632 . . . . 1.6000000000000001 111.636 179.857 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 36.4 m-85 -101.24 18.34 20.19 Favored 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 111.818 0.303 . . . . 0.64000000000000001 111.818 -179.665 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -115.23 80.37 1.42 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.966 0.413 . . . . 0.44 110.798 179.424 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 14.1 tppt? -87.82 -29.39 20.99 Favored 'General case' 0 N--CA 1.441 -0.918 0 CA-C-N 115.878 -0.601 . . . . 2.1000000000000001 110.66 -179.872 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -68.07 -16.72 64.14 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.116 -0.493 . . . . 1.8 111.404 -179.473 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.39 9.67 86.82 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.731 -0.747 . . . . 0.46000000000000002 112.937 179.703 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 34.6 p -79.65 8.18 7.04 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.619 0.247 . . . . 0.40000000000000002 111.012 179.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 55.43 21.43 27.12 Favored Glycine 0 C--N 1.333 0.379 0 C-N-CA 120.733 -0.746 . . . . 0.33000000000000002 111.707 -179.58 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.688 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 53.9 mtpt -134.88 155.13 51.22 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.577 -0.311 . . . . 1.1000000000000001 110.775 -179.091 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.651 HG13 ' HB2' ' A' ' 63' ' ' LEU . 20.5 pt -115.52 127.7 73.01 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.317 0 CA-C-O 120.921 0.391 . . . . 0.5 111.964 -178.963 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -53.09 139.84 27.32 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.1 -0.5 . . . . 0.29999999999999999 111.427 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.531 ' HA ' HD11 ' A' ' 63' ' ' LEU . 7.3 t -65.72 -20.9 66.45 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.992 -0.549 . . . . 1.03 111.454 -179.749 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.496 ' HD3' ' H ' ' A' ' 30' ' ' ARG . 0.0 OUTLIER -83.6 5.08 25.59 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.881 0.372 . . . . 3.0800000000000001 110.48 179.64 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -120.29 -6.65 9.85 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.845 -0.616 . . . . 2.2599999999999998 111.006 -179.845 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.594 HD13 HD13 ' A' ' 51' ' ' LEU . 10.3 tt -58.46 -51.5 69.57 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 116.482 -0.326 . . . . 1.3700000000000001 110.791 179.751 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.413 ' HA2' HD21 ' A' ' 48' ' ' LEU . . . -52.7 -48.07 57.07 Favored Glycine 0 C--N 1.332 0.331 0 C-N-CA 120.33 -0.938 . . . . 0.32000000000000001 111.335 179.405 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.492 ' HA ' ' HG2' ' A' ' 37' ' ' ARG . 88.6 m -57.94 -36.65 72.81 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.394 0.616 . . . . 0.31 109.54 178.493 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.5 -32.1 73.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.087 -0.961 . . . . 1.24 110.297 179.532 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 23.7 mmt -73.83 -26.72 60.74 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.891 -0.595 . . . . 1.1000000000000001 110.316 179.388 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.492 ' HG2' ' HA ' ' A' ' 34' ' ' THR . 17.9 mmt180 -66.78 -50.86 61.33 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.818 -0.628 . . . . 2.6899999999999999 110.271 179.566 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.437 HG23 ' HG ' ' A' ' 39' ' ' LEU . 7.9 t -65.05 -12.62 52.55 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.772 -0.649 . . . . 1.0600000000000001 111.313 179.833 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.437 ' HG ' HG23 ' A' ' 38' ' ' THR . 64.8 mt -112.77 156.32 23.05 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.205 -0.452 . . . . 1.26 110.614 -179.825 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -67.45 10.68 0.94 Allowed Glycine 0 CA--C 1.521 0.441 0 C-N-CA 121.022 -0.608 . . . . 0.68999999999999995 113.141 -179.74 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.418 ' H ' ' C ' ' A' ' 39' ' ' LEU . 15.8 mm-40 -67.4 -79.03 0.05 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.92 0.39 . . . . 1.97 111.122 179.798 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 56.44 68.7 2.09 Favored Pre-proline 0 C--N 1.331 -0.217 0 CA-C-N 115.923 -0.581 . . . . 2.6600000000000001 111.065 -179.628 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.606 ' HG2' HD23 ' A' ' 48' ' ' LEU . 61.5 Cg_endo -71.9 -171.53 0.69 Allowed 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.687 2.258 . . . . 0.51000000000000001 112.346 179.86 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 38.1 m -94.87 152.42 18.39 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.161 -0.472 . . . . 0.72999999999999998 110.639 179.716 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.415 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 37.4 tt0 -48.85 -53.07 20.91 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.574 -0.285 . . . . 2.7000000000000002 111.28 -179.651 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -46.92 -54.69 9.49 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.298 -0.41 . . . . 0.46000000000000002 111.424 -179.752 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -54.91 -50.29 69.17 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.358 -0.383 . . . . 2.23 110.82 179.876 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.606 HD23 ' HG2' ' A' ' 43' ' ' PRO . 0.1 OUTLIER -55.82 -36.09 67.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.115 -0.493 . . . . 1.3600000000000001 111.032 -179.879 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.415 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 28.5 mm-40 -75.88 -32.16 59.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.256 -0.429 . . . . 1.22 111.247 -179.707 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 64.7 m-20 -70.1 -55.42 9.5 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.464 -0.334 . . . . 0.62 111.09 -179.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.594 HD13 HD13 ' A' ' 32' ' ' LEU . 1.9 pp -59.19 -39.44 82.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.314 -0.403 . . . . 0.39000000000000001 111.116 -179.923 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 35.8 mt -64.52 -40.8 90.31 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-O 120.636 0.255 . . . . 0.5 110.594 179.429 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.89 -30.92 71.2 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.383 -0.371 . . . . 0.58999999999999997 111.003 179.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -80.46 -47.33 14.49 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.105 -0.498 . . . . 2.54 111.394 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -75.49 -14.86 60.45 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.351 0.5 . . . . 0.53000000000000003 112.351 -179.16 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -69.31 -38.71 78.37 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.705 0.288 . . . . 1.95 111.065 -179.486 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 30.6 m-80 -95.25 28.79 2.71 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.346 -0.388 . . . . 2.48 110.563 179.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.622 HD22 ' N ' ' A' ' 59' ' ' ASN . 0.2 OUTLIER -148.92 138.43 21.8 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.109 -0.496 . . . . 2.48 110.542 -179.679 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . 0.622 ' N ' HD22 ' A' ' 58' ' ' ASN . 77.4 m-20 62.68 14.58 7.33 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.181 -0.463 . . . . 2.0499999999999998 111.118 179.909 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 22.3 m-80 58.47 13.62 2.58 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.034 -0.53 . . . . 1.47 111.711 179.469 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 113.78 48.22 0.59 Allowed Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.564 -0.827 . . . . 0.42999999999999999 113.045 179.483 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.688 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -146.22 153.8 41.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.109 0.48 . . . . 0.38 111.198 179.513 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.651 ' HB2' HG13 ' A' ' 27' ' ' ILE . 16.3 mt -126.6 156.71 40.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.631 -0.713 . . . . 1.4299999999999999 110.549 -179.623 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . 0.442 ' OD1' ' HE3' ' A' ' 26' ' ' LYS . 0.1 OUTLIER -112.68 156.6 22.48 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 121.023 -0.271 . . . . 1.1899999999999999 110.447 179.674 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.438 ' O ' ' HB2' ' A' ' 69' ' ' CYS . 83.9 t80 -45.59 -32.51 2.35 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.751 0.31 . . . . 0.40000000000000002 110.998 179.639 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -80.39 -36.86 33.28 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 112.16 0.43 . . . . 0.81000000000000005 112.16 -179.555 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -62.71 -51.54 66.79 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.473 0.654 . . . . 1.3600000000000001 109.802 179.478 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.436 ' O ' ' HG3' ' A' ' 72' ' ' MET . 35.3 t80 -61.66 -48.13 82.23 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.999 -1.0 . . . . 0.51000000000000001 110.578 179.378 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.438 ' HB2' ' O ' ' A' ' 65' ' ' PHE . 7.8 t -57.96 -48.36 80.18 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.156 -0.475 . . . . 0.75 110.528 179.86 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -48.47 -48.6 27.81 Favored Glycine 0 N--CA 1.45 -0.415 0 CA-C-N 115.72 -0.673 . . . . 0.40999999999999998 112.03 179.863 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.573 HG23 ' HE2' ' A' ' 74' ' ' LYS . 15.3 mt -63.49 -43.65 98.46 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.362 0 CA-C-O 121.153 0.502 . . . . 0.51000000000000001 110.504 179.41 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . 0.436 ' HG3' ' O ' ' A' ' 68' ' ' PHE . 49.6 mtp -58.34 -26.67 63.38 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.637 -0.71 . . . . 1.01 110.076 179.535 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -72.55 -43.66 63.18 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.003 -0.544 . . . . 0.69999999999999996 110.704 179.557 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.573 ' HE2' HG23 ' A' ' 71' ' ' ILE . 48.7 pttt -73.9 -30.29 62.52 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.234 -0.439 . . . . 1.3799999999999999 111.125 -179.877 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -80.45 -47.19 14.7 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.112 0.412 . . . . 1.98 112.112 -179.694 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 48.2 mtp . . . . . 0 N--CA 1.453 -0.279 0 N-CA-C 112.065 0.395 . . . . 1.2 112.065 -179.0 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.406 ' O ' ' HG3' ' A' ' 85' ' ' MET . 5.7 t . . . . . 0 CA--C 1.528 0.099 0 CA-C-O 121.073 0.463 . . . . 7.29 111.042 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.407 ' HB2' ' OH ' ' A' ' 138' ' ' TYR . 10.5 pt-20 -55.87 -17.65 6.91 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.917 -0.583 . . . . 9.7400000000000002 112.232 -179.034 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -68.43 -56.37 8.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.917 0.389 . . . . 12.109999999999999 111.264 -179.583 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -72.99 -15.29 61.54 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.114 0.483 . . . . 10.869999999999999 110.379 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' MET . . . . . 0.701 ' HB3' HG22 ' A' ' 142' ' ' VAL . 15.0 mtt -76.37 -48.4 20.04 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.83 -0.623 . . . . 11.09 110.393 -179.779 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.428 ' O ' ' HG3' ' A' ' 90' ' ' LYS . 19.9 ttt180 -62.82 -41.95 99.52 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.546 -0.539 . . . . 15.52 109.546 179.354 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -55.16 -43.47 74.29 Favored 'General case' 0 C--O 1.233 0.214 0 N-CA-C 109.402 -0.592 . . . . 14.85 109.402 178.525 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.54 -28.37 67.74 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.541 -0.754 . . . . 14.109999999999999 110.667 179.132 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 82.4 t80 -66.84 -39.12 87.53 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 116.231 -0.44 . . . . 15.73 110.472 179.638 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . 0.428 ' HG3' ' O ' ' A' ' 86' ' ' ARG . 2.7 mtpm? -64.48 -49.14 72.57 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.27 0.557 . . . . 17.66 110.269 179.327 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 60.6 mt -62.96 -45.13 99.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.255 -0.884 . . . . 18.149999999999999 111.479 -179.228 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . 0.514 ' CG ' HG11 ' A' ' 108' ' ' VAL . 0.6 OUTLIER -68.28 -18.65 64.59 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.252 -0.431 . . . . 18.34 111.59 -179.378 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 48.2 t0 -99.01 103.9 15.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.049 0.452 . . . . 19.289999999999999 110.702 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.56 ' NE ' HG22 ' A' ' 108' ' ' VAL . 0.0 OUTLIER -67.68 -11.63 58.72 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.773 -0.649 . . . . 22.25 111.681 -179.461 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.47 ' HB2' ' OD1' ' A' ' 97' ' ' ASP . 28.2 m-20 -116.65 166.98 11.49 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.986 0.422 . . . . 23.34 111.193 -179.789 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.61 5.15 56.81 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.973 -0.632 . . . . 22.0 112.375 179.498 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . 0.47 ' OD1' ' HB2' ' A' ' 95' ' ' ASP . 7.6 p-10 -61.68 -38.13 86.67 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.665 0.269 . . . . 22.280000000000001 111.13 -179.691 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 111.34 18.73 7.93 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.738 -0.744 . . . . 19.93 112.749 179.843 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . 0.441 ' HA ' ' O ' ' A' ' 136' ' ' ILE . 92.3 m-85 -145.35 153.48 41.28 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 120.622 0.249 . . . . 20.300000000000001 110.854 179.803 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.402 HD13 ' HB3' ' A' ' 92' ' ' PHE . 63.9 mt -114.01 139.76 38.09 Favored 'Isoleucine or valine' 0 C--O 1.231 0.107 0 CA-C-O 121.014 0.435 . . . . 19.370000000000001 111.312 -179.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 16.5 m -121.77 156.22 59.25 Favored Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 115.747 -0.66 . . . . 22.489999999999998 110.434 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_exo -43.56 -32.95 4.11 Favored 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.498 2.132 . . . . 23.0 112.508 -179.753 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -62.55 -48.75 78.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.095 0.474 . . . . 24.559999999999999 111.248 179.91 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . 0.661 ' O ' HG23 ' A' ' 108' ' ' VAL . 33.5 mt-10 -73.08 -42.15 63.33 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.652 -0.704 . . . . 22.23 110.193 -179.662 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.466 HD12 ' HB ' ' A' ' 121' ' ' ILE . 1.6 tm? -48.89 -54.33 15.82 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.425 -0.807 . . . . 20.359999999999999 109.624 179.794 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.545 ' HB2' HD13 ' A' ' 121' ' ' ILE . 17.1 ttp180 -58.29 -51.11 71.15 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.19 -0.914 . . . . 27.190000000000001 110.844 179.851 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 50.3 t80 -56.23 -26.35 50.91 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.029 -0.532 . . . . 25.359999999999999 112.012 -179.147 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.661 HG23 ' O ' ' A' ' 104' ' ' GLU . 58.8 t -80.55 -55.38 8.67 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.16 0 N-CA-C 112.549 0.574 . . . . 21.059999999999999 112.549 -179.063 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . 0.591 ' SD ' HG21 ' A' ' 116' ' ' VAL . 0.1 OUTLIER -48.58 -47.42 39.68 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.277 0.561 . . . . 20.93 110.48 -179.347 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.468 HD11 ' HG3' ' A' ' 106' ' ' ARG . 27.7 mt -60.27 -30.79 46.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.257 -0.883 . . . . 25.129999999999999 111.187 -179.806 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . 0.474 HD22 HH21 ' A' ' 94' ' ' ARG . 92.6 m-20 -72.9 -28.99 62.81 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.22 -0.445 . . . . 23.32 110.846 179.29 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.454 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 6.5 mt -76.06 -27.64 57.33 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.159 -0.473 . . . . 21.07 110.695 -179.889 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 121.77 12.1 5.64 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.865 -0.683 . . . . 23.050000000000001 112.441 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -117.51 135.21 54.09 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.86 0.362 . . . . 22.59 111.133 -179.843 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -93.54 134.99 35.25 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.114 -0.494 . . . . 27.960000000000001 110.6 179.783 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . 0.591 HG21 ' SD ' ' A' ' 109' ' ' MET . 8.6 m -144.58 155.44 14.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 121.116 0.484 . . . . 24.75 111.986 -179.562 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 45.1 p -100.9 150.38 22.91 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.486 -0.779 . . . . 27.239999999999998 109.939 178.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -54.65 -19.74 6.72 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.736 0.303 . . . . 26.629999999999999 111.361 -179.66 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -78.73 -54.19 6.35 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.28 -0.418 . . . . 29.140000000000001 111.824 -179.364 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . 0.471 ' OE1' HG12 ' A' ' 116' ' ' VAL . 13.5 pt-20 -61.34 -36.52 80.39 Favored 'General case' 0 C--O 1.233 0.237 0 N-CA-C 111.612 0.227 . . . . 24.190000000000001 111.612 -179.171 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.545 HD13 ' HB2' ' A' ' 106' ' ' ARG . 22.0 pt -73.47 -37.61 51.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 C-N-CA 121.041 -0.264 . . . . 22.329999999999998 111.017 179.86 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . 0.519 ' N ' HG13 ' A' ' 121' ' ' ILE . 17.4 t70 -59.36 -38.36 80.23 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.991 0.425 . . . . 24.289999999999999 110.179 179.27 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -65.35 -49.97 67.36 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.863 -0.608 . . . . 24.739999999999998 110.474 179.542 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.435 ' SD ' ' HE2' ' A' ' 148' ' ' LYS . 56.3 ttp -52.44 -46.01 66.23 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.375 -0.375 . . . . 19.710000000000001 110.717 179.641 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.547 HG23 HD11 ' A' ' 136' ' ' ILE . 79.2 mt -61.6 -33.48 57.43 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 CA-C-N 116.072 -0.513 . . . . 19.949999999999999 110.742 179.476 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 16.7 tpt85 -65.74 -36.14 82.73 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.261 -0.427 . . . . 24.949999999999999 110.994 -179.613 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -62.48 -43.5 98.67 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.939 -0.573 . . . . 18.690000000000001 111.663 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.657 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -87.75 -18.64 28.97 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.303 -0.408 . . . . 16.469999999999999 111.756 -179.301 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . 0.461 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 22.3 t70 -93.75 106.65 18.61 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.027 0.441 . . . . 20.399999999999999 111.124 -179.627 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 79.1 m-85 -91.6 -33.0 15.29 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.824 -0.626 . . . . 21.43 110.669 179.839 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -64.12 -18.74 64.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.12 -0.491 . . . . 23.370000000000001 110.555 179.74 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 64.98 19.1 65.36 Favored Glycine 0 N--CA 1.45 -0.388 0 CA-C-N 115.632 -0.713 . . . . 24.32 112.467 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 7.8 p30 -86.29 3.89 41.35 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.608 0.242 . . . . 23.879999999999999 111.458 -179.749 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 62.09 23.28 63.74 Favored Glycine 0 N--CA 1.453 -0.221 0 C-N-CA 120.653 -0.785 . . . . 22.670000000000002 112.369 -179.854 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 92.8 mmm -130.73 145.54 51.97 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 110.36 -0.237 . . . . 22.91 110.36 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.607 HG23 ' HB2' ' A' ' 140' ' ' GLU . 50.4 mm -115.44 145.36 21.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.325 0.583 . . . . 18.41 112.104 -179.555 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . 0.471 ' O ' ' N ' ' A' ' 139' ' ' GLU . 29.1 p-10 -122.99 158.43 30.51 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.157 -0.929 . . . . 16.82 108.753 178.239 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.419 ' O ' HG23 ' A' ' 142' ' ' VAL . 18.0 t80 -38.5 -23.72 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 112.193 0.442 . . . . 14.65 112.193 -179.746 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . 0.471 ' N ' ' O ' ' A' ' 137' ' ' ASN . 45.0 mt-10 -80.46 -56.14 4.39 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.678 0.275 . . . . 14.82 111.517 -179.454 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.607 ' HB2' HG23 ' A' ' 136' ' ' ILE . 34.3 mt-10 -63.13 -34.94 78.69 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.077 0.465 . . . . 17.460000000000001 110.506 179.944 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.474 ' CZ ' HG21 ' A' ' 145' ' ' ILE . 88.0 t80 -63.74 -55.51 22.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.746 -0.661 . . . . 12.93 110.51 179.725 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.701 HG22 ' HB3' ' A' ' 85' ' ' MET . 4.6 t -48.28 -42.54 11.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.79 -0.641 . . . . 10.699999999999999 111.732 179.353 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 143' ' ' TRP . . . . . 0.474 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 83.4 t90 -61.76 -55.32 31.36 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.53 0.567 . . . . 13.66 112.53 -178.704 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . 0.657 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 11.9 ptt? -64.02 -40.04 95.45 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 112.797 0.666 . . . . 14.5 112.797 -177.653 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 145' ' ' ILE . . . . . 0.474 HG21 ' CZ ' ' A' ' 141' ' ' PHE . 37.2 pt -65.42 -29.09 46.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 N-CA-C 111.931 0.345 . . . . 11.25 111.931 -179.268 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 146' ' ' SER . . . . . 0.457 ' HB3' ' NE2' ' A' ' 147' ' ' GLN . 41.7 t -69.09 -32.98 72.8 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.901 0.381 . . . . 8.5399999999999991 110.459 -179.751 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 147' ' ' GLN . . . . . 0.474 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 8.6 mm-40 -95.98 -16.04 21.94 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.912 -0.585 . . . . 11.869999999999999 111.478 -179.895 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . 0.451 ' HG3' ' O ' ' A' ' 144' ' ' MET . 68.9 mttt . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.293 -0.861 . . . . 13.68 111.183 179.661 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.439 HD13 ' CZ ' ' A' ' 12' ' ' PHE . 39.3 mt . . . . . 0 CA--C 1.528 0.117 0 CA-C-O 120.918 0.39 . . . . 1.27 110.602 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 66.4 p -66.49 -159.94 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.81 -0.632 . . . . 1.1200000000000001 111.651 -179.635 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -76.78 -45.22 29.77 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.345 -0.389 . . . . 2.2000000000000002 110.948 -179.508 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.79 -39.26 70.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.99 -0.55 . . . . 1.3500000000000001 110.687 -179.782 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . 0.434 ' NE2' ' HA ' ' A' ' 4' ' ' LEU . 29.1 mt-30 -60.94 -47.33 86.93 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.961 -0.563 . . . . 2.2200000000000002 110.659 179.696 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.448 ' HA ' ' CZ ' ' A' ' 12' ' ' PHE . 66.8 mt -59.7 -54.3 36.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.087 -0.506 . . . . 0.54000000000000004 110.897 179.712 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.31 -18.7 51.43 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.253 -0.43 . . . . 0.5 111.682 -179.707 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -74.21 -56.87 4.4 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.617 0.246 . . . . 2.27 111.65 -179.491 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.448 ' CZ ' ' HA ' ' A' ' 9' ' ' ILE . 9.5 p90 -79.4 -20.85 46.6 Favored 'General case' 0 C--N 1.332 -0.158 0 C-N-CA 120.598 -0.441 . . . . 0.37 110.747 -179.9 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.424 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 19.7 tptm -70.28 -39.32 74.98 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.204 -0.665 . . . . 1.23 109.204 178.644 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -64.93 -47.53 77.4 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 108.735 -0.839 . . . . 0.44 108.735 177.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.45 -28.88 70.12 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.429 -0.805 . . . . 0.28999999999999998 110.02 178.581 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.424 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 30.1 t80 -67.33 -40.98 85.97 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.546 -0.752 . . . . 0.47999999999999998 110.238 179.364 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -68.83 -28.27 39.11 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.784 0 CA-C-N 115.73 -0.668 . . . . 1.1100000000000001 110.972 -179.82 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 83.7 mm-40 -61.5 -33.11 73.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.597 -0.729 . . . . 1.6000000000000001 111.332 -179.96 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -93.74 -5.83 47.48 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.497 -0.319 . . . . 0.64000000000000001 111.45 -179.617 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -95.14 78.39 3.51 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.901 0.382 . . . . 0.44 110.467 179.301 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 29.7 mmmt -90.94 -33.24 15.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.945 -0.57 . . . . 2.1000000000000001 111.19 -179.636 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -62.43 -23.98 67.16 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.226 -0.443 . . . . 1.8 111.177 -179.782 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 87.09 11.41 69.88 Favored Glycine 0 N--CA 1.453 -0.213 0 C-N-CA 120.758 -0.734 . . . . 0.46000000000000002 112.627 179.774 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 30.3 p -86.1 11.26 12.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.778 0.323 . . . . 0.40000000000000002 111.139 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 55.26 25.11 39.14 Favored Glycine 0 C--N 1.332 0.327 0 C-N-CA 120.813 -0.708 . . . . 0.33000000000000002 112.227 -179.824 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.651 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 42.5 mtpt -134.09 155.8 49.4 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.788 0.327 . . . . 1.1000000000000001 111.032 -179.58 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.52 HG13 ' HB2' ' A' ' 63' ' ' LEU . 30.8 pt -114.96 136.18 52.47 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.325 0 N-CA-C 112.27 0.47 . . . . 0.5 112.27 -178.825 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.92 135.35 57.55 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.262 -0.426 . . . . 0.29999999999999999 111.343 179.734 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.575 ' HA ' HD11 ' A' ' 63' ' ' LEU . 9.9 t -65.75 -23.35 66.72 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.996 -0.547 . . . . 1.03 111.179 -179.894 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 29.9 mtp180 -77.79 -2.57 37.02 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.069 -0.514 . . . . 3.0800000000000001 110.372 179.556 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -111.79 -6.18 14.33 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.759 -0.655 . . . . 2.2599999999999998 110.872 179.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -51.78 -50.94 59.73 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.944 -0.571 . . . . 1.3700000000000001 110.46 179.675 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -58.78 -43.02 96.73 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.63 -0.795 . . . . 0.32000000000000001 111.828 179.515 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 31.1 m -59.15 -32.24 69.7 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.989 0.424 . . . . 0.31 110.516 179.428 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.3 mt -67.51 -41.23 84.76 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 115.851 -0.613 . . . . 1.24 110.643 179.771 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' MET . . . . . 0.569 ' HG3' ' HG3' ' A' ' 43' ' ' PRO . 14.6 mmt -66.91 -25.66 66.48 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.013 -0.539 . . . . 1.1000000000000001 110.741 179.894 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -74.85 -47.82 28.27 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.855 -0.611 . . . . 2.6899999999999999 110.954 179.453 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.519 HG23 ' HG ' ' A' ' 39' ' ' LEU . 9.9 t -70.52 -13.69 62.21 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.98 0.419 . . . . 1.0600000000000001 111.033 179.758 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.519 ' HG ' HG23 ' A' ' 38' ' ' THR . 57.4 mt -113.85 156.65 23.53 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.92 -0.582 . . . . 1.26 110.626 -179.798 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -52.92 -11.44 1.36 Allowed Glycine 0 CA--C 1.521 0.45 0 C-N-CA 121.178 -0.534 . . . . 0.68999999999999995 113.269 -179.764 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -58.63 166.03 1.99 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.931 0.396 . . . . 1.97 111.181 179.673 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 46.3 t30 -172.55 73.72 0.44 Allowed Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 115.884 -0.598 . . . . 2.6600000000000001 110.513 179.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.569 ' HG3' ' HG3' ' A' ' 36' ' ' MET . 83.1 Cg_endo -80.18 158.34 23.33 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.741 2.294 . . . . 0.51000000000000001 112.712 -179.779 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.0 p -67.83 146.32 53.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.98 -0.555 . . . . 0.72999999999999998 110.932 179.55 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.1 tt0 -48.38 -49.23 35.51 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.86 0.362 . . . . 2.7000000000000002 110.791 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.22 -44.81 88.37 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.998 -0.546 . . . . 0.46000000000000002 111.127 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -54.28 -46.42 72.7 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.248 -0.433 . . . . 2.23 110.935 -179.939 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 37.8 mt -60.84 -45.16 95.59 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.337 -0.392 . . . . 1.3600000000000001 110.826 179.702 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 81.7 mm-40 -64.67 -27.51 68.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.455 -0.339 . . . . 1.22 111.161 -179.674 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 43.5 m-20 -74.8 -55.07 6.21 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.477 -0.328 . . . . 0.62 111.633 -179.652 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 2.4 pp -67.38 -41.12 85.55 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.468 -0.333 . . . . 0.39000000000000001 111.701 -179.316 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 76.9 mt -62.77 -45.88 97.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 120.637 0.256 . . . . 0.5 110.853 -179.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.89 -33.68 75.19 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.886 0.374 . . . . 0.58999999999999997 110.516 179.53 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -63.6 -44.31 94.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.985 -0.552 . . . . 2.54 110.004 179.302 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . 0.416 ' HA ' HD22 ' A' ' 59' ' ' ASN . . . -79.7 -16.89 54.85 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.915 -0.584 . . . . 0.53000000000000003 110.871 179.253 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -73.55 -43.0 60.95 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.122 -0.49 . . . . 1.95 111.035 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -102.87 47.83 0.88 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.143 -0.48 . . . . 2.48 111.118 -179.826 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -167.55 -55.17 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.2 -0.454 . . . . 2.48 110.927 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . 0.416 HD22 ' HA ' ' A' ' 55' ' ' ALA . 38.2 m-80 -97.4 24.85 6.12 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.171 -0.468 . . . . 2.0499999999999998 110.751 179.846 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 8.0 m120 64.81 -80.08 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 115.89 -0.595 . . . . 1.47 111.239 179.904 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -165.88 18.97 0.1 OUTLIER Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.804 -0.712 . . . . 0.42999999999999999 112.418 179.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.651 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -128.31 155.49 44.55 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.96 0.409 . . . . 0.38 111.373 -179.837 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.575 HD11 ' HA ' ' A' ' 29' ' ' THR . 14.8 mt -126.09 155.46 41.56 Favored 'General case' 0 C--O 1.222 -0.361 0 CA-C-N 115.834 -0.621 . . . . 1.4299999999999999 110.7 -179.631 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . 0.477 ' HB2' ' HG3' ' A' ' 67' ' ' GLU . 1.4 m-20 -111.68 156.51 21.75 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.652 -0.249 . . . . 1.1899999999999999 110.552 -179.607 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 90.0 t80 -43.86 -39.53 3.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.427 -0.351 . . . . 0.40000000000000002 111.399 -179.524 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -70.48 -39.07 74.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.528 -0.306 . . . . 0.81000000000000005 111.67 -179.878 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.477 ' HG3' ' HB2' ' A' ' 64' ' ' ASN . 14.0 mt-10 -62.06 -53.64 52.66 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.426 0.631 . . . . 1.3600000000000001 109.695 179.523 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.444 ' O ' ' HG2' ' A' ' 72' ' ' MET . 31.3 t80 -59.69 -54.98 40.05 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.934 -1.03 . . . . 0.51000000000000001 110.497 179.309 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 36.2 t -51.02 -53.97 28.81 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-N 116.169 -0.469 . . . . 0.75 110.458 179.506 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -41.82 -54.71 4.22 Favored Glycine 0 N--CA 1.451 -0.305 0 CA-C-N 115.281 -0.872 . . . . 0.40999999999999998 112.462 179.702 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.737 HG23 ' HE2' ' A' ' 74' ' ' LYS . 14.0 mt -64.84 -48.91 82.41 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.26 0 CA-C-O 121.037 0.446 . . . . 0.51000000000000001 110.946 179.692 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' MET . . . . . 0.444 ' HG2' ' O ' ' A' ' 68' ' ' PHE . 81.2 mmm -47.79 -36.82 12.32 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.833 -0.622 . . . . 1.01 110.042 179.289 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -63.73 -55.34 23.99 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.415 -0.812 . . . . 0.69999999999999996 110.974 179.407 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.737 ' HE2' HG23 ' A' ' 71' ' ' ILE . 61.1 pttt -60.17 -33.32 72.03 Favored 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 112.017 0.377 . . . . 1.3799999999999999 112.017 -179.199 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 65.1 mt-30 -78.82 -51.96 9.0 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 111.77 0.285 . . . . 1.98 111.77 -179.873 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 2.2 mmm . . . . . 0 N--CA 1.45 -0.467 0 CA-C-N 116.336 -0.393 . . . . 1.2 111.68 -179.431 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.624 ' O ' ' HG3' ' A' ' 85' ' ' MET . 13.5 m . . . . . 0 N--CA 1.455 -0.194 0 CA-C-O 120.799 0.333 . . . . 7.29 110.692 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.447 ' CD ' ' H ' ' A' ' 82' ' ' GLU . 1.9 mp0 -39.54 -49.51 2.14 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 115.381 -0.827 . . . . 9.7400000000000002 112.973 -178.589 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -56.7 -43.62 80.71 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.86 0.362 . . . . 12.109999999999999 111.199 -179.463 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -75.25 -14.53 60.53 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.058 -0.519 . . . . 10.869999999999999 111.248 -179.596 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' MET . . . . . 0.624 ' HG3' ' O ' ' A' ' 81' ' ' THR . 4.5 mtt -80.55 -30.69 37.06 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 121.181 0.515 . . . . 11.09 110.081 -179.889 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 20.9 ttt180 -78.81 -45.44 20.91 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.383 -0.826 . . . . 15.52 110.6 -179.697 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -66.14 -42.58 88.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.125 -0.489 . . . . 14.85 110.872 179.63 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.1 -39.26 86.7 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.24 -0.436 . . . . 14.109999999999999 111.257 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -59.2 -42.24 90.44 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.043 0.449 . . . . 15.73 110.61 179.86 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 5.5 mtpm? -63.32 -43.15 98.62 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.707 -0.679 . . . . 17.66 111.274 179.798 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 83.4 mt -62.67 -50.58 79.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.188 -0.46 . . . . 18.149999999999999 111.624 -179.531 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -64.67 -38.74 92.03 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.559 -0.291 . . . . 18.34 111.332 -179.504 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 29.3 t0 -66.27 91.97 0.18 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.046 0.45 . . . . 19.289999999999999 110.27 179.597 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 2.7 mmp_? -62.05 -2.31 0.89 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.692 -0.686 . . . . 22.25 112.156 -179.316 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 40.8 m-20 -124.78 177.95 5.73 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.942 0.401 . . . . 23.34 110.968 179.66 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.55 -4.41 54.81 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.947 -0.644 . . . . 22.0 111.947 179.29 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.88 -39.25 87.44 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.76 0.314 . . . . 22.280000000000001 111.324 -179.919 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 104.2 40.72 2.21 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.741 -0.742 . . . . 19.93 112.312 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . 0.449 ' HA ' ' O ' ' A' ' 136' ' ' ILE . 95.6 m-85 -143.62 142.04 30.87 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.675 0.274 . . . . 20.300000000000001 110.86 -179.96 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.509 ' HB ' ' HB ' ' A' ' 136' ' ' ILE . 56.6 mt -114.22 120.94 65.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.196 0 CA-C-O 121.069 0.462 . . . . 19.370000000000001 111.1 -179.937 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 31.8 p -114.38 156.18 44.81 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 115.799 -0.637 . . . . 22.489999999999998 110.564 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -40.58 -36.06 1.69 Allowed 'Trans proline' 0 C--N 1.349 0.589 0 C-N-CA 122.592 2.195 . . . . 23.0 112.66 -179.6 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.458 ' O ' ' HG3' ' A' ' 106' ' ' ARG . . . -68.04 -55.41 12.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.078 0.466 . . . . 24.559999999999999 111.172 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -62.49 -31.1 71.79 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.924 -0.58 . . . . 22.23 110.956 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.619 HD23 ' HB ' ' A' ' 121' ' ' ILE . 37.2 tp -68.42 -55.28 12.44 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.715 -0.675 . . . . 20.359999999999999 112.004 -178.45 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.459 ' HB3' HD13 ' A' ' 121' ' ' ILE . 0.3 OUTLIER -57.07 -40.22 76.46 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.758 0.313 . . . . 27.190000000000001 111.485 -179.003 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 21.1 t80 -58.02 -54.17 49.93 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.361 -0.381 . . . . 25.359999999999999 111.255 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.412 ' O ' HD12 ' A' ' 112' ' ' LEU . 48.3 t -67.9 -40.73 83.98 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.197 0 CA-C-N 116.725 -0.216 . . . . 21.059999999999999 111.332 -179.764 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -50.8 -38.6 49.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.846 0.355 . . . . 20.93 110.791 179.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.685 ' HA ' ' HA ' ' A' ' 114' ' ' GLU . 88.0 mt -67.27 -24.12 31.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.044 -0.525 . . . . 25.129999999999999 111.244 179.648 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -72.56 -21.27 61.18 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.069 -0.514 . . . . 23.32 110.354 179.167 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.412 HD12 ' O ' ' A' ' 108' ' ' VAL . 6.2 mp -93.76 -84.8 0.3 Allowed 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.168 -0.469 . . . . 21.07 111.415 -179.966 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . 0.484 ' O ' ' HG2' ' A' ' 114' ' ' GLU . . . -117.49 -1.64 17.88 Favored Glycine 0 C--N 1.334 0.435 0 C-N-CA 120.702 -0.761 . . . . 23.050000000000001 112.696 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . 0.685 ' HA ' ' HA ' ' A' ' 110' ' ' ILE . 9.1 pt-20 42.62 -170.12 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 114.284 1.216 . . . . 22.59 114.284 179.137 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.609 ' HG2' ' HG3' ' A' ' 114' ' ' GLU . 3.4 mmmp? 66.11 54.64 0.96 Allowed 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 114.535 -1.212 . . . . 27.960000000000001 111.548 -179.81 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . 0.543 ' HB ' HG23 ' A' ' 121' ' ' ILE . 1.5 m -130.11 115.38 32.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.998 -0.546 . . . . 24.75 110.991 178.837 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 72.9 p -69.32 146.69 51.99 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.186 -0.461 . . . . 27.239999999999998 110.257 179.713 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . 0.478 ' HA ' HD11 ' A' ' 121' ' ' ILE . 9.2 m-20 -53.63 -17.46 2.19 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.244 -0.434 . . . . 26.629999999999999 111.102 -179.897 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 0.402 ' O ' ' HG2' ' A' ' 123' ' ' GLU . 46.9 mt-10 -79.77 -55.48 4.97 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.299 -0.41 . . . . 29.140000000000001 111.81 -179.559 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . 0.472 ' OE1' HG12 ' A' ' 116' ' ' VAL . 13.5 pt-20 -58.07 -43.69 87.1 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 120.551 0.215 . . . . 24.190000000000001 111.395 -179.311 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.619 ' HB ' HD23 ' A' ' 105' ' ' LEU . 1.8 pt -68.68 -40.17 81.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 C-N-CA 121.037 -0.265 . . . . 22.329999999999998 111.127 179.795 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -61.41 -42.05 98.12 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.753 0.311 . . . . 24.289999999999999 110.5 179.583 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . 0.402 ' HG2' ' O ' ' A' ' 119' ' ' GLU . 20.3 mm-40 -57.71 -45.09 86.19 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.24 -0.436 . . . . 24.739999999999998 110.264 179.419 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 58.6 ttp -57.57 -37.15 72.66 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.068 -0.515 . . . . 19.710000000000001 110.292 179.1 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.544 HG23 HD11 ' A' ' 136' ' ' ILE . 64.4 mt -66.66 -42.3 89.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 115.858 -0.61 . . . . 19.949999999999999 110.414 179.386 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 66.0 ttt180 -59.6 -37.29 78.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.794 -0.639 . . . . 24.949999999999999 110.931 179.739 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -63.99 -33.16 75.11 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.054 -0.521 . . . . 18.690000000000001 111.344 -179.762 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.681 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -95.86 -17.55 21.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.474 -0.33 . . . . 16.469999999999999 111.305 -179.824 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . 0.427 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 14.4 t0 -94.31 100.51 12.54 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.211 -0.449 . . . . 20.399999999999999 110.761 -179.852 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 88.1 m-85 -85.34 -43.07 14.01 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.899 -0.591 . . . . 21.43 111.462 -179.446 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -60.05 -24.19 64.35 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.413 -0.358 . . . . 23.370000000000001 110.798 -179.714 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 66.17 78.02 0.25 Allowed Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.91 -0.662 . . . . 24.32 112.855 179.655 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -135.29 -27.1 1.23 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.769 0.318 . . . . 23.879999999999999 110.935 179.715 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 102.9 13.47 29.37 Favored Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.82 -0.705 . . . . 22.670000000000002 112.681 179.875 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 70.2 mtp -133.05 153.63 51.32 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.677 0.275 . . . . 22.91 110.586 179.805 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.59 HG23 ' HB2' ' A' ' 140' ' ' GLU . 42.3 mm -114.95 145.65 20.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 121.282 0.563 . . . . 18.41 111.987 -179.579 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 137' ' ' ASN . . . . . 0.43 ' OD1' ' HB2' ' A' ' 139' ' ' GLU . 1.0 OUTLIER -119.93 157.19 29.29 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.171 -0.922 . . . . 16.82 108.965 178.136 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 79.9 t80 -39.99 -23.96 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 112.06 0.393 . . . . 14.65 112.06 -179.6 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 139' ' ' GLU . . . . . 0.43 ' HB2' ' OD1' ' A' ' 137' ' ' ASN . 38.5 mt-10 -80.76 -56.13 4.35 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 120.697 0.284 . . . . 14.82 111.18 -179.223 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.59 ' HB2' HG23 ' A' ' 136' ' ' ILE . 59.8 mt-10 -60.46 -34.8 74.53 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.341 -0.391 . . . . 17.460000000000001 110.353 -179.927 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.451 ' CZ ' HG21 ' A' ' 145' ' ' ILE . 85.3 t80 -63.96 -55.0 25.67 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.0 -0.545 . . . . 12.93 110.125 179.174 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 142' ' ' VAL . . . . . 0.582 HG13 ' SD ' ' A' ' 85' ' ' MET . 2.6 t -47.91 -36.82 5.89 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-N 115.464 -0.789 . . . . 10.699999999999999 111.79 179.306 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 143' ' ' TRP . . . . . 0.546 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 91.5 t90 -69.79 -55.96 8.43 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.824 0.675 . . . . 13.66 112.824 -178.737 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 144' ' ' MET . . . . . 0.681 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 18.7 ptt? -63.91 -23.57 67.4 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 113.175 0.805 . . . . 14.5 113.175 -177.521 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 145' ' ' ILE . . . . . 0.537 HG13 ' N ' ' A' ' 146' ' ' SER . 49.2 pt -80.49 -40.7 19.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 N-CA-C 112.399 0.518 . . . . 11.25 112.399 -179.28 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 146' ' ' SER . . . . . 0.537 ' N ' HG13 ' A' ' 145' ' ' ILE . 78.7 p -61.21 -13.79 20.88 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.181 0.515 . . . . 8.5399999999999991 110.55 -179.71 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 147' ' ' GLN . . . . . 0.546 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 6.3 mm-40 -98.49 -19.11 17.84 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.377 -0.828 . . . . 11.869999999999999 111.289 -179.16 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 148' ' ' LYS . . . . . 0.406 ' HG3' ' O ' ' A' ' 144' ' ' MET . 99.1 mttt . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.234 -0.889 . . . . 13.68 110.959 179.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.403 ' HB2' ' CD2' ' A' ' 4' ' ' LEU . 97.7 p . . . . . 0 N--CA 1.485 1.313 0 CA-C-O 120.559 0.218 . . . . 4.8899999999999997 110.79 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -159.29 51.58 0.36 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.92 0.391 . . . . 3.2599999999999998 111.806 -179.665 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.502 ' H ' HD22 ' A' ' 4' ' ' LEU . 0.6 OUTLIER -90.21 138.39 31.57 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.172 -0.467 . . . . 1.27 110.35 179.237 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 74.0 p -70.01 -177.63 1.39 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.42 -0.355 . . . . 1.1200000000000001 111.341 -179.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -63.41 -48.02 79.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.435 -0.348 . . . . 2.2000000000000002 111.492 -179.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -67.14 -41.54 85.91 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.976 0.417 . . . . 1.3500000000000001 110.906 -179.425 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.568 HE21 ' HA ' ' A' ' 8' ' ' GLN . 0.0 OUTLIER -64.28 -45.63 87.2 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.822 -0.627 . . . . 2.2200000000000002 111.037 179.948 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.532 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 56.5 mt -58.1 -51.16 74.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.432 -0.349 . . . . 0.54000000000000004 110.543 179.526 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.87 -19.26 65.7 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.149 -0.478 . . . . 0.5 111.189 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -72.44 -56.57 5.21 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.275 -0.42 . . . . 2.27 111.777 -179.275 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.532 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 28.1 p90 -79.03 -24.41 43.67 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 120.532 -0.467 . . . . 0.37 110.625 -179.739 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 19.7 tptm -66.62 -37.13 84.23 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 109.174 -0.676 . . . . 1.23 109.174 178.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.519 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 27.4 t70 -66.97 -50.7 61.48 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 109.121 -0.696 . . . . 0.44 109.121 178.332 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.81 -14.51 59.43 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.679 -0.692 . . . . 0.28999999999999998 110.612 179.042 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 75.5 t80 -80.08 -47.76 14.31 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.845 -0.616 . . . . 0.47999999999999998 110.647 -179.677 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 26.8 m -69.65 -20.49 23.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.142 -0.481 . . . . 1.1100000000000001 110.302 179.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.519 ' HG3' ' O ' ' A' ' 14' ' ' ASP . 74.5 mt-30 -58.97 -35.5 73.3 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.729 -0.669 . . . . 1.6000000000000001 111.02 179.434 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 88.1 m-85 -105.91 44.16 1.07 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.276 -0.42 . . . . 0.64000000000000001 111.509 -179.499 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -135.27 70.4 1.44 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.017 0.437 . . . . 0.44 110.72 179.463 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.438 ' N ' ' HD2' ' A' ' 21' ' ' LYS . 0.9 OUTLIER -78.24 -25.95 47.09 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.92 -0.582 . . . . 2.1000000000000001 110.89 179.983 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -70.3 -11.75 61.12 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.011 -0.54 . . . . 1.8 111.213 -179.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 66.46 17.22 66.27 Favored Glycine 0 C--N 1.33 0.208 0 C-N-CA 120.857 -0.687 . . . . 0.46000000000000002 112.898 179.655 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 60.0 p -90.39 8.24 34.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.751 0.31 . . . . 0.40000000000000002 111.181 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 57.93 19.59 37.8 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.854 -0.688 . . . . 0.33000000000000002 112.126 -179.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.513 ' HD3' ' OD1' ' A' ' 64' ' ' ASN . 20.7 mtmm -128.23 154.54 45.74 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.928 0.394 . . . . 1.1000000000000001 111.205 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.43 HG13 ' O ' ' A' ' 27' ' ' ILE . 45.7 pt -120.64 129.27 75.79 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.111 -0.495 . . . . 0.5 110.823 179.567 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -53.24 134.88 39.17 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.803 0.335 . . . . 0.29999999999999999 110.882 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 5.9 t -61.2 -17.19 51.89 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.096 -0.502 . . . . 1.03 110.869 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 59.1 mtt180 -78.79 -19.12 52.91 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.885 -0.598 . . . . 3.0800000000000001 110.488 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 33.3 mm-40 -97.28 -2.05 43.42 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.656 -0.702 . . . . 2.2599999999999998 110.9 179.813 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.556 HD23 HD22 ' A' ' 63' ' ' LEU . 0.4 OUTLIER -55.64 -54.79 39.84 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.908 -0.587 . . . . 1.3700000000000001 110.956 -179.956 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -56.14 -39.4 80.57 Favored Glycine 0 C--N 1.331 0.274 0 C-N-CA 120.654 -0.784 . . . . 0.32000000000000001 112.152 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 32.1 m -65.4 -35.96 82.51 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.995 0.426 . . . . 0.31 110.645 179.584 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 24.4 tp -68.52 -36.62 79.11 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.896 -0.593 . . . . 1.24 110.677 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.539 ' HG3' ' HG3' ' A' ' 43' ' ' PRO . 23.2 mmt -62.27 -42.0 98.96 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.273 -0.421 . . . . 1.1000000000000001 109.925 179.098 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -63.92 -33.39 75.59 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.771 -0.65 . . . . 2.6899999999999999 109.691 179.033 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 2.4 m -72.57 -16.92 61.75 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.315 -0.857 . . . . 1.0600000000000001 110.385 179.352 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 95.1 mt -114.0 157.24 22.73 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.663 -0.698 . . . . 1.26 110.641 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -52.98 -9.88 0.93 Allowed Glycine 0 CA--C 1.521 0.434 0 C-N-CA 120.997 -0.62 . . . . 0.68999999999999995 113.245 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 73.6 mm-40 -66.29 174.45 2.64 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.941 0.401 . . . . 1.97 111.314 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -173.01 67.91 0.37 Allowed Pre-proline 0 C--N 1.331 -0.231 0 CA-C-N 115.805 -0.634 . . . . 2.6600000000000001 110.336 179.688 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.539 ' HG3' ' HG3' ' A' ' 36' ' ' MET . 47.0 Cg_endo -67.87 148.09 75.97 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.595 2.197 . . . . 0.51000000000000001 112.332 -179.8 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 12.4 m -64.68 154.26 37.13 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.09 -0.505 . . . . 0.72999999999999998 110.543 179.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.401 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 7.1 tp10 -49.62 -55.07 14.96 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.681 0.276 . . . . 2.7000000000000002 111.22 -179.404 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.63 -46.03 70.34 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.227 -0.442 . . . . 0.46000000000000002 111.507 -179.726 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -51.38 -54.52 25.71 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.335 -0.393 . . . . 2.23 111.146 -179.8 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 47.3 mt -56.9 -40.91 77.17 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.731 0.3 . . . . 1.3600000000000001 111.019 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.401 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 79.5 mm-40 -66.16 -27.56 68.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.885 0.374 . . . . 1.22 111.0 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 30.2 m-20 -76.73 -52.8 8.93 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.106 -0.497 . . . . 0.62 111.85 -179.397 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.4 pp -69.37 -35.45 75.85 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.481 -0.327 . . . . 0.39000000000000001 111.879 -179.033 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 72.8 mt -69.36 -48.59 66.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.64 0.257 . . . . 0.5 111.138 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.99 -37.37 82.25 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.882 0.372 . . . . 0.58999999999999997 110.757 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -66.58 -51.65 54.09 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.081 -0.509 . . . . 2.54 110.52 179.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -67.25 -14.9 63.34 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.01 -0.541 . . . . 0.53000000000000003 111.055 179.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -74.34 -27.29 60.62 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.283 -0.417 . . . . 1.95 110.932 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -118.28 7.83 12.13 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.173 -0.467 . . . . 2.48 110.813 179.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -122.97 -12.68 7.95 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.196 -0.456 . . . . 2.48 110.977 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -140.46 27.18 2.1 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.218 -0.446 . . . . 2.0499999999999998 110.886 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . 0.552 ' N ' HD22 ' A' ' 60' ' ' ASN . 0.8 OUTLIER 62.01 -85.18 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.917 -0.583 . . . . 1.47 111.118 179.984 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -151.85 -3.05 0.19 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.755 -0.736 . . . . 0.42999999999999999 112.409 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.427 HE22 ' N ' ' A' ' 27' ' ' ILE . 0.0 OUTLIER -115.05 154.9 28.01 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.07 0.462 . . . . 0.38 111.071 179.966 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.587 ' HG ' ' HB2' ' A' ' 67' ' ' GLU . 0.8 OUTLIER -119.6 156.17 30.89 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.691 -0.686 . . . . 1.4299999999999999 109.96 -179.795 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . 0.588 ' HB2' ' HG2' ' A' ' 67' ' ' GLU . 52.7 m-80 -111.26 156.4 21.55 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 121.098 0.475 . . . . 1.1899999999999999 111.719 -178.674 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 84.0 t80 -48.11 -41.64 26.98 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.348 -0.842 . . . . 0.40000000000000002 109.96 178.757 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.68 -36.22 82.01 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.483 -0.781 . . . . 0.81000000000000005 111.337 179.421 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.588 ' HG2' ' HB2' ' A' ' 64' ' ' ASN . 8.8 mm-40 -64.69 -55.04 22.51 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.192 -0.458 . . . . 1.3600000000000001 110.004 179.524 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.436 ' HD1' HD21 ' A' ' 32' ' ' LEU . 43.4 t80 -59.2 -54.18 49.89 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.829 -0.623 . . . . 0.51000000000000001 110.541 179.378 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 35.2 t -52.77 -49.31 65.81 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 116.119 -0.491 . . . . 0.75 110.276 179.526 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -43.84 -50.72 7.23 Favored Glycine 0 N--CA 1.451 -0.342 0 CA-C-N 115.613 -0.721 . . . . 0.40999999999999998 112.23 179.225 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.87 HG23 ' HE2' ' A' ' 74' ' ' LYS . 13.5 mt -66.81 -51.4 55.98 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.261 0 CA-C-O 120.912 0.386 . . . . 0.51000000000000001 110.78 179.41 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . 0.454 ' O ' ' HG3' ' A' ' 76' ' ' MET . 83.8 mmm -45.91 -36.47 5.45 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.932 -0.576 . . . . 1.01 109.766 179.192 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -63.21 -55.03 28.4 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.253 -0.885 . . . . 0.69999999999999996 110.622 179.312 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.87 ' HE2' HG23 ' A' ' 71' ' ' ILE . 58.6 pttt -61.0 -28.62 69.17 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.296 -0.411 . . . . 1.3799999999999999 110.84 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -77.68 -42.17 35.49 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.233 -0.439 . . . . 1.98 111.266 179.438 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . 0.502 ' SD ' HD12 ' A' ' 4' ' ' LEU . 2.8 mtt -62.12 -22.82 66.14 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 116.258 -0.428 . . . . 1.2 110.919 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.422 HH11 ' HD2' ' A' ' 77' ' ' ARG . 13.4 mmm180 -51.44 -14.96 0.34 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.049 -0.523 . . . . 4.6900000000000004 111.782 179.887 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -56.01 -16.67 5.24 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.772 0.32 . . . . 4.0099999999999998 110.814 179.49 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 19.8 m -108.09 113.75 27.14 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.037 -0.529 . . . . 5.2800000000000002 110.799 179.847 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -93.0 38.03 1.03 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.43 -0.35 . . . . 5.5999999999999996 111.599 -179.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.575 ' O ' ' HG2' ' A' ' 85' ' ' MET . 9.7 t -63.52 135.12 56.63 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.57 -0.287 . . . . 7.29 110.503 179.699 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -66.55 -23.43 66.22 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 112.558 0.577 . . . . 9.7400000000000002 112.558 -178.741 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -64.45 -56.05 16.79 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-O 121.102 0.477 . . . . 12.109999999999999 111.809 -179.137 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -59.21 -19.31 44.42 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.865 -0.607 . . . . 10.869999999999999 111.118 -179.458 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . 0.616 ' CB ' HG22 ' A' ' 142' ' ' VAL . 2.0 mmt -74.71 -49.85 19.66 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.137 -0.483 . . . . 11.09 110.609 -179.574 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 46.5 ttt180 -54.85 -43.17 72.81 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.036 -0.529 . . . . 15.52 110.075 179.775 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 25.3 mm-40 -60.37 -42.42 95.79 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.139 0.495 . . . . 14.85 109.973 178.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -69.85 -23.08 63.23 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.749 -0.66 . . . . 14.109999999999999 111.075 179.586 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 88.5 t80 -68.98 -41.56 77.75 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.389 -0.369 . . . . 15.73 110.419 179.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 50.0 mtmt -68.7 -39.13 80.64 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.92 -0.582 . . . . 17.66 110.646 179.552 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 81.7 mt -68.23 -44.48 84.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.038 -0.528 . . . . 18.149999999999999 111.441 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -67.69 -55.66 12.33 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.526 -0.306 . . . . 18.34 111.366 -179.646 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 41.8 t0 -55.32 99.08 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.823 0.344 . . . . 19.289999999999999 110.409 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.535 ' HG2' ' HB3' ' A' ' 104' ' ' GLU . 21.9 mmm180 -55.86 -33.08 64.21 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.125 -0.488 . . . . 22.25 110.955 -179.399 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.439 ' HB2' ' OD1' ' A' ' 97' ' ' ASP . 6.2 m-20 -101.71 170.13 8.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.189 -0.46 . . . . 23.34 110.929 -179.793 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.45 5.38 57.15 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.794 -0.717 . . . . 22.0 112.384 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.439 ' OD1' ' HB2' ' A' ' 95' ' ' ASP . 5.0 p-10 -58.7 -39.06 79.66 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.706 0.289 . . . . 22.280000000000001 111.307 -179.755 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 114.06 17.12 7.45 Favored Glycine 0 C--N 1.331 0.279 0 C-N-CA 120.698 -0.763 . . . . 19.93 112.91 179.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 99.2 m-85 -145.12 152.56 40.26 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 120.74 0.305 . . . . 20.300000000000001 110.829 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 61.2 mt -114.33 138.22 45.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 116.299 -0.41 . . . . 19.370000000000001 111.069 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 41.7 m -114.61 156.13 45.15 Favored Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 115.988 -0.551 . . . . 22.489999999999998 110.939 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_exo -41.76 -39.56 5.13 Favored 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 122.49 2.127 . . . . 23.0 112.281 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.71 -50.2 73.38 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.971 -0.559 . . . . 24.559999999999999 110.613 179.465 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.535 ' HB3' ' HG2' ' A' ' 94' ' ' ARG . 44.3 mt-10 -64.53 -28.37 69.6 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.442 -0.799 . . . . 22.23 111.188 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.536 HD23 ' HB ' ' A' ' 121' ' ' ILE . 38.0 tp -64.97 -55.5 18.7 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.285 -0.416 . . . . 20.359999999999999 111.429 -179.076 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.615 ' HB3' HD13 ' A' ' 121' ' ' ILE . 14.6 ptt180 -64.32 -38.76 92.2 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.852 0.358 . . . . 27.190000000000001 110.531 179.893 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . 0.452 ' N ' ' HG3' ' A' ' 106' ' ' ARG . 1.7 t80 -54.55 -39.37 67.64 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.957 -0.565 . . . . 25.359999999999999 111.022 -179.544 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.474 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 76.8 t -80.15 -49.65 18.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.521 -0.308 . . . . 21.059999999999999 111.37 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -50.03 -35.54 25.29 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.389 -0.369 . . . . 20.93 111.08 -179.835 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 78.1 mt -75.92 -31.22 21.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.333 -0.394 . . . . 25.129999999999999 110.565 179.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 95.2 m-20 -67.8 -43.34 79.9 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.07 -0.514 . . . . 23.32 110.812 179.507 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.474 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 6.2 mt -66.25 -45.33 80.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.069 -0.514 . . . . 21.07 110.826 -179.841 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 137.95 -0.15 2.61 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.922 -0.656 . . . . 23.050000000000001 112.278 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -88.61 104.63 17.02 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.734 0.302 . . . . 22.59 111.201 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -74.04 113.71 11.54 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.298 -0.41 . . . . 27.960000000000001 110.506 179.526 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . 0.413 HG12 ' OE1' ' A' ' 120' ' ' GLU . 5.3 m -138.35 155.2 28.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 121.004 0.431 . . . . 24.75 111.789 -179.574 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . 0.417 ' O ' HG12 ' A' ' 121' ' ' ILE . 64.0 p -99.18 156.76 16.8 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.702 -0.681 . . . . 27.239999999999998 110.448 179.24 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -58.68 -21.4 54.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.41 -0.359 . . . . 26.629999999999999 111.507 -179.658 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -76.31 -55.38 5.61 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 111.874 0.324 . . . . 29.140000000000001 111.874 -179.269 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.413 ' OE1' HG12 ' A' ' 116' ' ' VAL . 15.2 pt-20 -61.71 -39.44 91.5 Favored 'General case' 0 C--O 1.234 0.237 0 N-CA-C 111.679 0.251 . . . . 24.190000000000001 111.679 -179.33 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.615 HD13 ' HB3' ' A' ' 106' ' ' ARG . 18.7 pt -71.19 -34.88 56.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 C-N-CA 120.959 -0.297 . . . . 22.329999999999998 111.251 -179.709 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.498 ' N ' HG13 ' A' ' 121' ' ' ILE . 15.0 t70 -59.01 -43.84 91.61 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.953 0.406 . . . . 24.289999999999999 110.292 179.583 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -63.85 -42.24 97.61 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.89 -0.596 . . . . 24.739999999999998 110.413 179.44 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.436 ' CE ' HD21 ' A' ' 105' ' ' LEU . 65.1 ttp -56.59 -34.04 66.79 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.15 -0.477 . . . . 19.710000000000001 110.825 179.663 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.574 HG23 HD11 ' A' ' 136' ' ' ILE . 87.0 mt -68.92 -46.09 79.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.237 -0.438 . . . . 19.949999999999999 110.371 179.592 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 27.9 tpt180 -59.57 -31.46 69.46 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.99 -0.55 . . . . 24.949999999999999 111.04 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -66.96 -40.58 87.52 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.17 -0.468 . . . . 18.690000000000001 111.302 -179.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.522 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -91.19 -13.59 32.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.376 -0.374 . . . . 16.469999999999999 111.094 -179.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . 0.447 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 8.7 t70 -95.99 106.72 18.92 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.151 -0.477 . . . . 20.399999999999999 111.054 -179.697 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 87.3 m-85 -98.93 -32.91 11.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.033 -0.53 . . . . 21.43 111.533 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -69.3 -15.5 63.36 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.719 0.295 . . . . 23.370000000000001 110.981 -179.734 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . 0.419 ' HA2' ' OD2' ' A' ' 129' ' ' ASP . . . 58.45 84.95 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.835 -0.697 . . . . 24.32 112.874 179.615 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 12.3 p-10 -147.66 -9.64 0.41 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.768 0.318 . . . . 23.879999999999999 111.004 179.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 80.14 18.2 72.51 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.835 -0.698 . . . . 22.670000000000002 112.43 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 40.4 mtp -137.52 155.3 49.42 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.576 0.227 . . . . 22.91 110.454 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.72 HG23 ' HB2' ' A' ' 140' ' ' GLU . 48.8 mm -114.79 142.8 26.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 121.404 0.621 . . . . 18.41 112.233 -179.242 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . 0.423 ' OD1' ' HB2' ' A' ' 139' ' ' GLU . 1.6 p30 -115.45 157.76 23.51 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.006 -0.997 . . . . 16.82 109.108 178.129 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.624 ' O ' HG23 ' A' ' 142' ' ' VAL . 29.0 t80 -39.12 -25.45 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 112.432 0.53 . . . . 14.65 112.432 -179.239 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.423 ' HB2' ' OD1' ' A' ' 137' ' ' ASN . 43.5 mt-10 -80.18 -55.75 4.7 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.692 0.282 . . . . 14.82 111.529 -179.149 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.72 ' HB2' HG23 ' A' ' 136' ' ' ILE . 53.3 mt-10 -61.12 -31.33 71.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.941 0.401 . . . . 17.460000000000001 110.519 -179.825 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.604 ' CE2' HD13 ' A' ' 145' ' ' ILE . 88.9 t80 -67.67 -55.7 12.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.839 -0.619 . . . . 12.93 110.606 179.726 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.624 HG23 ' O ' ' A' ' 138' ' ' TYR . 34.4 t -47.23 -43.39 7.77 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 115.833 -0.622 . . . . 10.699999999999999 111.964 179.523 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 82.8 t90 -65.29 -55.21 19.61 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 112.697 0.629 . . . . 13.66 112.697 -178.448 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . 0.522 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 11.1 ptt? -61.78 -32.39 72.66 Favored 'General case' 0 N--CA 1.464 0.237 0 N-CA-C 112.55 0.574 . . . . 14.5 112.55 -177.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . 0.604 HD13 ' CE2' ' A' ' 141' ' ' PHE . 25.3 pt -80.71 -20.87 11.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 C-N-CA 120.779 -0.368 . . . . 11.25 111.423 179.835 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 33.2 t -67.66 -32.8 73.73 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.104 0.478 . . . . 8.5399999999999991 110.175 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 7.3 mm-40 -84.6 -23.65 29.49 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.595 -0.729 . . . . 11.869999999999999 111.1 180.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 63.9 mttm . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.289 -0.863 . . . . 13.68 110.989 179.503 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 149' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 151' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.411 ' N ' ' HA ' ' A' ' 77' ' ' ARG . 68.1 m . . . . . 0 N--CA 1.486 1.343 0 CA-C-O 120.829 0.347 . . . . 4.8899999999999997 110.932 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -59.7 153.38 20.38 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.0 -0.545 . . . . 3.2599999999999998 110.881 179.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 21.4 mt -67.75 89.77 0.27 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.253 -0.43 . . . . 1.27 110.919 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.554 HG22 ' H ' ' A' ' 6' ' ' GLU . 0.2 OUTLIER -73.44 -171.23 0.94 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.178 -0.465 . . . . 1.1200000000000001 110.869 179.969 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.554 ' H ' HG22 ' A' ' 5' ' ' THR . 9.9 tp10 -69.94 -46.25 65.72 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.134 0.492 . . . . 2.2000000000000002 110.442 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -72.03 -41.9 66.96 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.578 -0.737 . . . . 1.3500000000000001 110.664 179.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -60.55 -45.84 92.41 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.1 -0.5 . . . . 2.2200000000000002 110.603 179.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.532 ' HA ' ' CZ ' ' A' ' 12' ' ' PHE . 40.7 mt -57.92 -52.27 60.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.16 -0.473 . . . . 0.54000000000000004 110.879 179.733 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.2 -21.4 65.09 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.068 -0.515 . . . . 0.5 111.716 -179.607 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -72.72 -56.78 4.76 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 111.991 0.367 . . . . 2.27 111.991 -178.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.532 ' CZ ' ' HA ' ' A' ' 9' ' ' ILE . 7.5 p90 -77.92 -26.18 48.83 Favored 'General case' 0 C--N 1.332 -0.178 0 C-N-CA 120.674 -0.41 . . . . 0.37 110.789 -179.764 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.436 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 26.7 tptp -65.01 -38.47 91.04 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 109.383 -0.599 . . . . 1.23 109.383 178.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.485 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 20.1 t70 -66.65 -48.62 68.83 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 108.945 -0.761 . . . . 0.44 108.945 178.186 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.78 -14.59 59.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.411 -0.813 . . . . 0.28999999999999998 110.723 179.184 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.436 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 88.3 t80 -77.14 -49.89 14.21 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.029 -0.532 . . . . 0.47999999999999998 110.436 -179.579 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 16.5 m -67.32 -22.6 29.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.215 -0.448 . . . . 1.1100000000000001 110.26 179.67 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.485 ' HG2' ' O ' ' A' ' 14' ' ' ASP . 26.1 mm-40 -63.85 -20.82 66.1 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.829 -0.623 . . . . 1.6000000000000001 111.379 179.444 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 45.2 m-85 -114.83 24.21 11.96 Favored 'General case' 0 C--N 1.332 -0.156 0 N-CA-C 111.903 0.335 . . . . 0.64000000000000001 111.903 -179.36 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -112.26 81.45 1.47 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.965 0.412 . . . . 0.44 110.504 179.335 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -92.44 -25.52 18.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.832 -0.622 . . . . 2.1000000000000001 111.286 -179.63 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -70.49 -15.33 62.79 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.102 -0.499 . . . . 1.8 111.355 -179.497 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.16 -0.08 68.84 Favored Glycine 0 CA--C 1.518 0.24 0 C-N-CA 120.749 -0.739 . . . . 0.46000000000000002 112.708 179.718 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 40.4 p -82.48 11.9 5.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.632 0.253 . . . . 0.40000000000000002 111.222 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 57.86 24.47 53.92 Favored Glycine 0 C--N 1.33 0.245 0 C-N-CA 120.676 -0.773 . . . . 0.33000000000000002 111.724 -179.489 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.653 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 47.7 mtpt -129.61 155.49 45.75 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.725 0.298 . . . . 1.1000000000000001 110.678 -179.516 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.431 ' N ' HE22 ' A' ' 62' ' ' GLN . 36.3 pt -118.47 130.85 72.73 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 116.411 -0.359 . . . . 0.5 111.29 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -50.07 129.38 20.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.372 -0.376 . . . . 0.29999999999999999 111.274 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.418 HG22 HD13 ' A' ' 63' ' ' LEU . 79.7 p -61.55 -21.37 64.22 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.118 -0.492 . . . . 1.03 110.722 179.819 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 51.8 mtp180 -80.91 4.08 20.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.742 -0.663 . . . . 3.0800000000000001 110.201 179.492 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -119.05 -6.63 10.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.547 -0.751 . . . . 2.2599999999999998 110.55 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.49 HD22 HD11 ' A' ' 51' ' ' LEU . 10.2 tt -55.2 -51.18 67.37 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.242 -0.436 . . . . 1.3700000000000001 110.18 179.534 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -52.27 -48.88 52.77 Favored Glycine 0 C--N 1.331 0.288 0 C-N-CA 120.531 -0.842 . . . . 0.32000000000000001 111.496 179.209 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 90.7 m -59.36 -34.44 72.39 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 121.319 0.58 . . . . 0.31 109.848 178.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 47.2 tp -70.36 -28.66 65.3 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.296 -0.865 . . . . 1.24 110.26 179.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.481 ' HG2' ' O ' ' A' ' 32' ' ' LEU . 23.9 mmm -76.12 -21.42 56.66 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.06 -0.518 . . . . 1.1000000000000001 109.768 179.057 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -75.41 -44.74 42.98 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.651 -0.704 . . . . 2.6899999999999999 110.326 179.071 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.442 HG23 ' HG ' ' A' ' 39' ' ' LEU . 7.9 t -71.51 -13.28 61.76 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.031 -0.531 . . . . 1.0600000000000001 110.416 179.13 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.442 ' HG ' HG23 ' A' ' 38' ' ' THR . 76.7 mt -112.83 157.4 21.43 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.727 -0.67 . . . . 1.26 110.187 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -71.84 34.85 0.61 Allowed Glycine 0 CA--C 1.521 0.449 0 C-N-CA 120.762 -0.733 . . . . 0.68999999999999995 113.34 -179.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.411 ' H ' ' C ' ' A' ' 39' ' ' LEU . 12.8 mm-40 -93.58 -80.68 0.38 Allowed 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.791 0.329 . . . . 1.97 111.087 179.569 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 32.5 m-80 56.81 74.89 0.62 Allowed Pre-proline 0 C--N 1.332 -0.184 0 CA-C-N 115.943 -0.571 . . . . 2.6600000000000001 111.05 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.402 ' HD3' ' HB3' ' A' ' 36' ' ' MET . 92.1 Cg_endo -79.18 173.88 12.78 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.654 2.236 . . . . 0.51000000000000001 112.446 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 19.9 m -69.07 152.71 44.86 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.172 -0.467 . . . . 0.72999999999999998 110.778 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -55.09 -55.21 33.65 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.733 0.302 . . . . 2.7000000000000002 111.128 -179.648 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -54.43 -47.92 72.26 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.092 -0.504 . . . . 0.46000000000000002 111.804 -179.565 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.433 ' HG2' HD23 ' A' ' 51' ' ' LEU . 39.5 tt0 -57.99 -48.24 80.61 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.87 0.367 . . . . 2.23 110.456 -179.629 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.43 ' HA ' HD21 ' A' ' 51' ' ' LEU . 31.8 tp -57.07 -38.61 73.54 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.78 -0.645 . . . . 1.3600000000000001 110.977 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 83.3 mm-40 -72.82 -31.04 64.52 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.303 -0.408 . . . . 1.22 111.551 -179.682 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 28.1 m-20 -73.78 -54.99 6.79 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.547 -0.297 . . . . 0.62 111.8 -179.44 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.49 HD11 HD22 ' A' ' 32' ' ' LEU . 2.2 pp -60.75 -38.57 85.64 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.611 -0.268 . . . . 0.39000000000000001 111.516 -179.226 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 82.4 mt -68.81 -36.75 75.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.934 0.397 . . . . 0.5 110.744 179.595 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.96 -50.76 61.29 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.096 -0.502 . . . . 0.58999999999999997 111.073 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -62.08 -38.53 89.17 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.283 -0.417 . . . . 2.54 110.603 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -73.58 -18.21 61.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.285 -0.416 . . . . 0.53000000000000003 111.04 179.747 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -70.8 -55.02 9.48 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.272 -0.422 . . . . 1.95 110.612 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 7.9 p30 -89.65 43.68 1.16 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.183 -0.462 . . . . 2.48 110.988 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -155.16 -15.66 0.11 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.705 -0.68 . . . . 2.48 110.61 179.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -144.21 21.39 1.73 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.911 -0.586 . . . . 2.0499999999999998 110.613 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 9.8 m120 64.49 -83.24 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.126 0 CA-C-N 115.861 -0.609 . . . . 1.47 111.314 179.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -154.69 19.54 0.59 Allowed Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.793 -0.718 . . . . 0.42999999999999999 112.336 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.653 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -128.49 155.31 45.03 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.981 0.419 . . . . 0.38 111.156 -179.847 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.552 ' HG ' ' HB2' ' A' ' 67' ' ' GLU . 9.5 tp -124.45 154.09 41.0 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.901 -0.59 . . . . 1.4299999999999999 110.482 -179.604 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . 0.419 ' CG ' ' HE3' ' A' ' 26' ' ' LYS . 7.6 m-80 -113.41 157.63 21.67 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-O 121.111 0.481 . . . . 1.1899999999999999 111.548 -179.708 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 88.1 t80 -46.88 -43.52 18.85 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.281 -0.872 . . . . 0.40000000000000002 111.02 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -67.62 -34.43 76.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 0.81000000000000005 111.877 -179.82 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.552 ' HB2' ' HG ' ' A' ' 63' ' ' LEU . 22.4 mm-40 -64.39 -53.41 48.95 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.958 0.409 . . . . 1.3600000000000001 110.245 179.682 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.461 ' O ' ' HG3' ' A' ' 72' ' ' MET . 28.0 t80 -59.91 -51.11 71.08 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.825 -0.625 . . . . 0.51000000000000001 110.336 179.261 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 1.5 m -55.25 -49.67 71.45 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.821 -0.627 . . . . 0.75 111.085 179.727 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -47.51 -49.73 20.14 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.982 -0.627 . . . . 0.40999999999999998 112.212 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.634 HG23 ' HE3' ' A' ' 74' ' ' LYS . 12.7 mt -64.19 -45.56 95.98 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.308 0 CA-C-O 121.015 0.436 . . . . 0.51000000000000001 110.743 179.541 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . 0.461 ' HG3' ' O ' ' A' ' 68' ' ' PHE . 38.0 mtp -54.84 -25.01 25.68 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.9 -0.591 . . . . 1.01 110.135 179.556 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.495 ' O ' ' HB3' ' A' ' 77' ' ' ARG . . . -76.04 -49.27 18.01 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.36 -0.382 . . . . 0.69999999999999996 110.748 179.69 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.634 ' HE3' HG23 ' A' ' 71' ' ' ILE . 19.2 pttp -65.35 -35.4 80.86 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.516 -0.311 . . . . 1.3799999999999999 111.081 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -81.41 -55.67 4.55 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.728 0.64 . . . . 1.98 112.728 -179.033 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 24.7 mtm -74.17 -56.28 5.09 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 113.066 0.765 . . . . 1.2 113.066 -178.321 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.495 ' HB3' ' O ' ' A' ' 73' ' ' ALA . 29.5 ttt180 -67.99 -55.93 10.85 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 112.13 0.419 . . . . 4.6900000000000004 112.13 -178.331 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 60.22 -80.7 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 O-C-N 123.093 0.246 . . . . 4.0099999999999998 110.669 -179.12 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.416 ' N ' ' O ' ' A' ' 77' ' ' ARG . 19.0 p -147.25 40.53 1.04 Allowed 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.45 -0.341 . . . . 5.2800000000000002 111.366 179.446 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -85.91 14.18 6.43 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 121.034 0.445 . . . . 5.5999999999999996 110.801 -179.775 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.431 HG23 ' O ' ' A' ' 81' ' ' THR . 3.9 t -70.41 90.89 0.73 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.857 -0.61 . . . . 7.29 111.605 -179.876 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.429 ' HB2' ' OH ' ' A' ' 138' ' ' TYR . 11.2 pt-20 -50.25 -20.77 1.13 Allowed 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 112.793 0.664 . . . . 9.7400000000000002 112.793 -178.876 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 25.9 mm-40 -68.78 -57.01 6.21 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.758 0.313 . . . . 12.109999999999999 111.644 -179.312 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -71.86 -27.34 62.81 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.106 0.479 . . . . 10.869999999999999 110.513 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . 0.563 ' HB3' HD11 ' A' ' 145' ' ' ILE . 27.7 mtp -70.88 -36.09 72.63 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.629 -0.714 . . . . 11.09 110.47 -179.73 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 70.0 ttt180 -68.22 -43.56 77.72 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.973 -0.558 . . . . 15.52 110.2 179.575 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -55.21 -42.91 73.94 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.74 -0.467 . . . . 14.85 109.74 178.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.428 ' HA ' HD12 ' A' ' 91' ' ' ILE . . . -61.1 -38.44 86.29 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.776 -0.647 . . . . 14.109999999999999 110.688 179.509 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -58.17 -40.89 82.63 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.237 -0.438 . . . . 15.73 110.554 179.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 26.3 mtpp -63.96 -37.9 89.11 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.829 -0.623 . . . . 17.66 110.584 179.611 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.428 HD12 ' HA ' ' A' ' 88' ' ' ALA . 66.0 mt -62.32 -44.03 98.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.875 -0.602 . . . . 18.149999999999999 111.598 -179.917 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.507 ' HA ' HG21 ' A' ' 108' ' ' VAL . 18.5 m-85 -80.31 -20.52 44.14 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 111.791 0.293 . . . . 18.34 111.791 -179.614 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -96.88 108.65 21.39 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.892 0.377 . . . . 19.289999999999999 111.047 -179.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.82 -58.9 3.33 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.941 -0.572 . . . . 22.25 111.295 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -74.82 158.86 32.72 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.151 -0.477 . . . . 23.34 111.347 -179.466 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -80.88 5.19 66.52 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.796 -0.716 . . . . 22.0 111.429 178.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 27.8 p-10 -55.52 -35.06 65.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.904 0.383 . . . . 22.280000000000001 111.384 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 89.86 30.95 11.78 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.867 -0.682 . . . . 19.93 112.167 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -146.78 146.79 30.39 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.639 0.257 . . . . 20.300000000000001 110.902 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.43 HD13 ' HB3' ' A' ' 92' ' ' PHE . 40.4 mt -114.17 125.3 71.44 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-O 120.846 0.355 . . . . 19.370000000000001 111.097 179.773 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . 0.489 ' OG ' ' HD2' ' A' ' 102' ' ' PRO . 47.3 t -114.61 152.67 46.46 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.055 -0.52 . . . . 22.489999999999998 110.421 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . 0.489 ' HD2' ' OG ' ' A' ' 101' ' ' SER . 55.6 Cg_exo -40.05 -34.71 1.01 Allowed 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.564 2.176 . . . . 23.0 112.848 179.669 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.86 -46.57 81.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.292 -0.413 . . . . 24.559999999999999 111.132 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.44 ' O ' HG23 ' A' ' 108' ' ' VAL . 43.5 mt-10 -74.37 -39.2 62.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.936 -0.574 . . . . 22.23 110.75 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.875 HD23 ' HB ' ' A' ' 121' ' ' ILE . 8.7 tp -54.86 -49.68 70.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.93 -0.577 . . . . 20.359999999999999 110.407 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 10.4 ttt180 -63.89 -47.85 78.96 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.899 -0.591 . . . . 27.190000000000001 110.582 179.424 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 68.4 t80 -49.91 -43.43 49.63 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.881 -0.6 . . . . 25.359999999999999 111.492 -179.387 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.508 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 53.9 t -72.16 -49.94 40.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.585 -0.28 . . . . 21.059999999999999 111.268 -179.785 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 18.6 mmt -49.13 -49.54 41.69 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.302 -0.408 . . . . 20.93 111.352 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 63.4 mt -59.84 -28.13 40.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.232 -0.44 . . . . 25.129999999999999 110.937 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -77.9 -29.49 50.18 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.122 -0.49 . . . . 23.32 110.937 179.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.508 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 14.8 mt -74.47 -41.35 60.92 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.387 -0.37 . . . . 21.07 110.836 -179.892 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 131.28 -0.04 5.12 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.879 -0.677 . . . . 23.050000000000001 112.422 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -101.55 109.27 21.05 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.882 0.372 . . . . 22.59 111.021 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -74.77 113.68 12.33 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.128 -0.487 . . . . 27.960000000000001 111.013 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . 0.481 HG12 ' OE1' ' A' ' 120' ' ' GLU . 4.9 m -131.21 146.39 33.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 121.006 0.432 . . . . 24.75 111.437 179.634 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 55.3 p -92.88 152.39 19.43 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.883 -0.599 . . . . 27.239999999999998 110.128 179.306 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -55.79 -19.05 9.97 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.328 -0.396 . . . . 26.629999999999999 111.118 -179.69 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -76.11 -55.48 5.55 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.356 -0.384 . . . . 29.140000000000001 111.709 -179.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.481 ' OE1' HG12 ' A' ' 116' ' ' VAL . 14.5 pt-20 -62.59 -40.82 98.13 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 111.873 0.323 . . . . 24.190000000000001 111.873 -179.152 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.875 ' HB ' HD23 ' A' ' 105' ' ' LEU . 43.9 pt -70.09 -35.14 62.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 C-N-CA 120.853 -0.339 . . . . 22.329999999999998 111.242 -179.671 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.401 ' N ' HG13 ' A' ' 121' ' ' ILE . 13.3 t70 -61.14 -38.83 87.8 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.833 0.349 . . . . 24.289999999999999 110.305 179.437 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -64.52 -46.35 83.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.055 -0.521 . . . . 24.739999999999998 110.446 179.461 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.419 ' CE ' HD21 ' A' ' 105' ' ' LEU . 53.0 ttp -56.58 -39.04 72.82 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 116.09 -0.505 . . . . 19.710000000000001 110.537 179.457 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.607 HD11 HD22 ' A' ' 105' ' ' LEU . 82.1 mt -65.36 -41.3 90.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.914 -0.585 . . . . 19.949999999999999 110.513 179.488 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 69.1 ttt180 -60.52 -32.17 71.2 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.664 -0.698 . . . . 24.949999999999999 110.821 179.666 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -67.79 -36.19 79.99 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.125 -0.489 . . . . 18.690000000000001 111.062 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.75 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -90.93 -15.48 29.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.262 -0.426 . . . . 16.469999999999999 110.964 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . 0.44 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 19.1 t70 -98.39 106.67 18.98 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.978 -0.556 . . . . 20.399999999999999 110.902 -179.662 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -94.19 -33.34 13.33 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.805 -0.634 . . . . 21.43 111.448 -179.644 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 3.5 p30 -67.81 -15.97 63.88 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.87 0.367 . . . . 23.370000000000001 110.649 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 60.41 85.63 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.962 -0.637 . . . . 24.32 112.85 179.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -143.05 -35.4 0.4 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.753 0.311 . . . . 23.879999999999999 110.851 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 110.91 6.06 26.66 Favored Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.832 -0.699 . . . . 22.670000000000002 112.729 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 78.3 mtp -131.43 155.26 47.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.631 0.253 . . . . 22.91 110.627 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.662 HG23 ' HB2' ' A' ' 140' ' ' GLU . 48.1 mm -117.33 144.79 24.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 121.203 0.525 . . . . 18.41 111.851 -179.477 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . 0.451 ' O ' ' N ' ' A' ' 139' ' ' GLU . 29.8 p-10 -116.92 158.13 24.56 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.354 -0.839 . . . . 16.82 109.194 178.44 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.429 ' OH ' ' HB2' ' A' ' 82' ' ' GLU . 26.8 t80 -39.21 -23.72 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.368 0.507 . . . . 14.65 112.368 -179.534 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.451 ' N ' ' O ' ' A' ' 137' ' ' ASN . 45.4 mt-10 -80.45 -56.01 4.48 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 120.744 0.307 . . . . 14.82 111.401 -179.486 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.662 ' HB2' HG23 ' A' ' 136' ' ' ILE . 34.7 mt-10 -62.82 -31.02 71.93 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.908 0.385 . . . . 17.460000000000001 110.38 -179.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.56 ' HA ' ' HE2' ' A' ' 144' ' ' MET . 78.0 t80 -66.89 -54.51 21.44 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.976 -0.556 . . . . 12.93 109.689 178.892 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.449 ' HA ' HD11 ' A' ' 145' ' ' ILE . 1.7 t -47.84 -35.44 4.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.306 -0.861 . . . . 10.699999999999999 111.286 179.101 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' TRP . . . . . 0.404 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 79.8 t90 -69.71 -55.32 10.26 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.278 0.473 . . . . 13.66 112.278 -179.42 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . 0.75 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 21.4 ptt? -65.32 -21.71 66.74 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 113.323 0.861 . . . . 14.5 113.323 -177.627 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . 0.635 ' HA ' ' HB2' ' A' ' 148' ' ' LYS . 44.0 pt -80.61 -43.77 21.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 C-N-CA 120.806 -0.357 . . . . 11.25 111.861 -179.821 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . 0.535 ' N ' HG13 ' A' ' 145' ' ' ILE . 46.9 t -63.67 -13.89 46.98 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 121.472 0.653 . . . . 8.5399999999999991 109.473 179.574 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 147' ' ' GLN . . . . . 0.404 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 6.2 mm-40 -126.19 21.73 7.32 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 114.781 -1.099 . . . . 11.869999999999999 110.025 -179.272 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . 0.635 ' HB2' ' HA ' ' A' ' 145' ' ' ILE . 27.2 ttpp . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.203 -0.904 . . . . 13.68 110.931 -179.492 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 149' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 151' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 77.9 p . . . . . 0 N--CA 1.485 1.309 0 CA-C-O 120.836 0.351 . . . . 4.8899999999999997 110.887 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -93.94 -58.27 2.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.153 -0.476 . . . . 3.2599999999999998 111.094 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 11.0 mp 45.8 64.53 1.42 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.639 -0.71 . . . . 1.27 111.014 -179.476 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.523 HG22 ' H ' ' A' ' 6' ' ' GLU . 0.2 OUTLIER -59.1 177.32 0.17 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.917 -0.583 . . . . 1.1200000000000001 111.181 -179.857 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.523 ' H ' HG22 ' A' ' 5' ' ' THR . 37.7 tt0 -62.88 -42.87 99.93 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.294 0.568 . . . . 2.2000000000000002 109.909 179.691 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -71.27 -39.0 71.83 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.309 -0.859 . . . . 1.3500000000000001 110.521 179.488 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 18.3 mm-40 -62.9 -43.12 99.67 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.894 -0.593 . . . . 2.2200000000000002 110.47 179.623 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.553 ' HA ' ' CZ ' ' A' ' 12' ' ' PHE . 83.6 mt -58.66 -54.35 34.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.139 -0.482 . . . . 0.54000000000000004 110.362 179.572 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.26 -22.38 65.94 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.042 -0.527 . . . . 0.5 111.074 179.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -73.38 -56.31 5.22 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.228 -0.442 . . . . 2.27 112.186 -178.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.553 ' CZ ' ' HA ' ' A' ' 9' ' ' ILE . 4.7 p90 -78.69 -26.51 44.92 Favored 'General case' 0 C--N 1.332 -0.157 0 C-N-CA 120.542 -0.463 . . . . 0.37 111.255 -179.374 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.431 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 27.8 tptp -67.03 -38.38 85.79 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.649 -0.5 . . . . 1.23 109.649 179.116 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.44 ' O ' HG22 ' A' ' 17' ' ' VAL . 16.8 t70 -66.62 -52.42 45.35 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 109.246 -0.65 . . . . 0.44 109.246 178.34 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.44 -13.66 52.71 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.603 -0.726 . . . . 0.28999999999999998 110.726 179.198 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.431 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 83.0 t80 -76.96 -48.51 17.89 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.083 -0.508 . . . . 0.47999999999999998 110.443 -179.741 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.44 HG22 ' O ' ' A' ' 14' ' ' ASP . 30.8 m -68.73 -22.7 26.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.205 -0.452 . . . . 1.1100000000000001 110.353 179.54 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.435 ' HG2' ' O ' ' A' ' 14' ' ' ASP . 26.3 mm-40 -59.48 -48.28 82.26 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.844 -0.616 . . . . 1.6000000000000001 111.461 179.444 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -88.14 37.34 0.81 Allowed 'General case' 0 N--CA 1.462 0.14 0 CA-C-O 120.771 0.32 . . . . 0.64000000000000001 111.622 -179.541 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -125.11 74.66 1.39 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.065 0.459 . . . . 0.44 110.397 179.328 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -84.72 -21.91 29.92 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.727 -0.67 . . . . 2.1000000000000001 111.309 -179.653 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -75.97 -22.25 56.09 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.978 -0.555 . . . . 1.8 111.398 -179.404 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 82.12 4.53 90.21 Favored Glycine 0 C--N 1.33 0.229 0 C-N-CA 120.678 -0.773 . . . . 0.46000000000000002 112.418 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 60.6 p -82.12 14.74 2.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.652 0.263 . . . . 0.40000000000000002 111.177 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 53.92 22.86 20.91 Favored Glycine 0 C--N 1.332 0.339 0 C-N-CA 120.714 -0.755 . . . . 0.33000000000000002 111.895 -179.498 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.639 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 46.2 mtpt -129.98 155.11 46.63 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.681 -0.259 . . . . 1.1000000000000001 110.692 -179.374 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.682 HG13 ' HB2' ' A' ' 63' ' ' LEU . 15.4 pt -114.89 122.12 68.36 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.203 0 CA-C-O 120.915 0.388 . . . . 0.5 112.021 -179.43 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -52.81 134.71 36.71 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.087 -0.506 . . . . 0.29999999999999999 111.114 179.693 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.0 t -65.53 -13.19 58.38 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.016 -0.538 . . . . 1.03 111.152 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 32.1 mtt180 -80.94 -10.09 59.76 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.012 -0.54 . . . . 3.0800000000000001 110.632 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -116.61 1.12 12.82 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.819 -0.628 . . . . 2.2599999999999998 110.619 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.713 HD11 ' CD1' ' A' ' 68' ' ' PHE . 16.0 tp -64.13 -47.75 78.75 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.382 -0.372 . . . . 1.3700000000000001 110.685 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.421 ' O ' ' HG3' ' A' ' 37' ' ' ARG . . . -51.86 -41.41 51.46 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.246 -0.978 . . . . 0.32000000000000001 110.927 179.115 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.437 ' O ' HG22 ' A' ' 38' ' ' THR . 95.2 m -68.14 -30.63 69.81 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.985 0.421 . . . . 0.31 110.359 179.112 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 60.6 tp -71.73 -41.52 68.39 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.761 -0.654 . . . . 1.24 111.246 -179.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.419 ' SD ' ' HG3' ' A' ' 43' ' ' PRO . 48.2 mtp -72.31 -23.9 61.24 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.301 -0.409 . . . . 1.1000000000000001 110.849 179.807 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.421 ' HG3' ' O ' ' A' ' 33' ' ' GLY . 81.9 mtt180 -72.62 -46.14 55.59 Favored 'General case' 0 N--CA 1.461 0.125 0 CA-C-O 120.958 0.408 . . . . 2.6899999999999999 110.297 179.179 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.591 HG23 HD13 ' A' ' 39' ' ' LEU . 1.8 t -68.16 -11.16 58.73 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.958 -0.564 . . . . 1.0600000000000001 110.412 179.023 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.591 HD13 HG23 ' A' ' 38' ' ' THR . 8.4 mp -111.47 156.82 21.09 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.603 -0.726 . . . . 1.26 110.304 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -45.79 -24.42 1.26 Allowed Glycine 0 CA--C 1.519 0.323 0 C-N-CA 121.224 -0.512 . . . . 0.68999999999999995 113.439 -179.652 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.433 ' OE1' ' HB3' ' A' ' 39' ' ' LEU . 19.7 mp0 -57.07 152.94 12.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.893 0.377 . . . . 1.97 111.174 179.811 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 -155.28 71.87 5.61 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.067 -0.515 . . . . 2.6600000000000001 110.952 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.419 ' HG3' ' SD ' ' A' ' 36' ' ' MET . 60.0 Cg_endo -69.24 152.5 72.01 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.789 2.326 . . . . 0.51000000000000001 112.35 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 27.2 m -76.13 151.21 37.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.174 -0.466 . . . . 0.72999999999999998 110.321 179.397 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.445 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 1.3 mp0 -44.55 -55.08 5.43 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.678 0.275 . . . . 2.7000000000000002 111.191 -179.714 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -54.5 -45.01 73.17 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.234 -0.439 . . . . 0.46000000000000002 111.392 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -56.2 -49.83 72.96 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.234 -0.439 . . . . 2.23 111.216 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 17.5 mt -59.74 -41.78 91.73 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.683 0.278 . . . . 1.3600000000000001 110.934 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.445 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 78.0 mm-40 -66.64 -30.28 70.52 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.523 -0.308 . . . . 1.22 111.274 -179.702 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 -75.83 -54.99 6.06 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.424 -0.353 . . . . 0.62 111.431 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 3.1 pp -64.09 -38.14 89.99 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.437 -0.347 . . . . 0.39000000000000001 111.361 -179.469 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 44.9 mt -65.79 -43.92 93.19 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 C-N-CA 121.066 -0.253 . . . . 0.5 110.741 179.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.8 -29.55 70.8 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.929 0.395 . . . . 0.58999999999999997 110.739 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -74.59 -52.96 10.34 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.963 -0.562 . . . . 2.54 110.075 179.625 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -69.86 -14.44 62.75 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.014 -0.539 . . . . 0.53000000000000003 111.508 179.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -73.6 -37.04 65.56 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.851 0.358 . . . . 1.95 110.965 -179.647 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 18.0 m120 -89.6 16.67 7.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.235 -0.439 . . . . 2.48 110.656 179.683 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -142.39 151.55 41.97 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.905 -0.589 . . . . 2.48 110.627 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 2.5 m120 62.86 9.92 3.98 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.221 -0.445 . . . . 2.0499999999999998 111.17 179.704 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 14.2 m120 63.03 11.52 5.22 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.329 -0.396 . . . . 1.47 111.827 179.796 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 110.44 44.03 1.02 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.61 -0.805 . . . . 0.42999999999999999 112.822 179.496 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.639 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -147.62 154.83 41.14 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.066 0.46 . . . . 0.38 111.11 179.856 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.682 ' HB2' HG13 ' A' ' 27' ' ' ILE . 66.4 mt -124.47 155.88 38.18 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.809 -0.632 . . . . 1.4299999999999999 109.982 179.531 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . 0.475 ' OD1' ' HE3' ' A' ' 26' ' ' LYS . 0.6 OUTLIER -113.15 156.74 22.66 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.924 -0.31 . . . . 1.1899999999999999 110.505 -179.66 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -43.06 -50.23 6.07 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.117 -0.492 . . . . 0.40000000000000002 110.913 179.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.7 -29.59 69.62 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.285 -0.416 . . . . 0.81000000000000005 111.35 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.422 ' HG2' ' HB2' ' A' ' 64' ' ' ASN . 14.3 mm-40 -65.1 -55.45 18.7 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.831 0.348 . . . . 1.3600000000000001 110.203 179.317 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.713 ' CD1' HD11 ' A' ' 32' ' ' LEU . 32.8 t80 -63.98 -45.98 86.65 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.077 -0.511 . . . . 0.51000000000000001 109.993 179.255 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 62.7 m -57.34 -35.46 69.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.809 -0.632 . . . . 0.75 110.251 179.477 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -59.51 -54.4 38.07 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.788 -0.72 . . . . 0.40999999999999998 111.431 179.436 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.599 HG23 ' HE2' ' A' ' 74' ' ' LYS . 12.6 mt -60.16 -43.38 92.96 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.347 0 CA-C-O 121.108 0.48 . . . . 0.51000000000000001 110.173 179.099 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . 0.409 ' HG3' ' O ' ' A' ' 68' ' ' PHE . 40.1 mtp -53.76 -32.52 52.64 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.859 -0.61 . . . . 1.01 110.051 179.317 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -67.17 -47.71 70.15 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.186 -0.461 . . . . 0.69999999999999996 110.853 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.599 ' HE2' HG23 ' A' ' 71' ' ' ILE . 65.7 pttt -70.44 -28.9 65.39 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.412 -0.358 . . . . 1.3799999999999999 111.747 -179.591 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . 0.454 ' HG3' HG22 ' A' ' 71' ' ' ILE . 6.9 mm100 -82.1 -35.06 28.98 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.186 0.517 . . . . 1.98 111.155 -179.383 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 50.7 mtp -79.6 -19.2 49.87 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.525 -0.762 . . . . 1.2 111.969 -179.024 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 51.1 mtp180 -61.48 -17.53 54.98 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.663 -0.244 . . . . 4.6900000000000004 111.361 -179.814 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -142.12 78.41 1.62 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.453 -0.34 . . . . 4.0099999999999998 111.081 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.428 ' H ' ' H ' ' A' ' 80' ' ' ASP . 14.7 t -173.39 -1.36 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 120.764 -0.375 . . . . 5.2800000000000002 111.342 179.797 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . 0.428 ' H ' ' H ' ' A' ' 79' ' ' THR . 5.3 p-10 -107.68 -54.6 2.47 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.389 -0.368 . . . . 5.5999999999999996 111.445 -179.499 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.558 ' O ' ' HG2' ' A' ' 85' ' ' MET . 6.6 t 36.11 57.06 1.02 Allowed 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 120.98 0.419 . . . . 7.29 111.836 -179.697 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -42.71 -30.91 0.41 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 115.57 -0.741 . . . . 9.7400000000000002 112.977 -179.152 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -60.56 -55.94 27.37 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 120.879 0.371 . . . . 12.109999999999999 111.52 -179.332 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -63.99 -21.93 66.71 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.169 -0.468 . . . . 10.869999999999999 111.167 -179.582 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . 0.558 ' HG2' ' O ' ' A' ' 81' ' ' THR . 11.3 mmm -74.41 -41.13 61.42 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.895 0.379 . . . . 11.09 110.578 -179.558 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 50.8 ttp180 -62.46 -46.57 87.92 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.969 -0.559 . . . . 15.52 110.404 179.729 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.439 ' O ' HG12 ' A' ' 91' ' ' ILE . 40.7 tt0 -55.73 -47.05 77.56 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.029 0.442 . . . . 14.85 109.867 179.015 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.84 -32.89 74.79 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.796 -0.638 . . . . 14.109999999999999 111.034 179.616 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 81.7 t80 -61.5 -37.12 82.52 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-O 120.978 0.418 . . . . 15.73 110.494 179.777 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 89.0 mttt -69.21 -40.1 78.21 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.871 -0.604 . . . . 17.66 110.501 179.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.439 HG12 ' O ' ' A' ' 87' ' ' GLU . 37.4 mm -60.51 -50.5 80.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.897 -0.592 . . . . 18.149999999999999 111.567 -179.799 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.448 ' HB3' HD13 ' A' ' 100' ' ' ILE . 8.2 m-85 -66.79 -48.08 70.11 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.306 -0.406 . . . . 18.34 111.635 -179.347 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 53.6 t0 -60.83 93.82 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.984 0.421 . . . . 19.289999999999999 110.557 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.717 ' HE ' ' HG2' ' A' ' 104' ' ' GLU . 34.8 mtm180 -63.01 -11.55 19.83 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.9 -0.591 . . . . 22.25 111.49 -179.497 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.436 ' HB2' ' OD1' ' A' ' 97' ' ' ASP . 8.9 m-20 -119.82 170.23 9.42 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.965 0.412 . . . . 23.34 111.09 -179.78 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.49 5.21 57.02 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.925 -0.655 . . . . 22.0 112.256 179.602 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.436 ' OD1' ' HB2' ' A' ' 95' ' ' ASP . 5.0 p-10 -60.0 -38.6 83.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.66 0.267 . . . . 22.280000000000001 111.119 -179.657 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 113.05 15.04 9.42 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.804 -0.712 . . . . 19.93 112.955 179.648 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -142.34 154.13 44.41 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.613 0.244 . . . . 20.300000000000001 110.758 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.448 HD13 ' HB3' ' A' ' 92' ' ' PHE . 76.8 mt -114.11 140.7 33.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 121.023 0.44 . . . . 19.370000000000001 111.337 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . 0.438 ' OG ' ' HD2' ' A' ' 102' ' ' PRO . 31.1 t -114.51 154.22 46.6 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 115.589 -0.732 . . . . 22.489999999999998 109.956 179.785 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . 0.438 ' HD2' ' OG ' ' A' ' 101' ' ' SER . 57.7 Cg_exo -50.53 -36.19 48.55 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 121.941 1.76 . . . . 23.0 111.442 -179.892 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.73 -48.84 79.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.765 -0.652 . . . . 24.559999999999999 109.911 178.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.717 ' HG2' ' HE ' ' A' ' 94' ' ' ARG . 45.4 mt-10 -59.47 -45.62 91.12 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.303 -0.862 . . . . 22.23 110.332 179.245 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.573 HD22 ' HB ' ' A' ' 121' ' ' ILE . 2.6 tt -63.29 -29.7 70.97 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.585 -0.734 . . . . 20.359999999999999 110.615 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.462 ' CZ ' HD11 ' A' ' 110' ' ' ILE . 12.1 tpt180 -72.81 -40.41 65.88 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.709 -0.678 . . . . 27.190000000000001 111.5 -179.645 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 53.3 t80 -76.87 -35.18 57.63 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 111.98 0.363 . . . . 25.359999999999999 111.98 -178.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.447 HG21 ' HA ' ' A' ' 92' ' ' PHE . 90.4 t -72.34 -47.45 52.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 111.692 0.256 . . . . 21.059999999999999 111.692 -179.455 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 12.9 mmt -50.98 -36.32 38.44 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.712 0.291 . . . . 20.93 111.283 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.462 HD11 ' CZ ' ' A' ' 106' ' ' ARG . 72.4 mt -67.94 -35.58 72.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.894 0.378 . . . . 25.129999999999999 110.636 179.801 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 -66.06 -37.94 87.08 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.025 -0.534 . . . . 23.32 110.744 179.594 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 14.6 mt -67.59 -28.89 68.14 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.999 -0.546 . . . . 21.07 110.954 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 116.28 0.14 20.65 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.9 -0.667 . . . . 23.050000000000001 112.305 -179.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -103.42 110.06 21.93 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.768 0.318 . . . . 22.59 110.978 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 17.6 tppt? -80.58 116.2 20.49 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.2 -0.455 . . . . 27.960000000000001 110.743 179.708 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 3.7 m -125.33 154.59 33.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.035 0.445 . . . . 24.75 111.569 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 80.6 p -95.68 146.27 24.63 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.735 -0.666 . . . . 27.239999999999998 110.085 179.173 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -53.55 -18.94 3.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.279 -0.418 . . . . 26.629999999999999 111.367 -179.597 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -79.22 -52.13 8.56 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.38 -0.373 . . . . 29.140000000000001 111.697 -179.49 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -63.09 -37.12 85.92 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.627 -0.261 . . . . 24.190000000000001 111.567 -179.269 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.573 ' HB ' HD22 ' A' ' 105' ' ' LEU . 48.3 pt -74.67 -35.46 37.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 C-N-CA 120.995 -0.282 . . . . 22.329999999999998 111.031 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -61.2 -38.59 87.1 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.961 0.41 . . . . 24.289999999999999 110.309 179.185 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -67.81 -43.48 79.54 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.897 -0.592 . . . . 24.739999999999998 110.52 179.488 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 50.2 ttp -58.11 -39.5 78.83 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.044 -0.525 . . . . 19.710000000000001 110.573 179.62 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.431 HG23 HD11 ' A' ' 136' ' ' ILE . 76.2 mt -66.94 -36.4 77.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.16 -0.473 . . . . 19.949999999999999 110.608 179.585 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 37.6 ttm180 -66.04 -29.92 70.35 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.173 -0.467 . . . . 24.949999999999999 110.806 179.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -75.88 -26.89 57.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.14 -0.482 . . . . 18.690000000000001 111.239 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.683 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -97.81 -16.23 19.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.245 -0.434 . . . . 16.469999999999999 111.173 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . 0.4 ' HA ' ' OE1' ' A' ' 140' ' ' GLU . 31.4 t70 -94.57 105.19 17.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.135 -0.484 . . . . 20.399999999999999 111.009 -179.564 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -100.33 -33.34 10.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.865 -0.607 . . . . 21.43 111.294 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -64.06 -27.95 69.45 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.375 -0.375 . . . . 23.370000000000001 110.715 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 75.98 81.88 0.52 Allowed Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.921 -0.657 . . . . 24.32 112.952 179.51 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 16.5 p-10 -155.66 6.66 0.22 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.745 0.307 . . . . 23.879999999999999 110.919 179.605 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 59.94 25.64 62.04 Favored Glycine 0 C--N 1.331 0.251 0 C-N-CA 120.891 -0.671 . . . . 22.670000000000002 112.551 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 96.8 mmm -135.96 152.5 51.02 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.596 0.236 . . . . 22.91 110.43 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.731 HG23 ' HB2' ' A' ' 140' ' ' GLU . 41.4 mm -115.86 138.71 45.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 121.341 0.591 . . . . 18.41 112.126 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . 0.454 ' O ' ' N ' ' A' ' 139' ' ' GLU . 26.4 p30 -115.38 158.85 21.87 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.267 -0.879 . . . . 16.82 109.036 178.035 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.65 ' O ' HG23 ' A' ' 142' ' ' VAL . 28.6 t80 -38.49 -24.21 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 112.589 0.589 . . . . 14.65 112.589 -179.029 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.454 ' N ' ' O ' ' A' ' 137' ' ' ASN . 44.4 mt-10 -80.25 -55.78 4.67 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.822 0.344 . . . . 14.82 111.213 -179.437 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.731 ' HB2' HG23 ' A' ' 136' ' ' ILE . 24.8 mt-10 -60.22 -27.17 66.98 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.174 -0.466 . . . . 17.460000000000001 110.266 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.725 ' HA ' ' HE2' ' A' ' 144' ' ' MET . 69.0 t80 -71.14 -56.34 6.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.877 -0.601 . . . . 12.93 110.415 179.54 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.65 HG23 ' O ' ' A' ' 138' ' ' TYR . 43.1 t -44.73 -48.05 2.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.774 -0.648 . . . . 10.699999999999999 111.794 179.432 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 78.8 t90 -64.65 -55.43 20.25 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.513 0.56 . . . . 13.66 112.513 -178.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . 0.725 ' HE2' ' HA ' ' A' ' 141' ' ' PHE . 16.7 ptt? -60.37 -35.41 75.64 Favored 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 112.451 0.538 . . . . 14.5 112.451 -178.004 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . 0.635 HG21 ' CZ ' ' A' ' 141' ' ' PHE . 3.2 pt -80.93 -17.27 12.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 C-N-CA 120.591 -0.444 . . . . 11.25 111.275 -179.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 42.2 t -69.25 -36.46 77.17 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.399 -0.593 . . . . 8.5399999999999991 109.399 179.231 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 31.8 mm-40 -93.56 -16.48 24.36 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.138 -0.937 . . . . 11.869999999999999 110.229 179.382 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . 0.438 ' CB ' ' HA ' ' A' ' 145' ' ' ILE . 37.6 ttpt . . . . . 0 C--O 1.25 1.112 0 CA-C-O 118.231 -0.89 . . . . 13.68 110.961 179.474 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 149' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 151' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 79.0 p . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 120.746 0.308 . . . . 4.8899999999999997 110.827 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -134.46 -19.34 1.9 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.169 -0.469 . . . . 3.2599999999999998 110.995 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 9.8 mp 41.23 65.13 0.87 Allowed 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.218 -0.446 . . . . 1.27 111.491 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -62.88 167.0 5.02 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.422 -0.354 . . . . 1.1200000000000001 110.68 179.616 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -49.37 -39.8 33.51 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.707 0.289 . . . . 2.2000000000000002 111.436 179.597 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.95 -33.72 59.83 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.432 -0.349 . . . . 1.3500000000000001 110.699 -179.593 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 -67.02 -44.73 79.5 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.001 -0.545 . . . . 2.2200000000000002 110.583 179.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.531 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 80.4 mt -61.29 -51.77 69.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.992 -0.549 . . . . 0.54000000000000004 110.755 179.804 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.48 -21.0 66.53 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.044 -0.526 . . . . 0.5 111.193 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -72.09 -56.42 5.64 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 116.405 -0.361 . . . . 2.27 111.696 -179.405 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.531 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 8.6 p90 -77.85 -24.67 48.52 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.703 -0.399 . . . . 0.37 110.823 -179.636 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.426 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 20.1 tptm -66.81 -36.93 83.51 Favored 'General case' 0 C--O 1.233 0.201 0 N-CA-C 109.355 -0.609 . . . . 1.23 109.355 178.738 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.447 ' O ' HG22 ' A' ' 17' ' ' VAL . 23.5 t70 -68.05 -48.18 66.32 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 109.224 -0.658 . . . . 0.44 109.224 178.347 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.72 -14.31 61.04 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.666 -0.697 . . . . 0.28999999999999998 110.528 178.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.426 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 81.2 t80 -77.48 -49.94 13.7 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-N 115.929 -0.578 . . . . 0.47999999999999998 110.18 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.447 HG22 ' O ' ' A' ' 14' ' ' ASP . 34.0 m -66.91 -21.4 28.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.075 -0.511 . . . . 1.1100000000000001 110.141 179.395 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.435 ' HG3' ' O ' ' A' ' 14' ' ' ASP . 70.5 mt-30 -59.99 -46.17 90.34 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.625 -0.716 . . . . 1.6000000000000001 111.212 179.2 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 25.8 m-85 -84.36 22.33 1.27 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.304 -0.407 . . . . 0.64000000000000001 111.565 -179.471 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -120.45 66.15 0.84 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.146 0.498 . . . . 0.44 110.441 179.385 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 11.2 mmmm -73.32 -26.19 60.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.77 -0.65 . . . . 2.1000000000000001 111.269 -179.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -68.89 -42.64 76.66 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.111 -0.495 . . . . 1.8 111.306 -179.629 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 107.73 11.77 24.09 Favored Glycine 0 C--N 1.331 0.272 0 C-N-CA 120.723 -0.751 . . . . 0.46000000000000002 112.791 179.683 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 38.5 p -86.18 10.35 14.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.71 0.29 . . . . 0.40000000000000002 111.199 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 55.68 20.12 23.35 Favored Glycine 0 C--N 1.332 0.333 0 C-N-CA 120.803 -0.713 . . . . 0.33000000000000002 112.126 -179.703 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.504 ' C ' HE22 ' A' ' 62' ' ' GLN . 32.5 mtpt -130.35 155.93 45.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.727 0.299 . . . . 1.1000000000000001 111.081 -179.669 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.464 ' N ' HE22 ' A' ' 62' ' ' GLN . 39.5 pt -115.5 133.7 61.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.408 -0.36 . . . . 0.5 111.494 -179.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -48.8 143.21 5.51 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.116 -0.493 . . . . 0.29999999999999999 111.696 -179.672 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.485 ' HA ' HD11 ' A' ' 63' ' ' LEU . 58.5 p -68.86 -29.87 68.27 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.662 -0.699 . . . . 1.03 111.724 -179.704 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.545 ' HD3' ' H ' ' A' ' 30' ' ' ARG . 0.2 OUTLIER -86.11 0.47 53.43 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.392 -0.367 . . . . 3.0800000000000001 111.109 -179.536 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -109.29 -3.57 17.08 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.105 -0.498 . . . . 2.2599999999999998 110.845 179.824 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.494 HD23 HD13 ' A' ' 63' ' ' LEU . 1.4 tm? -61.03 -52.33 65.43 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.232 -0.44 . . . . 1.3700000000000001 110.616 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.447 ' HA2' HD21 ' A' ' 48' ' ' LEU . . . -52.41 -41.25 55.12 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.638 -0.791 . . . . 0.32000000000000001 111.633 179.441 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 89.4 m -64.5 -34.67 78.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.018 0.437 . . . . 0.31 110.218 179.103 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 28.9 tp -66.82 -23.72 66.08 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.711 -0.677 . . . . 1.24 110.525 179.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.42 ' HG3' ' HG3' ' A' ' 43' ' ' PRO . 23.3 mmt -78.92 -39.23 35.34 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.221 -0.445 . . . . 1.1000000000000001 110.039 178.846 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 70.3 mtt180 -59.19 -43.12 92.2 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.691 -0.686 . . . . 2.6899999999999999 111.068 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.488 HG23 HD13 ' A' ' 39' ' ' LEU . 2.0 t -70.4 -13.29 62.07 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.38 -0.373 . . . . 1.0600000000000001 111.42 179.886 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.488 HD13 HG23 ' A' ' 38' ' ' THR . 10.6 mp -113.14 157.14 22.03 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.193 -0.458 . . . . 1.26 110.59 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -48.29 -19.23 1.07 Allowed Glycine 0 CA--C 1.519 0.314 0 CA-C-N 116.013 -0.54 . . . . 0.68999999999999995 113.441 -179.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 61.9 mm-40 -59.03 168.57 1.28 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.885 0.374 . . . . 1.97 110.894 179.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 6.0 t30 -170.27 64.35 0.47 Allowed Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.068 -0.515 . . . . 2.6600000000000001 110.777 179.605 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.534 ' HB3' ' NE2' ' A' ' 75' ' ' GLN . 32.1 Cg_endo -64.8 154.96 70.07 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.633 2.222 . . . . 0.51000000000000001 112.449 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.403 HG22 ' N ' ' A' ' 45' ' ' GLU . 20.8 m -80.43 157.01 26.37 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.027 -0.533 . . . . 0.72999999999999998 110.69 179.765 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.403 ' N ' HG22 ' A' ' 44' ' ' THR . 39.2 tt0 -46.77 -49.05 20.38 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.549 -0.296 . . . . 2.7000000000000002 111.343 -179.701 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.09 -55.27 25.2 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.199 -0.455 . . . . 0.46000000000000002 111.516 -179.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -50.7 -50.84 54.09 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.289 -0.414 . . . . 2.23 111.045 -179.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.502 HD13 HD11 ' A' ' 51' ' ' LEU . 0.2 OUTLIER -58.25 -40.66 82.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.295 -0.411 . . . . 1.3600000000000001 110.866 -179.844 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 85.0 mm-40 -67.42 -29.64 69.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.421 -0.354 . . . . 1.22 110.976 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -70.68 -49.37 47.94 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.22 -0.446 . . . . 0.62 111.529 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.502 HD11 HD13 ' A' ' 48' ' ' LEU . 0.9 OUTLIER -72.78 -28.32 62.52 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.49 -0.323 . . . . 0.39000000000000001 111.614 -179.375 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.493 HD11 HD12 ' A' ' 48' ' ' LEU . 28.2 mt -70.21 -46.03 73.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 120.771 0.319 . . . . 0.5 110.389 179.467 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.94 -25.53 62.78 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.079 -0.51 . . . . 0.58999999999999997 111.083 -179.884 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -77.98 -46.57 20.73 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.194 -0.457 . . . . 2.54 110.731 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -74.39 -27.13 60.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.188 -0.46 . . . . 0.53000000000000003 111.378 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -64.76 -34.38 78.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.796 0.331 . . . . 1.95 110.985 -179.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -111.53 59.64 0.62 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.229 -0.441 . . . . 2.48 111.079 -179.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -170.81 -55.17 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.051 -0.522 . . . . 2.48 110.684 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 1.5 p30 -110.96 27.16 9.95 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.867 -0.606 . . . . 2.0499999999999998 110.818 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . 0.544 ' N ' HD22 ' A' ' 60' ' ' ASN . 0.8 OUTLIER 62.66 -81.75 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.945 -0.57 . . . . 1.47 111.331 179.877 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -158.49 34.83 0.51 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.752 -0.737 . . . . 0.42999999999999999 112.546 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.504 HE22 ' C ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -140.47 150.22 43.52 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.031 0.443 . . . . 0.38 111.379 179.893 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.494 HD13 HD23 ' A' ' 32' ' ' LEU . 13.5 mt -121.99 155.48 35.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.804 -0.634 . . . . 1.4299999999999999 110.566 -179.905 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -113.4 157.03 22.42 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.482 -0.326 . . . . 1.1899999999999999 110.847 -179.657 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 59.7 t80 -43.16 -35.16 1.27 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.427 -0.351 . . . . 0.40000000000000002 111.228 179.571 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.35 -38.8 59.89 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.143 0.423 . . . . 0.81000000000000005 112.143 -179.579 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -63.99 -53.19 54.01 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.216 0.531 . . . . 1.3600000000000001 110.28 179.636 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.48 ' HD1' HD21 ' A' ' 32' ' ' LEU . 18.4 t80 -59.22 -52.41 65.82 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.495 -0.775 . . . . 0.51000000000000001 110.789 179.459 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 35.8 t -56.54 -49.0 76.09 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 116.28 -0.418 . . . . 0.75 110.51 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -43.67 -50.94 6.96 Favored Glycine 0 N--CA 1.45 -0.391 0 CA-C-N 115.503 -0.771 . . . . 0.40999999999999998 112.313 179.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.537 HG23 ' HE3' ' A' ' 74' ' ' LYS . 11.0 mt -67.1 -42.69 88.62 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.373 0 CA-C-O 120.823 0.344 . . . . 0.51000000000000001 111.064 179.752 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . 0.403 ' HG2' ' O ' ' A' ' 68' ' ' PHE . 87.8 mmm -53.26 -41.05 65.1 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.28 0.562 . . . . 1.01 110.003 179.344 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.8 -53.24 60.28 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.297 -0.865 . . . . 0.69999999999999996 111.087 179.481 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.537 ' HE3' HG23 ' A' ' 71' ' ' ILE . 18.8 pttp -67.94 -27.09 66.32 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 120.858 0.361 . . . . 1.3799999999999999 111.327 -179.81 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . 0.534 ' NE2' ' HB3' ' A' ' 43' ' ' PRO . 35.2 tt0 -80.35 -28.05 38.13 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.104 -0.498 . . . . 1.98 111.826 -179.352 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 38.6 mtt -75.46 -41.92 54.48 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 116.448 -0.342 . . . . 1.2 111.541 -179.483 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 34.0 ptt180 -67.28 -21.91 65.68 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.4 -0.364 . . . . 4.6900000000000004 111.73 -179.368 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -94.29 -34.96 12.64 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.664 0.268 . . . . 4.0099999999999998 111.267 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 55.1 m -66.42 129.21 39.08 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.379 -0.373 . . . . 5.2800000000000002 111.006 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -157.39 29.41 0.29 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.999 -0.546 . . . . 5.5999999999999996 110.152 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.471 ' O ' ' HG3' ' A' ' 85' ' ' MET . 2.7 t -38.26 117.21 0.6 Allowed 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.823 -0.626 . . . . 7.29 111.289 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -79.86 -28.73 39.98 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 112.776 0.658 . . . . 9.7400000000000002 112.776 -178.3 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -59.91 -49.14 78.84 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.907 -0.317 . . . . 12.109999999999999 111.461 -179.393 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -69.72 -21.94 63.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.982 0.42 . . . . 10.869999999999999 110.628 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . 0.604 ' SD ' HG13 ' A' ' 142' ' ' VAL . 23.9 mtt -72.75 -47.75 44.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.827 -0.624 . . . . 11.09 111.103 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.404 ' O ' ' HB3' ' A' ' 89' ' ' PHE . 64.7 ttt180 -62.17 -38.21 88.17 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.396 -0.365 . . . . 15.52 110.195 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -59.01 -45.11 91.49 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.165 -0.68 . . . . 14.85 109.165 178.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -69.15 -27.92 65.97 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.476 -0.784 . . . . 14.109999999999999 110.557 179.259 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.404 ' HB3' ' O ' ' A' ' 86' ' ' ARG . 62.0 t80 -63.4 -41.93 98.76 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.158 -0.474 . . . . 15.73 110.27 179.437 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 53.8 mttp -66.74 -41.82 87.2 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.765 -0.652 . . . . 17.66 110.435 179.481 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 78.3 mt -64.49 -39.61 86.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.102 -0.499 . . . . 18.149999999999999 111.076 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.535 ' HD1' HG11 ' A' ' 108' ' ' VAL . 1.7 m-85 -73.79 -33.75 64.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.345 -0.389 . . . . 18.34 111.103 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 51.1 t0 -81.27 114.87 20.36 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.364 -0.38 . . . . 19.289999999999999 110.507 179.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.525 ' HG2' ' HB3' ' A' ' 104' ' ' GLU . 22.0 mmm180 -65.47 -57.48 8.17 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.004 -0.544 . . . . 22.25 110.992 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.99 160.3 22.04 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.093 -0.503 . . . . 23.34 110.975 -179.693 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -84.18 5.49 79.88 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.857 -0.687 . . . . 22.0 112.175 179.641 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 16.8 p-10 -57.81 -33.36 68.5 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.747 0.308 . . . . 22.280000000000001 111.185 -179.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 96.04 26.97 10.63 Favored Glycine 0 C--N 1.331 0.274 0 C-N-CA 120.833 -0.699 . . . . 19.93 112.619 179.813 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 68.0 m-85 -142.57 142.69 32.21 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.599 0.238 . . . . 20.300000000000001 110.853 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.407 ' HB ' ' HB ' ' A' ' 136' ' ' ILE . 65.5 mt -114.38 127.27 71.92 Favored 'Isoleucine or valine' 0 C--O 1.231 0.126 0 CA-C-O 121.0 0.429 . . . . 19.370000000000001 111.17 179.882 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 75.6 m -114.44 156.5 44.44 Favored Pre-proline 0 C--N 1.332 -0.182 0 CA-C-N 115.879 -0.6 . . . . 22.489999999999998 110.783 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_exo -44.13 -35.86 8.16 Favored 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 122.41 2.073 . . . . 23.0 112.284 -179.813 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.436 ' O ' ' HG3' ' A' ' 106' ' ' ARG . . . -63.83 -48.11 78.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.169 -0.468 . . . . 24.559999999999999 110.734 179.709 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.525 ' HB3' ' HG2' ' A' ' 94' ' ' ARG . 45.4 mt-10 -72.9 -19.89 61.19 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.837 -0.619 . . . . 22.23 110.842 179.703 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.841 HD23 ' HB ' ' A' ' 121' ' ' ILE . 14.7 tp -80.16 -39.98 28.26 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.062 -0.517 . . . . 20.359999999999999 111.691 -179.22 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.489 ' HB3' HD13 ' A' ' 121' ' ' ILE . 7.4 ppt_? -73.76 -35.79 65.04 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.852 0.358 . . . . 27.190000000000001 110.517 -179.834 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 60.4 t80 -69.41 -44.7 70.85 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.963 -0.562 . . . . 25.359999999999999 111.306 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.535 HG11 ' HD1' ' A' ' 92' ' ' PHE . 7.3 p -63.75 -43.74 98.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.529 -0.305 . . . . 21.059999999999999 111.571 -179.536 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.464 ' N ' HG13 ' A' ' 108' ' ' VAL . 20.6 mmt -55.43 -45.63 76.75 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.519 -0.309 . . . . 20.93 111.29 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 81.2 mt -59.35 -25.05 29.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.963 0.411 . . . . 25.129999999999999 110.619 179.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 80.1 m-20 -77.67 -39.41 44.96 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.963 -0.562 . . . . 23.32 110.533 179.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.431 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 10.5 mt -69.68 -28.68 66.07 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.93 -0.577 . . . . 21.07 110.668 179.859 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 113.18 17.08 7.94 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.921 -0.657 . . . . 23.050000000000001 112.523 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -113.88 108.8 17.55 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.804 0.335 . . . . 22.59 111.087 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -77.04 113.83 15.18 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.163 -0.471 . . . . 27.960000000000001 110.989 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . 0.488 ' HB ' HG23 ' A' ' 121' ' ' ILE . 1.2 m -127.39 155.01 38.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.026 0.441 . . . . 24.75 111.6 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . 0.44 ' O ' HG12 ' A' ' 121' ' ' ILE . 72.2 p -99.34 144.26 28.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.793 -0.639 . . . . 27.239999999999998 110.227 179.275 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -51.77 -20.94 2.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.274 -0.421 . . . . 26.629999999999999 111.551 -179.506 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 12.9 mm-40 -77.43 -55.33 5.48 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.502 -0.317 . . . . 29.140000000000001 111.694 -179.618 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -61.63 -40.92 96.59 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 111.825 0.306 . . . . 24.190000000000001 111.825 -179.204 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.841 ' HB ' HD23 ' A' ' 105' ' ' LEU . 4.9 pt -68.59 -42.67 83.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 C-N-CA 121.062 -0.255 . . . . 22.329999999999998 111.584 -179.442 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.523 ' N ' HG13 ' A' ' 121' ' ' ILE . 24.0 t70 -59.76 -33.16 71.32 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.825 0.345 . . . . 24.289999999999999 110.649 179.842 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 -66.06 -49.19 68.5 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.034 -0.53 . . . . 24.739999999999998 110.434 179.562 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.409 ' CE ' HD21 ' A' ' 105' ' ' LEU . 3.1 tmm? -56.96 -37.94 72.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.032 -0.531 . . . . 19.710000000000001 111.054 179.547 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.602 HD11 HD22 ' A' ' 105' ' ' LEU . 66.4 mt -65.55 -43.52 94.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.291 -0.413 . . . . 19.949999999999999 110.516 179.793 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 23.9 ttm180 -57.43 -35.43 70.08 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.892 -0.595 . . . . 24.949999999999999 110.984 179.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -69.47 -43.5 73.11 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.166 -0.47 . . . . 18.690000000000001 110.969 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.611 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -80.4 -12.22 59.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.217 -0.447 . . . . 16.469999999999999 111.283 -179.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -101.31 106.14 17.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.161 -0.472 . . . . 20.399999999999999 110.942 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 82.1 m-85 -98.16 -33.64 11.05 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.911 -0.586 . . . . 21.43 111.032 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -65.1 -16.41 63.44 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.213 -0.449 . . . . 23.370000000000001 110.772 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 61.16 82.75 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.871 -0.68 . . . . 24.32 112.55 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -151.68 -6.68 0.24 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.65 0.262 . . . . 23.879999999999999 111.393 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 74.66 20.47 79.51 Favored Glycine 0 C--N 1.331 0.253 0 C-N-CA 120.785 -0.721 . . . . 22.670000000000002 112.815 179.647 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 47.9 mtp -136.01 155.64 49.93 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.623 0.249 . . . . 22.91 110.385 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.706 HG23 ' HB2' ' A' ' 140' ' ' GLU . 48.6 mm -114.84 140.17 37.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 121.309 0.576 . . . . 18.41 112.092 -179.416 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . 0.449 ' O ' ' N ' ' A' ' 139' ' ' GLU . 1.9 m-20 -115.07 157.84 22.96 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.919 -1.037 . . . . 16.82 108.996 178.594 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 31.2 t80 -40.0 -23.84 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 120.762 0.315 . . . . 14.65 111.605 179.795 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.449 ' N ' ' O ' ' A' ' 137' ' ' ASN . 19.4 mm-40 -80.53 -55.77 4.63 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-O 120.958 0.408 . . . . 14.82 110.871 -179.586 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.706 ' HB2' HG23 ' A' ' 136' ' ' ILE . 25.8 mt-10 -61.27 -33.42 73.52 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.958 -0.565 . . . . 17.460000000000001 110.693 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.594 ' CZ ' HG21 ' A' ' 145' ' ' ILE . 76.9 t80 -66.91 -56.06 11.93 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.914 -0.585 . . . . 12.93 110.194 179.796 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.604 HG13 ' SD ' ' A' ' 85' ' ' MET . 2.5 t -45.75 -44.86 4.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.554 -0.748 . . . . 10.699999999999999 112.138 179.83 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 79.8 t90 -65.13 -55.58 17.89 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.439 0.533 . . . . 13.66 112.439 -178.69 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . 0.611 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 17.3 ptt? -60.28 -36.71 78.48 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 112.099 0.407 . . . . 14.5 112.099 -178.185 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . 0.594 HG21 ' CZ ' ' A' ' 141' ' ' PHE . 2.8 pt -80.73 -15.39 12.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 C-N-CA 120.803 -0.359 . . . . 11.25 111.327 179.817 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 45.0 t -69.42 -38.9 78.09 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.385 -0.598 . . . . 8.5399999999999991 109.385 179.589 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 10.0 mm-40 -87.03 -21.07 26.33 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.313 -0.858 . . . . 11.869999999999999 109.945 178.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 24.5 ttpp . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.258 -0.877 . . . . 13.68 111.11 179.7 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 149' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 151' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 55.8 m . . . . . 0 N--CA 1.485 1.286 0 CA-C-O 120.793 0.33 . . . . 4.8899999999999997 110.997 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -168.69 69.79 0.08 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.179 -0.464 . . . . 3.2599999999999998 110.92 -179.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.497 HD13 ' SG ' ' A' ' 69' ' ' CYS . 78.7 mt 47.05 81.17 0.04 OUTLIER 'General case' 0 C--O 1.232 0.178 0 CA-C-N 115.981 -0.554 . . . . 1.27 111.165 -179.865 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 50.5 p -73.19 -176.37 2.15 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.434 -0.348 . . . . 1.1200000000000001 111.525 -179.799 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -64.7 -38.08 89.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.475 -0.329 . . . . 2.2000000000000002 111.518 -179.586 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -75.06 -44.26 48.67 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.963 0.411 . . . . 1.3500000000000001 111.009 -179.549 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 27.6 mt-30 -61.92 -46.2 90.4 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.892 -0.595 . . . . 2.2200000000000002 110.885 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.542 ' HA ' ' CZ ' ' A' ' 12' ' ' PHE . 62.9 mt -58.56 -52.64 57.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.135 -0.484 . . . . 0.54000000000000004 111.006 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.85 -20.8 65.44 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.417 -0.356 . . . . 0.5 111.584 -179.722 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -70.82 -56.82 5.47 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 111.78 0.289 . . . . 2.27 111.78 -179.273 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.542 ' CZ ' ' HA ' ' A' ' 9' ' ' ILE . 19.3 p90 -79.57 -26.9 41.22 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 120.591 -0.444 . . . . 0.37 110.922 -179.692 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.428 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 45.8 tptt -65.51 -34.2 77.72 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 109.387 -0.598 . . . . 1.23 109.387 178.889 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.548 ' O ' HG22 ' A' ' 17' ' ' VAL . 14.4 t70 -69.98 -50.09 45.13 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 108.998 -0.742 . . . . 0.44 108.998 178.187 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.89 -14.8 50.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.663 -0.699 . . . . 0.28999999999999998 110.277 178.771 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.428 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 44.9 t80 -80.32 -45.47 17.78 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.636 -0.711 . . . . 0.47999999999999998 110.733 -179.616 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.548 HG22 ' O ' ' A' ' 14' ' ' ASP . 24.6 m -69.62 -20.46 23.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 121.003 0.43 . . . . 1.1100000000000001 110.288 179.749 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.469 ' HG3' ' O ' ' A' ' 14' ' ' ASP . 78.3 mt-30 -60.38 -29.43 68.94 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.784 -0.643 . . . . 1.6000000000000001 111.175 179.471 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 56.8 m-85 -104.34 13.64 31.69 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.558 -0.292 . . . . 0.64000000000000001 111.7 -179.409 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -114.12 81.96 1.62 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.981 0.419 . . . . 0.44 110.921 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 43.8 mmtm -85.42 -34.59 21.67 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.969 -0.56 . . . . 2.1000000000000001 111.291 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -62.26 -28.53 69.77 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.127 -0.488 . . . . 1.8 111.296 -179.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 89.69 7.25 69.1 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.697 -0.763 . . . . 0.46000000000000002 112.72 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 21.9 p -76.76 7.87 4.25 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.583 0.23 . . . . 0.40000000000000002 111.231 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 55.88 27.23 49.9 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.609 -0.805 . . . . 0.33000000000000002 111.745 -179.436 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.676 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 37.8 mtpt -136.68 155.56 49.71 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.858 0.361 . . . . 1.1000000000000001 111.095 -179.402 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.431 ' N ' HE22 ' A' ' 62' ' ' GLN . 46.5 pt -125.51 143.51 38.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.11 -0.496 . . . . 0.5 111.252 -179.735 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -56.92 124.98 20.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.365 -0.38 . . . . 0.29999999999999999 111.04 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.1 t -62.03 -13.36 25.31 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.116 -0.493 . . . . 1.03 111.268 -179.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 68.1 mtp180 -79.75 -29.07 40.41 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.125 -0.488 . . . . 3.0800000000000001 110.565 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -93.54 3.89 54.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.959 -0.564 . . . . 2.2599999999999998 110.341 179.678 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.442 HD23 HD22 ' A' ' 63' ' ' LEU . 0.8 OUTLIER -56.91 -55.29 36.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.794 -0.639 . . . . 1.3700000000000001 110.636 -179.932 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.478 ' HA3' HD21 ' A' ' 48' ' ' LEU . . . -53.91 -42.63 70.39 Favored Glycine 0 C--N 1.331 0.282 0 C-N-CA 120.556 -0.831 . . . . 0.32000000000000001 111.892 179.551 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 57.8 m -62.69 -36.35 82.64 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.094 0.473 . . . . 0.31 110.573 179.278 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 62.9 tp -65.28 -31.65 72.91 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.799 -0.637 . . . . 1.24 110.822 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.437 ' HG3' ' O ' ' A' ' 32' ' ' LEU . 19.3 mtp -80.48 -28.59 37.51 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.129 -0.487 . . . . 1.1000000000000001 110.851 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 24.9 mtp180 -65.23 -44.12 89.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.49 -0.323 . . . . 2.6899999999999999 110.731 179.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.452 HG23 ' CD1' ' A' ' 39' ' ' LEU . 1.3 t -65.59 -13.67 59.53 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.956 0.408 . . . . 1.0600000000000001 110.991 179.579 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.452 ' CD1' HG23 ' A' ' 38' ' ' THR . 8.8 mp -113.86 156.87 23.16 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.996 -0.547 . . . . 1.26 110.65 179.584 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -46.51 -27.95 3.22 Favored Glycine 0 CA--C 1.52 0.372 0 C-N-CA 120.886 -0.673 . . . . 0.68999999999999995 113.161 -179.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -60.66 154.64 20.87 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.712 0.292 . . . . 1.97 111.157 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 48.5 t-20 -172.13 82.61 0.46 Allowed Pre-proline 0 C--N 1.33 -0.242 0 CA-C-N 116.222 -0.444 . . . . 2.6600000000000001 110.747 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.401 ' HB3' ' NE2' ' A' ' 75' ' ' GLN . 56.1 Cg_endo -70.27 159.26 53.63 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.512 2.141 . . . . 0.51000000000000001 112.367 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 37.7 m -65.17 146.83 54.46 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.107 -0.497 . . . . 0.72999999999999998 110.584 179.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.499 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 16.8 mm-40 -48.38 -55.68 10.14 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.843 -0.162 . . . . 2.7000000000000002 111.377 -179.47 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -49.15 -42.66 40.32 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.784 0.326 . . . . 0.46000000000000002 111.248 -179.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.522 ' HG3' HD23 ' A' ' 51' ' ' LEU . 7.9 tp10 -64.52 -50.76 66.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.16 -0.473 . . . . 2.23 110.288 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.478 HD21 ' HA3' ' A' ' 33' ' ' GLY . 33.0 tp -57.32 -33.83 68.11 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.957 -0.565 . . . . 1.3600000000000001 110.9 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.499 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 77.4 mm-40 -73.55 -34.67 65.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.314 -0.403 . . . . 1.22 110.511 179.71 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 56.4 m-20 -72.26 -55.27 7.46 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.099 -0.501 . . . . 0.62 111.649 -179.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.522 HD23 ' HG3' ' A' ' 47' ' ' GLU . 1.9 pp -61.2 -34.64 75.41 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 111.823 0.305 . . . . 0.39000000000000001 111.823 -179.207 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 49.4 mt -72.01 -53.62 19.45 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 120.692 0.282 . . . . 0.5 110.857 179.61 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.85 -26.23 65.66 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.341 -0.39 . . . . 0.58999999999999997 111.036 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -77.33 -51.86 10.14 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.191 -0.459 . . . . 2.54 110.697 179.885 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -69.53 -16.6 63.46 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.197 -0.456 . . . . 0.53000000000000003 111.294 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -80.08 -36.66 35.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.361 -0.382 . . . . 1.95 110.964 -179.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 18.9 m120 -98.5 36.57 1.61 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.201 -0.454 . . . . 2.48 110.991 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -159.54 -27.39 0.07 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.172 -0.467 . . . . 2.48 110.937 179.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 10.4 m120 -120.19 20.44 12.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.273 -0.421 . . . . 2.0499999999999998 110.825 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 24.5 m-80 64.13 -81.34 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 115.901 -0.591 . . . . 1.47 111.453 179.694 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -154.84 5.21 0.26 Allowed Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.547 -0.835 . . . . 0.42999999999999999 113.001 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.676 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -117.23 153.91 32.08 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.984 0.421 . . . . 0.38 111.619 -179.945 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.525 ' HG ' ' HB2' ' A' ' 67' ' ' GLU . 1.7 tp -128.62 153.62 47.07 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.699 -0.682 . . . . 1.4299999999999999 110.201 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 10.9 m-80 -110.61 157.0 20.16 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-O 121.343 0.592 . . . . 1.1899999999999999 111.472 -179.363 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.443 ' O ' ' HB2' ' A' ' 69' ' ' CYS . 88.1 t80 -46.39 -38.91 9.58 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.91 -1.041 . . . . 0.40000000000000002 111.736 -179.439 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -67.49 -37.54 83.01 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.606 0.595 . . . . 0.81000000000000005 112.606 -179.087 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.525 ' HB2' ' HG ' ' A' ' 63' ' ' LEU . 7.7 mt-10 -63.92 -52.91 57.65 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.126 0.489 . . . . 1.3600000000000001 109.842 179.611 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.447 ' O ' ' HG3' ' A' ' 72' ' ' MET . 28.2 t80 -59.53 -54.39 47.14 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.551 -0.75 . . . . 0.51000000000000001 110.608 179.175 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.497 ' SG ' HD13 ' A' ' 4' ' ' LEU . 0.5 OUTLIER -53.78 -46.63 71.08 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.2 -0.455 . . . . 0.75 110.729 -179.986 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -48.28 -54.27 13.19 Favored Glycine 0 C--N 1.331 0.291 0 CA-C-N 115.857 -0.61 . . . . 0.40999999999999998 112.564 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.466 HG23 ' CE ' ' A' ' 74' ' ' LYS . 11.5 mt -61.79 -43.09 96.77 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.297 0 CA-C-O 120.861 0.363 . . . . 0.51000000000000001 110.751 179.755 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . 0.447 ' HG3' ' O ' ' A' ' 68' ' ' PHE . 61.8 mtp -54.9 -28.93 54.39 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.965 -0.561 . . . . 1.01 110.05 179.582 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.89 -50.3 36.49 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.964 -0.562 . . . . 0.69999999999999996 110.754 179.63 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.466 ' CE ' HG23 ' A' ' 71' ' ' ILE . 63.8 pttt -68.84 -28.49 66.77 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.357 -0.383 . . . . 1.3799999999999999 111.655 -179.616 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . 0.401 ' NE2' ' HB3' ' A' ' 43' ' ' PRO . 7.5 tt0 -81.0 -55.05 5.04 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.123 0.416 . . . . 1.98 112.123 -179.319 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 71.3 mtp -59.49 -37.01 77.16 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 112.282 0.475 . . . . 1.2 112.282 -178.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.478 ' NE ' ' HA ' ' A' ' 77' ' ' ARG . 16.0 mmp_? -71.34 -41.05 70.28 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.523 0.201 . . . . 4.6900000000000004 111.263 -179.627 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 62.76 -84.89 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.231 -0.441 . . . . 4.0099999999999998 111.136 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 46.0 m -103.45 101.33 11.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.378 -0.374 . . . . 5.2800000000000002 110.735 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . 0.419 ' O ' ' N ' ' A' ' 82' ' ' GLU . 0.1 OUTLIER -106.61 -34.13 7.44 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.381 -0.372 . . . . 5.5999999999999996 111.612 -179.533 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.602 ' O ' ' HG3' ' A' ' 85' ' ' MET . 65.7 m -47.23 90.15 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.035 -0.53 . . . . 7.29 111.707 -179.36 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.43 ' HB3' ' OH ' ' A' ' 138' ' ' TYR . 44.9 mt-10 -55.55 -16.34 3.83 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 112.873 0.694 . . . . 9.7400000000000002 112.873 -178.772 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -61.38 -55.99 25.38 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.863 0.364 . . . . 12.109999999999999 111.693 -179.329 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -71.59 -21.76 61.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.338 -0.392 . . . . 10.869999999999999 111.148 -179.522 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . 0.646 ' HB3' HD11 ' A' ' 145' ' ' ILE . 10.8 mtp -74.38 -39.58 62.62 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.353 -0.385 . . . . 11.09 110.908 -179.473 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 61.4 ttt180 -69.76 -41.41 75.24 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.064 -0.517 . . . . 15.52 110.327 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -59.35 -40.93 87.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.219 0.533 . . . . 14.85 109.596 178.857 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -69.62 -29.51 67.02 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.652 -0.704 . . . . 14.109999999999999 110.425 179.277 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 64.0 t80 -66.91 -41.18 87.51 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.053 -0.521 . . . . 15.73 110.483 179.466 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 49.0 mttm -64.07 -42.93 96.82 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.882 -0.599 . . . . 17.66 110.789 179.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 84.0 mt -64.8 -46.95 90.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.892 -0.595 . . . . 18.149999999999999 111.066 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.493 ' CD1' HG11 ' A' ' 108' ' ' VAL . 2.2 m-85 -60.02 -48.03 83.41 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.256 -0.429 . . . . 18.34 110.867 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 42.9 t0 -64.68 109.49 2.04 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.074 -0.512 . . . . 19.289999999999999 110.608 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.477 ' HG2' ' HB3' ' A' ' 104' ' ' GLU . 19.1 mmm180 -64.84 -42.2 95.1 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.114 -0.494 . . . . 22.25 111.141 -179.441 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -94.39 178.46 5.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.277 -0.42 . . . . 23.34 110.969 -179.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.14 5.24 57.57 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.962 -0.637 . . . . 22.0 112.033 179.562 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 18.5 p-10 -63.54 -31.66 72.89 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.783 0.325 . . . . 22.280000000000001 111.079 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 93.41 27.28 13.5 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.784 -0.722 . . . . 19.93 112.606 179.704 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 67.9 m-85 -138.88 143.52 38.78 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.594 0.235 . . . . 20.300000000000001 110.879 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.498 ' HB ' ' HB ' ' A' ' 136' ' ' ILE . 56.1 mt -114.33 128.74 71.22 Favored 'Isoleucine or valine' 0 C--O 1.232 0.144 0 CA-C-O 120.94 0.4 . . . . 19.370000000000001 111.061 179.638 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 49.5 m -114.84 156.65 44.74 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 115.818 -0.628 . . . . 22.489999999999998 110.506 -179.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_exo -44.29 -35.11 7.84 Favored 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 122.174 1.916 . . . . 23.0 112.012 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.479 ' O ' ' HG3' ' A' ' 106' ' ' ARG . . . -65.35 -49.59 68.78 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.099 -0.501 . . . . 24.559999999999999 110.509 179.377 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.477 ' HB3' ' HG2' ' A' ' 94' ' ' ARG . 45.5 mt-10 -69.71 -20.37 63.54 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.862 -0.608 . . . . 22.23 110.641 179.506 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.635 HD23 ' HB ' ' A' ' 121' ' ' ILE . 42.1 tp -80.29 -39.55 28.59 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.061 -0.518 . . . . 20.359999999999999 111.51 -179.346 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.479 ' HG3' ' O ' ' A' ' 103' ' ' ALA . 3.3 ppt_? -72.03 -32.16 66.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.186 0.517 . . . . 27.190000000000001 110.39 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 81.0 t80 -73.49 -43.33 60.38 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.581 -0.736 . . . . 25.359999999999999 111.482 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.52 HG13 ' N ' ' A' ' 109' ' ' MET . 7.5 p -66.86 -48.17 80.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 N-CA-C 111.879 0.325 . . . . 21.059999999999999 111.879 -179.184 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.52 ' N ' HG13 ' A' ' 108' ' ' VAL . 22.7 mmt -50.84 -41.89 58.1 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 111.625 0.232 . . . . 20.93 111.625 -179.174 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 79.7 mt -61.78 -30.44 48.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 120.951 0.405 . . . . 25.129999999999999 110.528 179.401 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -70.77 -35.85 72.79 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.007 -0.542 . . . . 23.32 110.427 179.619 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 9.0 mp -72.84 -42.14 64.08 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.946 -0.57 . . . . 21.07 110.634 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 115.53 41.11 0.82 Allowed Glycine 0 N--CA 1.452 -0.272 0 CA-C-N 115.875 -0.602 . . . . 23.050000000000001 112.392 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -110.03 -31.75 7.26 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 111.577 0.214 . . . . 22.59 111.577 -179.558 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 36.6 mtmm 52.7 90.0 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.966 0.413 . . . . 27.960000000000001 110.606 -179.596 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 2.4 m -123.38 155.78 29.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.906 -0.588 . . . . 24.75 112.12 -178.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . 0.408 ' O ' HG12 ' A' ' 121' ' ' ILE . 70.5 p -92.23 145.06 24.79 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.57 -0.741 . . . . 27.239999999999998 110.216 179.187 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . 0.479 ' HA ' HD11 ' A' ' 121' ' ' ILE . 8.8 m-20 -51.62 -18.38 1.14 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.041 -0.527 . . . . 26.629999999999999 111.98 -179.361 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -77.51 -55.62 5.22 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.078 0.399 . . . . 29.140000000000001 112.078 -179.008 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -61.87 -40.57 95.83 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 111.967 0.358 . . . . 24.190000000000001 111.967 -179.044 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.635 ' HB ' HD23 ' A' ' 105' ' ' LEU . 5.1 pt -69.63 -40.15 79.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 C-N-CA 120.897 -0.321 . . . . 22.329999999999998 111.522 -179.568 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.429 ' N ' HG13 ' A' ' 121' ' ' ILE . 15.4 t70 -56.49 -41.52 76.78 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.858 0.361 . . . . 24.289999999999999 110.42 179.552 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -62.83 -45.37 92.91 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.059 -0.519 . . . . 24.739999999999998 110.475 179.52 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 59.9 ttp -56.98 -38.2 72.69 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.034 -0.53 . . . . 19.710000000000001 110.868 179.49 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.615 HG23 HD11 ' A' ' 136' ' ' ILE . 58.6 mt -64.43 -38.39 82.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.147 -0.479 . . . . 19.949999999999999 110.525 179.691 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.407 ' HD2' HH11 ' A' ' 126' ' ' ARG . 6.7 ttp85 -62.21 -42.7 99.53 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.957 -0.565 . . . . 24.949999999999999 110.632 179.74 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -65.6 -26.46 67.85 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.876 -0.602 . . . . 18.690000000000001 110.962 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.623 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -95.65 -13.07 24.6 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.104 -0.498 . . . . 16.469999999999999 111.21 179.912 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -100.16 105.79 17.43 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.094 -0.503 . . . . 20.399999999999999 110.837 -179.77 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 91.2 m-85 -97.4 -30.91 12.65 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.878 -0.601 . . . . 21.43 111.387 -179.498 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -69.72 -15.04 63.08 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.301 -0.409 . . . . 23.370000000000001 110.715 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 60.5 87.4 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.977 -0.63 . . . . 24.32 113.059 179.581 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -155.7 -23.84 0.11 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.755 0.312 . . . . 23.879999999999999 111.099 179.511 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 93.87 23.51 22.85 Favored Glycine 0 C--N 1.331 0.293 0 C-N-CA 120.817 -0.706 . . . . 22.670000000000002 112.617 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 82.1 mmm -135.8 155.22 50.68 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 110.423 -0.214 . . . . 22.91 110.423 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.652 HG23 ' HB2' ' A' ' 140' ' ' GLU . 46.9 mm -114.57 139.53 40.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 121.306 0.574 . . . . 18.41 111.599 179.759 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . 0.451 ' O ' ' N ' ' A' ' 139' ' ' GLU . 16.2 m-20 -115.09 157.4 23.61 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.095 -0.957 . . . . 16.82 108.887 178.662 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.43 ' OH ' ' HB3' ' A' ' 82' ' ' GLU . 19.5 t80 -41.13 -22.86 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 120.893 0.378 . . . . 14.65 111.024 179.483 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.451 ' N ' ' O ' ' A' ' 137' ' ' ASN . 9.6 mm-40 -81.16 -55.25 4.87 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.24 -0.436 . . . . 14.82 111.019 -179.662 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.652 ' HB2' HG23 ' A' ' 136' ' ' ILE . 31.9 mt-10 -60.11 -34.1 73.04 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.195 -0.457 . . . . 17.460000000000001 110.74 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.482 ' CZ ' HG21 ' A' ' 145' ' ' ILE . 82.2 t80 -68.29 -55.28 12.68 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.034 -0.53 . . . . 12.93 110.326 179.503 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 2.3 t -47.04 -39.67 4.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.485 -0.78 . . . . 10.699999999999999 111.684 179.427 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' TRP . . . . . 0.466 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 84.8 t90 -71.06 -55.43 8.26 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.182 0.438 . . . . 13.66 112.182 -178.856 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . 0.623 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 17.3 ptt? -61.3 -23.79 65.95 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 113.156 0.799 . . . . 14.5 113.156 -177.801 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . 0.646 HD11 ' HB3' ' A' ' 85' ' ' MET . 48.5 pt -80.7 -46.15 21.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 N-CA-C 112.488 0.551 . . . . 11.25 112.488 -179.287 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . 0.573 ' N ' HG13 ' A' ' 145' ' ' ILE . 12.6 p -63.29 -13.94 44.09 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-O 121.201 0.524 . . . . 8.5399999999999991 110.469 -179.839 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 147' ' ' GLN . . . . . 0.466 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 17.0 mm-40 -117.57 13.77 14.39 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.35 -0.841 . . . . 11.869999999999999 111.326 -178.563 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . 0.544 ' HG3' ' O ' ' A' ' 144' ' ' MET . 35.5 mttm . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.19 -0.91 . . . . 13.68 110.84 179.548 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 149' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 151' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 40.2 t . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 120.846 0.355 . . . . 4.8899999999999997 110.833 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -146.46 133.86 20.75 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.137 -0.483 . . . . 3.2599999999999998 110.622 179.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.461 HD13 ' SG ' ' A' ' 69' ' ' CYS . 49.3 mt -67.12 89.84 0.19 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.955 0.407 . . . . 1.27 110.71 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.428 HG22 ' H ' ' A' ' 6' ' ' GLU . 0.2 OUTLIER -73.41 169.32 17.41 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.875 -0.602 . . . . 1.1200000000000001 111.073 -179.833 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.428 ' H ' HG22 ' A' ' 5' ' ' THR . 32.9 tt0 -52.05 -46.64 65.18 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.407 -0.36 . . . . 2.2000000000000002 111.501 179.668 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -70.82 -46.13 63.33 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.216 -0.447 . . . . 1.3500000000000001 111.08 -179.27 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -58.16 -42.99 87.14 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.975 -0.557 . . . . 2.2200000000000002 110.872 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.506 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 72.5 mt -59.47 -51.04 77.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.302 -0.408 . . . . 0.54000000000000004 110.376 179.596 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.08 -22.54 66.97 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.024 -0.535 . . . . 0.5 111.315 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -70.05 -56.87 5.81 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 116.34 -0.391 . . . . 2.27 111.835 -179.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.518 ' HB2' ' HE2' ' A' ' 68' ' ' PHE . 13.3 p90 -78.91 -24.85 43.85 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.733 -0.387 . . . . 0.37 110.692 -179.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.41 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 24.0 tptp -64.01 -35.58 81.17 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 108.923 -0.769 . . . . 1.23 108.923 178.382 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.443 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 20.4 t70 -70.14 -49.78 47.18 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 115.621 -0.718 . . . . 0.44 109.302 178.37 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.43 -14.62 42.81 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.769 -0.65 . . . . 0.28999999999999998 110.506 178.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.41 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 36.3 t80 -79.93 -50.58 10.24 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.742 -0.663 . . . . 0.47999999999999998 110.686 -179.708 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 31.2 m -65.93 -19.31 25.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 121.01 0.433 . . . . 1.1100000000000001 110.336 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.443 ' HG2' ' O ' ' A' ' 14' ' ' ASP . 75.3 mm-40 -58.64 -37.18 75.39 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.656 -0.702 . . . . 1.6000000000000001 111.331 179.294 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 62.0 m-85 -91.26 9.87 29.57 Favored 'General case' 0 N--CA 1.464 0.248 0 N-CA-C 111.767 0.284 . . . . 0.64000000000000001 111.767 -179.684 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -106.85 83.94 1.92 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.886 0.374 . . . . 0.44 110.808 179.602 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 29.9 mmmt -92.77 -10.61 36.34 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.061 -0.518 . . . . 2.1000000000000001 111.242 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -84.95 -14.32 47.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.147 -0.479 . . . . 1.8 111.281 -179.488 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.14 6.73 88.79 Favored Glycine 0 N--CA 1.453 -0.21 0 C-N-CA 120.688 -0.768 . . . . 0.46000000000000002 112.605 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 40.2 p -82.4 8.09 12.39 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.688 0.28 . . . . 0.40000000000000002 111.071 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 56.94 18.01 24.49 Favored Glycine 0 C--N 1.332 0.34 0 C-N-CA 120.824 -0.703 . . . . 0.33000000000000002 112.165 -179.683 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.475 ' C ' HE22 ' A' ' 62' ' ' GLN . 32.6 mtpt -129.31 155.69 45.21 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.773 0.32 . . . . 1.1000000000000001 111.161 -179.406 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.46 ' N ' HE22 ' A' ' 62' ' ' GLN . 39.8 pt -118.19 133.02 66.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 120.895 0.379 . . . . 0.5 111.455 -179.791 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -52.52 138.77 27.03 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.079 -0.509 . . . . 0.29999999999999999 111.247 -179.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.555 ' HA ' HD11 ' A' ' 63' ' ' LEU . 8.9 t -71.27 -2.51 16.41 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.194 -0.457 . . . . 1.03 111.323 -179.771 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.436 ' HD2' ' N ' ' A' ' 30' ' ' ARG . 0.9 OUTLIER -98.48 2.49 47.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.029 0.443 . . . . 3.0800000000000001 110.25 179.592 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -124.43 -5.41 7.7 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.782 -0.645 . . . . 2.2599999999999998 110.886 -179.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.468 ' O ' ' HG2' ' A' ' 36' ' ' MET . 2.1 tm? -55.57 -51.28 67.64 Favored 'General case' 0 C--O 1.233 0.198 0 N-CA-C 109.954 -0.387 . . . . 1.3700000000000001 109.954 179.694 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.42 ' HA2' HD11 ' A' ' 48' ' ' LEU . . . -53.71 -37.31 56.72 Favored Glycine 0 C--N 1.333 0.366 0 C-N-CA 120.629 -0.796 . . . . 0.32000000000000001 111.4 179.122 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 59.7 m -67.49 -31.48 71.65 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.279 0.561 . . . . 0.31 110.112 178.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 56.3 tp -72.83 -19.72 61.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.544 -0.753 . . . . 1.24 110.369 179.554 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.468 ' HG2' ' O ' ' A' ' 32' ' ' LEU . 75.8 mmm -80.02 -47.11 15.43 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.062 -0.517 . . . . 1.1000000000000001 110.786 179.593 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 13.4 ptm180 -61.85 -39.87 93.38 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.365 -0.38 . . . . 2.6899999999999999 111.399 -179.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.491 HG23 HD12 ' A' ' 39' ' ' LEU . 5.3 t -62.84 -14.42 45.64 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 121.179 0.514 . . . . 1.0600000000000001 110.413 179.491 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.491 HD12 HG23 ' A' ' 38' ' ' THR . 6.8 mp -114.46 157.21 23.23 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.464 -0.789 . . . . 1.26 109.31 178.385 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -74.02 34.54 0.91 Allowed Glycine 0 CA--C 1.521 0.43 0 C-N-CA 120.612 -0.804 . . . . 0.68999999999999995 113.298 -179.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.471 ' OE1' ' HB3' ' A' ' 39' ' ' LEU . 3.5 mm100 -91.65 -68.12 0.81 Allowed 'General case' 0 C--O 1.232 0.14 0 CA-C-O 120.829 0.347 . . . . 1.97 110.547 179.517 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 31.0 m-80 54.42 78.32 0.39 Allowed Pre-proline 0 CA--C 1.53 0.183 0 CA-C-N 115.961 -0.563 . . . . 2.6600000000000001 111.16 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.429 ' HD3' ' HB3' ' A' ' 36' ' ' MET . 74.4 Cg_endo -75.04 175.51 11.15 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.456 2.104 . . . . 0.51000000000000001 112.319 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 34.4 m -74.16 149.01 41.19 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.173 -0.467 . . . . 0.72999999999999998 110.734 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.479 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 38.1 mt-10 -53.6 -55.84 22.31 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.546 -0.297 . . . . 2.7000000000000002 111.484 -179.664 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.85 -47.08 71.32 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.339 -0.391 . . . . 0.46000000000000002 111.698 -179.405 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -57.9 -49.95 74.99 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.926 0.393 . . . . 2.23 110.582 -179.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.42 HD11 ' HA2' ' A' ' 33' ' ' GLY . 21.4 tp -57.48 -37.13 72.42 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.832 -0.622 . . . . 1.3600000000000001 111.068 -179.772 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.479 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 78.4 mm-40 -75.2 -28.01 59.82 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.42 -0.355 . . . . 1.22 111.264 -179.818 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 45.7 m-20 -75.35 -46.05 35.6 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.402 -0.363 . . . . 0.62 111.681 -179.588 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.414 HD21 ' HA ' ' A' ' 48' ' ' LEU . 1.9 pp -71.92 -40.12 69.01 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.552 -0.295 . . . . 0.39000000000000001 111.66 -179.314 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 71.8 mt -64.97 -45.02 95.94 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-O 120.746 0.308 . . . . 0.5 110.736 179.795 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -69.08 -35.12 76.15 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.308 -0.405 . . . . 0.58999999999999997 110.667 179.767 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -64.93 -46.63 80.83 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.18 -0.464 . . . . 2.54 109.87 179.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -70.92 -21.5 62.35 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.844 -0.616 . . . . 0.53000000000000003 110.909 179.295 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -65.65 -54.39 28.17 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.344 -0.389 . . . . 1.95 110.865 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 87.1 m-20 -93.81 52.76 1.71 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.279 -0.419 . . . . 2.48 110.932 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.431 HD22 ' C ' ' A' ' 58' ' ' ASN . 0.2 OUTLIER -162.33 -63.24 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.188 -0.46 . . . . 2.48 110.628 179.987 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 29.4 m-80 -93.0 27.1 2.54 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.204 -0.453 . . . . 2.0499999999999998 110.869 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 10.9 m120 65.21 -78.98 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 115.998 -0.546 . . . . 1.47 111.172 179.876 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -163.79 22.06 0.16 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.901 -0.666 . . . . 0.42999999999999999 112.297 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.475 HE22 ' C ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -131.92 153.1 50.61 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.976 0.417 . . . . 0.38 111.38 -179.782 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.555 HD11 ' HA ' ' A' ' 29' ' ' THR . 33.6 mt -120.63 151.9 38.86 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.768 -0.651 . . . . 1.4299999999999999 110.276 179.818 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 19.9 m-80 -113.18 157.69 21.37 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.765 0.317 . . . . 1.1899999999999999 110.879 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -42.61 -39.75 2.46 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.751 -0.659 . . . . 0.40000000000000002 111.415 -179.499 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -68.98 -35.63 76.94 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.105 0.409 . . . . 0.81000000000000005 112.105 -179.575 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -61.1 -52.87 63.08 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.01 0.433 . . . . 1.3600000000000001 110.457 179.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.518 ' HE2' ' HB2' ' A' ' 12' ' ' PHE . 36.6 t80 -65.63 -46.24 80.01 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.698 -0.683 . . . . 0.51000000000000001 111.02 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.461 ' SG ' HD13 ' A' ' 4' ' ' LEU . 2.7 t -58.38 -46.99 85.28 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.233 -0.44 . . . . 0.75 110.723 -179.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -53.32 -50.27 53.12 Favored Glycine 0 N--CA 1.451 -0.347 0 CA-C-N 115.837 -0.619 . . . . 0.40999999999999998 112.136 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.604 HG23 ' HE2' ' A' ' 74' ' ' LYS . 12.6 mt -62.57 -38.04 80.46 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.386 0 CA-C-O 120.924 0.392 . . . . 0.51000000000000001 110.787 179.695 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -58.6 -28.57 65.71 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.899 -0.591 . . . . 1.01 110.26 179.421 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -73.09 -49.45 28.4 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.06 -0.518 . . . . 0.69999999999999996 110.778 179.632 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.604 ' HE2' HG23 ' A' ' 71' ' ' ILE . 61.9 pttt -69.56 -26.7 64.62 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.245 -0.434 . . . . 1.3799999999999999 110.838 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 58.2 tt0 -78.69 -50.06 12.07 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.074 -0.512 . . . . 1.98 110.99 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 34.8 mtt -55.53 -36.65 66.98 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 116.175 -0.466 . . . . 1.2 110.908 179.779 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 13.9 tpt180 -61.36 -27.58 68.62 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.782 -0.645 . . . . 4.6900000000000004 110.827 179.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -77.69 -45.58 24.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.029 -0.532 . . . . 4.0099999999999998 110.817 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 72.6 p -88.0 70.38 9.41 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.049 -0.523 . . . . 5.2800000000000002 111.646 -179.362 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -77.36 92.18 3.91 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.029 -0.532 . . . . 5.5999999999999996 110.315 179.267 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.505 ' O ' ' HG2' ' A' ' 85' ' ' MET . 6.1 t 35.52 58.69 0.84 Allowed 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.079 0.466 . . . . 7.29 111.388 -179.558 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.44 ' HA ' ' HG2' ' A' ' 85' ' ' MET . 13.1 pt-20 -46.08 -32.38 2.84 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 113.064 0.764 . . . . 9.7400000000000002 113.064 -178.479 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -53.74 -56.06 20.77 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.002 0.43 . . . . 12.109999999999999 111.733 -179.152 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -65.99 -17.51 64.72 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.227 -0.442 . . . . 10.869999999999999 110.85 -179.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . 0.603 ' CB ' HG22 ' A' ' 142' ' ' VAL . 0.8 OUTLIER -83.0 -25.02 32.63 Favored 'General case' 0 CA--C 1.509 -0.63 0 CA-C-O 121.912 0.863 . . . . 11.09 109.081 -179.089 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 31.1 tpt180 -71.04 -45.23 64.22 Favored 'General case' 0 N--CA 1.442 -0.835 0 CA-C-N 113.902 -1.499 . . . . 15.52 110.151 179.693 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -69.26 -37.26 77.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.844 -0.616 . . . . 14.85 110.06 178.839 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -69.69 -39.58 76.86 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.008 -0.542 . . . . 14.109999999999999 111.046 179.635 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -64.25 -34.84 79.04 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.995 0.426 . . . . 15.73 110.276 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 59.8 mttt -62.45 -55.23 29.65 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.726 -0.67 . . . . 17.66 110.882 179.493 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 55.1 mt -64.15 -29.68 48.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.655 -0.702 . . . . 18.149999999999999 111.652 -179.409 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -79.6 -29.97 41.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.584 -0.28 . . . . 18.34 111.657 -179.403 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 24.1 t0 -83.84 101.83 11.91 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.009 0.433 . . . . 19.289999999999999 110.617 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.86 -14.17 58.65 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.874 -0.603 . . . . 22.25 111.719 -179.567 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.467 ' HB2' ' OD1' ' A' ' 97' ' ' ASP . 4.7 m-20 -125.66 160.07 30.62 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.932 0.396 . . . . 23.34 111.148 -179.876 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -87.68 5.34 85.11 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.899 -0.667 . . . . 22.0 112.051 179.64 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.467 ' OD1' ' HB2' ' A' ' 95' ' ' ASP . 10.4 p-10 -61.54 -33.12 73.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.784 0.326 . . . . 22.280000000000001 110.962 -179.844 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 99.84 17.85 24.43 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.758 -0.734 . . . . 19.93 112.845 179.691 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . 0.421 ' HB2' ' OD2' ' A' ' 97' ' ' ASP . 98.0 m-85 -141.09 147.1 38.01 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.815 0.34 . . . . 20.300000000000001 111.313 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 71.3 mt -114.96 136.2 52.41 Favored 'Isoleucine or valine' 0 C--O 1.232 0.157 0 CA-C-N 116.141 -0.482 . . . . 19.370000000000001 110.828 179.368 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 70.8 m -114.64 156.13 45.18 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 116.076 -0.511 . . . . 22.489999999999998 110.647 -179.819 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -40.1 -36.14 1.39 Allowed 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 122.458 2.105 . . . . 23.0 112.524 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.83 -51.66 60.89 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.105 -0.498 . . . . 24.559999999999999 110.839 179.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.402 ' O ' HG23 ' A' ' 108' ' ' VAL . 45.8 mt-10 -63.42 -45.03 92.87 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.808 -0.633 . . . . 22.23 110.739 179.768 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.769 HD23 ' HB ' ' A' ' 121' ' ' ILE . 21.7 tp -52.27 -42.71 63.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.862 -0.608 . . . . 20.359999999999999 110.999 -179.665 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.547 HH21 ' HA ' ' A' ' 117' ' ' THR . 4.4 ttm180 -72.13 -45.24 61.33 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.896 -0.593 . . . . 27.190000000000001 111.14 -179.907 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -53.14 -34.2 55.76 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.272 -0.422 . . . . 25.359999999999999 111.42 -179.468 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.466 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 43.3 t -80.17 -51.15 16.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.636 -0.256 . . . . 21.059999999999999 111.292 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 18.1 mmt -49.61 -46.18 49.01 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.372 -0.376 . . . . 20.93 111.406 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 68.4 mt -62.31 -30.16 48.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.92 0.39 . . . . 25.129999999999999 110.589 179.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 -74.94 -28.02 60.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.029 -0.532 . . . . 23.32 110.913 179.494 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 27.8 mt -77.16 -41.79 40.31 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.108 -0.496 . . . . 21.07 110.732 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 131.18 -5.2 5.65 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.996 -0.621 . . . . 23.050000000000001 111.965 -179.611 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -91.13 97.69 11.3 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.696 0.284 . . . . 22.59 110.875 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -68.71 102.1 1.45 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.291 -0.413 . . . . 27.960000000000001 110.82 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . 0.442 ' HB ' HG23 ' A' ' 121' ' ' ILE . 2.3 m -115.86 154.74 17.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.212 -0.449 . . . . 24.75 111.428 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . 0.547 ' HA ' HH21 ' A' ' 106' ' ' ARG . 81.5 p -98.88 145.77 26.65 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.854 -0.612 . . . . 27.239999999999998 110.53 179.487 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -51.88 -20.84 2.49 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.227 -0.442 . . . . 26.629999999999999 111.612 -179.549 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -78.26 -53.2 7.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.427 -0.351 . . . . 29.140000000000001 111.676 -179.527 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -63.83 -37.91 89.13 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.04 0.385 . . . . 24.190000000000001 112.04 -179.115 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.769 ' HB ' HD23 ' A' ' 105' ' ' LEU . 38.7 pt -72.83 -42.19 61.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 C-N-CA 120.83 -0.348 . . . . 22.329999999999998 111.702 -179.518 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.478 ' N ' HG13 ' A' ' 121' ' ' ILE . 18.1 t70 -58.74 -44.77 90.59 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.842 0.353 . . . . 24.289999999999999 110.671 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -60.08 -44.99 94.38 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.082 -0.508 . . . . 24.739999999999998 110.457 179.475 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 43.2 ttp -57.46 -33.66 68.19 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.905 -0.588 . . . . 19.710000000000001 110.63 179.386 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 66.5 mt -65.82 -43.96 93.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.048 -0.524 . . . . 19.949999999999999 110.554 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 33.8 ttm180 -58.23 -40.66 82.28 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.924 -0.58 . . . . 24.949999999999999 111.048 179.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -56.45 -43.65 79.7 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.254 -0.43 . . . . 18.690000000000001 111.08 -179.892 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.628 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -87.39 -14.25 41.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.148 -0.478 . . . . 16.469999999999999 111.28 -179.776 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . 0.432 ' HA ' ' OE1' ' A' ' 140' ' ' GLU . 27.5 t70 -93.61 99.23 11.71 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.015 0.436 . . . . 20.399999999999999 110.728 -179.739 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -89.74 -37.1 14.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.8 -0.636 . . . . 21.43 111.278 -179.679 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -63.7 -18.04 63.59 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.324 -0.398 . . . . 23.370000000000001 110.583 -179.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 60.74 83.45 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.977 -0.63 . . . . 24.32 112.831 179.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . 0.424 ' OD2' ' HB2' ' A' ' 135' ' ' MET . 12.6 p-10 -146.44 -5.62 0.56 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.791 0.329 . . . . 23.879999999999999 111.086 179.586 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 77.09 11.71 85.31 Favored Glycine 0 C--N 1.331 0.254 0 C-N-CA 120.866 -0.683 . . . . 22.670000000000002 112.699 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . 0.424 ' HB2' ' OD2' ' A' ' 133' ' ' ASP . 88.9 mtp -133.38 154.27 50.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.646 0.26 . . . . 22.91 110.389 179.653 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.662 HG23 ' HB2' ' A' ' 140' ' ' GLU . 40.4 mm -115.3 144.89 21.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 121.254 0.55 . . . . 18.41 112.155 -179.246 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . 0.429 ' O ' ' N ' ' A' ' 139' ' ' GLU . 30.0 p-10 -114.81 157.86 22.68 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.304 -0.862 . . . . 16.82 108.779 178.058 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.645 ' O ' HG23 ' A' ' 142' ' ' VAL . 27.8 t80 -39.27 -25.19 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 112.377 0.51 . . . . 14.65 112.377 -179.152 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.429 ' N ' ' O ' ' A' ' 137' ' ' ASN . 44.9 mt-10 -80.05 -55.92 4.61 Favored 'General case' 0 C--O 1.234 0.275 0 O-C-N 122.226 -0.296 . . . . 14.82 111.401 -179.563 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.662 ' HB2' HG23 ' A' ' 136' ' ' ILE . 30.7 mt-10 -60.82 -27.33 67.97 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.986 0.422 . . . . 17.460000000000001 110.36 179.895 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.619 ' HA ' ' HE2' ' A' ' 144' ' ' MET . 91.6 t80 -69.33 -56.01 8.77 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.905 -0.588 . . . . 12.93 109.787 179.333 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.645 HG23 ' O ' ' A' ' 138' ' ' TYR . 38.9 t -45.41 -40.84 2.84 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 CA-C-N 115.55 -0.75 . . . . 10.699999999999999 111.643 178.917 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' TRP . . . . . 0.41 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 75.5 t90 -67.68 -55.61 12.58 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.744 0.646 . . . . 13.66 112.744 -178.845 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . 0.628 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 19.9 ptt? -67.07 -20.25 65.79 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 113.257 0.836 . . . . 14.5 113.257 -177.433 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . 0.574 HG23 ' O ' ' A' ' 141' ' ' PHE . 43.4 pt -80.52 -46.09 21.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 N-CA-C 112.236 0.458 . . . . 11.25 112.236 -179.121 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . 0.551 ' N ' HG13 ' A' ' 145' ' ' ILE . 28.8 t -63.58 -13.93 46.55 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.193 0.521 . . . . 8.5399999999999991 110.356 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 147' ' ' GLN . . . . . 0.41 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 16.6 mm-40 -118.35 45.33 2.04 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.385 -0.825 . . . . 11.869999999999999 111.651 -178.245 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . 0.442 ' HE3' ' O ' ' A' ' 145' ' ' ILE . 10.4 mtmp? . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.242 -0.885 . . . . 13.68 110.919 179.51 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 149' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 151' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 56.9 m . . . . . 0 N--CA 1.486 1.347 0 CA-C-O 120.8 0.333 . . . . 4.8899999999999997 110.893 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -135.68 14.94 3.39 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.171 -0.468 . . . . 3.2599999999999998 111.164 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.9 mt -61.07 94.48 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.118 -0.492 . . . . 1.27 111.007 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 72.3 p -76.68 -177.45 4.27 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.456 -0.338 . . . . 1.1200000000000001 111.294 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -60.25 -51.26 70.32 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.376 -0.375 . . . . 2.2000000000000002 111.562 -179.512 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -67.74 -45.63 74.44 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.983 0.42 . . . . 1.3500000000000001 111.018 -179.572 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -59.23 -42.41 90.95 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.812 -0.631 . . . . 2.2200000000000002 111.245 -179.717 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.532 ' HA ' ' CZ ' ' A' ' 12' ' ' PHE . 55.0 mt -60.62 -49.79 83.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.884 0.373 . . . . 0.54000000000000004 110.652 179.744 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.2 -19.07 64.73 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.995 -0.548 . . . . 0.5 111.099 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -73.94 -55.83 5.69 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.259 -0.428 . . . . 2.27 111.767 -179.238 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.532 ' CZ ' ' HA ' ' A' ' 9' ' ' ILE . 4.2 p90 -77.53 -24.51 49.95 Favored 'General case' 0 C--N 1.332 -0.196 0 C-N-CA 120.673 -0.411 . . . . 0.37 111.012 -179.582 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 23.9 tptp -66.92 -41.44 87.05 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 109.397 -0.594 . . . . 1.23 109.397 178.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -65.26 -47.67 75.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.898 -0.592 . . . . 0.44 109.477 178.498 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.87 -30.65 70.27 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 115.643 -0.708 . . . . 0.28999999999999998 110.415 179.127 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 24.9 t80 -66.95 -38.89 86.96 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.572 -0.74 . . . . 0.47999999999999998 110.623 179.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -70.88 -28.39 33.5 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.774 0 CA-C-N 115.966 -0.561 . . . . 1.1100000000000001 111.153 -179.724 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -60.54 -27.86 67.98 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.791 -0.641 . . . . 1.6000000000000001 111.486 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 54.9 m-85 -94.01 -12.63 28.22 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.63 -0.259 . . . . 0.64000000000000001 111.672 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -84.93 91.25 8.0 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.894 0.378 . . . . 0.44 110.732 179.621 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 71.8 mmtt -100.03 -26.03 14.11 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.965 -0.561 . . . . 2.1000000000000001 111.243 -179.659 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -70.96 -20.14 62.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.168 -0.469 . . . . 1.8 111.281 -179.549 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 86.45 0.2 86.64 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.786 -0.721 . . . . 0.46000000000000002 112.707 179.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 22.7 p -79.39 10.74 3.48 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.738 0.304 . . . . 0.40000000000000002 111.212 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 55.54 30.01 54.97 Favored Glycine 0 C--N 1.331 0.293 0 C-N-CA 120.82 -0.705 . . . . 0.33000000000000002 112.066 -179.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.482 ' C ' HE22 ' A' ' 62' ' ' GLN . 33.0 mtmm -138.33 155.85 48.18 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.744 0.307 . . . . 1.1000000000000001 111.238 -179.466 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.558 HG13 ' HB2' ' A' ' 63' ' ' LEU . 33.8 pt -116.12 126.41 73.61 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 116.358 -0.383 . . . . 0.5 111.199 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -50.74 142.02 11.99 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.181 -0.463 . . . . 0.29999999999999999 111.501 -179.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.503 ' HA ' HD11 ' A' ' 63' ' ' LEU . 9.8 t -67.44 -16.09 64.03 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.886 -0.597 . . . . 1.03 111.745 -179.542 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -89.46 5.08 46.95 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.473 -0.33 . . . . 3.0800000000000001 110.679 179.728 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -123.18 -4.26 8.45 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.091 -0.504 . . . . 2.2599999999999998 110.942 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.508 HD21 ' CD1' ' A' ' 68' ' ' PHE . 1.6 tm? -58.81 -48.6 80.75 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.35 -0.386 . . . . 1.3700000000000001 110.373 179.617 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -55.64 -35.77 63.18 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.533 -0.841 . . . . 0.32000000000000001 111.306 179.341 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 88.5 m -69.74 -39.92 76.5 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.062 0.458 . . . . 0.31 110.21 179.272 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 56.1 tp -65.15 -24.07 67.3 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.731 -0.668 . . . . 1.24 110.322 179.439 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.496 ' HG3' ' HG3' ' A' ' 43' ' ' PRO . 21.5 mmt -75.46 -43.32 50.15 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.94 -0.573 . . . . 1.1000000000000001 110.13 179.139 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -55.87 -50.14 71.43 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.645 -0.707 . . . . 2.6899999999999999 111.102 179.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.442 HG23 ' HG ' ' A' ' 39' ' ' LEU . 10.1 t -61.68 -13.49 23.17 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.294 -0.412 . . . . 1.0600000000000001 111.135 179.84 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.442 ' HG ' HG23 ' A' ' 38' ' ' THR . 75.0 mt -113.57 157.16 22.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.096 -0.502 . . . . 1.26 110.613 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -75.85 40.36 1.4 Allowed Glycine 0 CA--C 1.521 0.426 0 C-N-CA 120.883 -0.675 . . . . 0.68999999999999995 114.027 -178.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 9.9 mp0 -97.15 -66.72 0.88 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 117.103 0.451 . . . . 1.97 111.109 179.029 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 59.0 m-20 60.82 67.21 1.55 Allowed Pre-proline 0 CA--C 1.53 0.199 0 CA-C-N 116.149 -0.478 . . . . 2.6600000000000001 111.098 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.496 ' HG3' ' HG3' ' A' ' 36' ' ' MET . 60.1 Cg_endo -71.47 160.39 48.65 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.72 2.28 . . . . 0.51000000000000001 112.124 179.655 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 33.4 m -74.5 146.76 42.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.153 -0.476 . . . . 0.72999999999999998 110.604 179.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.435 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 41.9 tt0 -46.4 -50.34 16.76 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.61 -0.268 . . . . 2.7000000000000002 111.137 -179.522 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -51.32 -53.07 39.66 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.274 -0.421 . . . . 0.46000000000000002 111.315 -179.748 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.467 ' HG2' HD23 ' A' ' 51' ' ' LEU . 36.8 tt0 -52.08 -49.5 63.43 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.357 -0.383 . . . . 2.23 110.618 179.888 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 51.6 mt -57.87 -40.24 79.73 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.38 -0.373 . . . . 1.3600000000000001 110.584 179.572 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.435 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 31.7 mm-40 -65.66 -32.74 74.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.411 -0.359 . . . . 1.22 111.026 179.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -75.13 -54.64 6.79 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.222 -0.444 . . . . 0.62 112.103 -179.349 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.467 HD23 ' HG2' ' A' ' 47' ' ' GLU . 2.2 pp -66.33 -39.71 89.42 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 111.995 0.368 . . . . 0.39000000000000001 111.995 -178.871 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 86.1 mt -68.48 -43.31 83.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 C-N-CA 121.147 -0.221 . . . . 0.5 111.054 -179.647 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.86 -38.86 89.95 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.809 0.338 . . . . 0.58999999999999997 110.811 179.72 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -64.02 -43.54 95.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.13 -0.486 . . . . 2.54 110.309 179.607 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -77.19 -16.36 59.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.983 -0.553 . . . . 0.53000000000000003 110.996 179.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -65.74 -23.9 66.84 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.148 -0.478 . . . . 1.95 110.799 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -103.92 29.61 5.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.035 -0.53 . . . . 2.48 110.621 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -158.51 150.26 21.23 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.007 -0.542 . . . . 2.48 110.754 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 74.4 m-20 59.76 15.1 4.54 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.042 -0.526 . . . . 2.0499999999999998 111.021 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 18.3 m-80 60.71 12.9 3.96 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.905 -0.589 . . . . 1.47 111.917 179.29 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 113.62 30.47 2.6 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.636 -0.792 . . . . 0.42999999999999999 112.389 179.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.482 HE22 ' C ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -127.32 154.52 44.84 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.095 0.474 . . . . 0.38 111.3 -179.832 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.558 ' HB2' HG13 ' A' ' 27' ' ' ILE . 17.4 mt -121.08 152.42 38.68 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.608 -0.724 . . . . 1.4299999999999999 109.753 179.366 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . 0.438 ' H ' ' CG ' ' A' ' 67' ' ' GLU . 0.8 OUTLIER -113.07 156.76 22.55 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 110.19 -0.3 . . . . 1.1899999999999999 110.19 -179.483 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.537 ' O ' ' HB2' ' A' ' 69' ' ' CYS . 82.8 t80 -42.41 -41.56 2.93 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.483 -0.326 . . . . 0.40000000000000002 110.959 179.889 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 3.8 m -71.45 -33.85 69.73 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.352 -0.386 . . . . 0.81000000000000005 111.397 -179.766 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.438 ' CG ' ' H ' ' A' ' 64' ' ' ASN . 17.5 mm-40 -62.51 -51.28 68.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.871 0.367 . . . . 1.3600000000000001 110.287 179.393 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.508 ' CD1' HD21 ' A' ' 32' ' ' LEU . 32.8 t80 -67.65 -47.43 69.56 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.021 -0.536 . . . . 0.51000000000000001 110.649 179.534 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.537 ' HB2' ' O ' ' A' ' 65' ' ' PHE . 0.1 OUTLIER -57.27 -38.9 74.62 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-O 120.959 0.409 . . . . 0.75 110.059 179.599 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -57.51 -50.95 60.87 Favored Glycine 0 CA--C 1.507 -0.466 0 N-CA-C 111.119 -0.792 . . . . 0.40999999999999998 111.119 179.462 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.706 HG23 ' HE2' ' A' ' 74' ' ' LYS . 70.6 mt -59.5 -50.12 81.09 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.656 0 CA-C-O 121.032 0.444 . . . . 0.51000000000000001 110.365 178.466 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 15.2 mtp -49.68 -28.94 6.58 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.613 -0.721 . . . . 1.01 110.51 179.524 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -71.87 -45.28 61.87 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.328 -0.396 . . . . 0.69999999999999996 110.231 179.291 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.706 ' HE2' HG23 ' A' ' 71' ' ' ILE . 49.0 pttt -70.56 -28.87 65.23 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.125 -0.489 . . . . 1.3799999999999999 111.041 179.823 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . 0.494 HE22 ' HA ' ' A' ' 43' ' ' PRO . 4.8 tp-100 -80.58 -55.42 4.87 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.001 -0.545 . . . . 1.98 111.623 -179.784 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 68.3 mtp -63.07 -22.96 67.21 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 116.169 -0.469 . . . . 1.2 111.793 -179.275 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 43.3 mtt180 -60.4 -39.09 86.12 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.648 0.261 . . . . 4.6900000000000004 110.705 179.432 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 58.6 -82.71 0.02 OUTLIER 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.085 -0.507 . . . . 4.0099999999999998 110.791 -179.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.424 HG22 ' OD2' ' A' ' 80' ' ' ASP . 5.0 m -91.74 -64.49 1.11 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.251 -0.432 . . . . 5.2800000000000002 110.238 179.347 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . 0.424 ' OD2' HG22 ' A' ' 79' ' ' THR . 1.1 p30 177.55 -12.3 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.781 -0.645 . . . . 5.5999999999999996 111.239 179.683 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.64 ' O ' ' HG2' ' A' ' 85' ' ' MET . 58.8 m 62.67 76.82 0.35 Allowed 'General case' 0 CA--C 1.529 0.137 0 N-CA-C 109.925 -0.398 . . . . 7.29 109.925 -179.104 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -58.12 -16.03 11.72 Favored 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 113.39 0.885 . . . . 9.7400000000000002 113.39 -178.169 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -64.26 -56.5 14.17 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.001 0.429 . . . . 12.109999999999999 111.683 -179.286 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -68.19 -14.08 62.71 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.045 -0.525 . . . . 10.869999999999999 110.919 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . 0.64 ' HG2' ' O ' ' A' ' 81' ' ' THR . 4.5 mmm -80.35 -38.77 29.83 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.119 -0.491 . . . . 11.09 110.42 -179.441 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 10.4 ttm180 -67.73 -42.55 81.72 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.975 -0.557 . . . . 15.52 109.595 179.303 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.503 ' O ' HG12 ' A' ' 91' ' ' ILE . 36.9 tt0 -59.55 -48.77 80.34 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.879 -0.6 . . . . 14.85 109.811 179.011 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -66.56 -29.87 70.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.938 -0.574 . . . . 14.109999999999999 110.778 179.583 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 46.7 t80 -59.28 -52.04 67.37 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 109.846 -0.427 . . . . 15.73 109.846 179.492 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -59.06 -37.77 77.82 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.797 -0.638 . . . . 17.66 110.021 178.77 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.503 HG12 ' O ' ' A' ' 87' ' ' GLU . 40.0 mm -59.92 -40.98 84.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.431 -0.804 . . . . 18.149999999999999 110.83 179.469 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.528 ' O ' ' HD3' ' A' ' 94' ' ' ARG . 7.0 m-85 -74.06 -56.64 4.68 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.311 -0.404 . . . . 18.34 111.332 -179.636 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.486 ' HA ' ' CZ ' ' A' ' 94' ' ' ARG . 43.2 t0 -49.96 124.97 10.97 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 120.947 0.403 . . . . 19.289999999999999 110.566 -179.739 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.67 ' CZ ' ' HB3' ' A' ' 104' ' ' GLU . 0.0 OUTLIER -76.78 -31.97 57.38 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.904 -0.589 . . . . 22.25 111.662 -178.694 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -113.76 177.97 4.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.978 0.418 . . . . 23.34 111.368 -179.036 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -88.38 3.9 85.32 Favored Glycine 0 N--CA 1.449 -0.472 0 N-CA-C 110.919 -0.872 . . . . 22.0 110.919 178.632 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 22.3 p-10 -56.02 -39.18 71.55 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.227 -0.487 . . . . 22.280000000000001 111.167 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 89.48 21.57 40.3 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.846 -0.693 . . . . 19.93 111.922 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . 0.501 ' HA ' ' O ' ' A' ' 136' ' ' ILE . 97.5 m-85 -136.93 143.83 43.12 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.858 0.361 . . . . 20.300000000000001 111.328 -179.709 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.538 ' HB ' ' HB ' ' A' ' 136' ' ' ILE . 59.6 mt -114.35 132.3 63.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-N 115.904 -0.589 . . . . 19.370000000000001 110.832 179.629 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 26.7 p -114.42 156.18 44.86 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.037 -0.529 . . . . 22.489999999999998 110.693 -179.705 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_exo -42.78 -48.71 7.18 Favored 'Trans proline' 0 C--N 1.348 0.538 0 C-N-CA 122.686 2.257 . . . . 23.0 112.965 -179.78 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.81 -51.29 68.86 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.093 0.473 . . . . 24.559999999999999 111.068 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.67 ' HB3' ' CZ ' ' A' ' 94' ' ' ARG . 38.6 mt-10 -59.15 -41.34 88.1 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.716 -0.674 . . . . 22.23 111.04 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.708 HD23 ' HB ' ' A' ' 121' ' ' ILE . 47.7 tp -54.38 -46.72 73.13 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.67 -0.695 . . . . 20.359999999999999 111.037 -179.476 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 5.4 ttt180 -60.47 -48.16 82.98 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.104 -0.498 . . . . 27.190000000000001 110.854 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 72.5 t80 -52.19 -35.02 47.92 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.223 -0.444 . . . . 25.359999999999999 111.513 -179.457 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.631 HG21 HH11 ' A' ' 94' ' ' ARG . 30.2 t -77.18 -54.12 13.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 N-CA-C 111.748 0.277 . . . . 21.059999999999999 111.748 -179.611 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -49.54 -39.63 35.27 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.834 0.349 . . . . 20.93 110.955 -179.715 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 84.7 mt -66.84 -28.68 43.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.17 -0.468 . . . . 25.129999999999999 110.936 179.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 89.1 m-20 -72.84 -46.18 54.37 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.235 -0.439 . . . . 23.32 110.336 179.639 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 9.6 mp -60.32 -45.11 94.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.626 -0.715 . . . . 21.07 110.976 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 128.95 11.81 2.79 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.8 -0.714 . . . . 23.050000000000001 112.474 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -106.51 94.64 5.24 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.789 0.328 . . . . 22.59 111.07 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -60.99 126.2 26.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.159 -0.473 . . . . 27.960000000000001 110.704 179.588 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . 0.425 HG12 ' OE1' ' A' ' 120' ' ' GLU . 3.0 m -144.41 150.71 16.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.231 -0.44 . . . . 24.75 111.444 -179.792 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 68.3 p -94.5 149.36 21.32 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.826 -0.625 . . . . 27.239999999999998 110.218 179.231 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -54.78 -17.24 3.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.155 -0.475 . . . . 26.629999999999999 111.601 -179.597 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -77.8 -55.18 5.54 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.479 -0.328 . . . . 29.140000000000001 111.511 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.425 ' OE1' HG12 ' A' ' 116' ' ' VAL . 14.6 pt-20 -63.36 -38.84 92.71 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 111.996 0.369 . . . . 24.190000000000001 111.996 -179.151 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.708 ' HB ' HD23 ' A' ' 105' ' ' LEU . 42.0 pt -71.68 -41.61 71.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 N-CA-C 111.787 0.292 . . . . 22.329999999999998 111.787 -179.408 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.513 ' N ' HG13 ' A' ' 121' ' ' ILE . 19.7 t70 -59.89 -39.76 86.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.741 0.305 . . . . 24.289999999999999 110.702 179.873 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -65.06 -43.9 90.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.11 -0.496 . . . . 24.739999999999998 110.605 179.682 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 52.6 ttp -56.76 -37.78 71.54 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.114 -0.494 . . . . 19.710000000000001 110.585 179.459 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.61 HG23 HD11 ' A' ' 136' ' ' ILE . 72.3 mt -65.85 -43.23 93.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.99 -0.55 . . . . 19.949999999999999 110.448 179.595 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 75.0 ttt180 -60.82 -30.66 70.22 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.701 -0.682 . . . . 24.949999999999999 111.115 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -75.88 -27.62 57.81 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.132 -0.485 . . . . 18.690000000000001 111.362 -179.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.581 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -101.06 -8.73 22.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.355 -0.384 . . . . 16.469999999999999 111.181 -179.805 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 30.2 t0 -100.7 87.48 3.35 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.179 -0.464 . . . . 20.399999999999999 110.825 -179.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 71.7 m-85 -67.4 -49.81 62.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.895 -0.593 . . . . 21.43 111.147 -179.633 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -57.39 -29.12 63.81 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.239 -0.437 . . . . 23.370000000000001 110.776 179.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 67.17 63.62 3.7 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.973 -0.632 . . . . 24.32 112.909 179.419 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -122.95 7.26 9.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.851 0.358 . . . . 23.879999999999999 110.586 179.533 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 69.07 18.83 73.27 Favored Glycine 0 C--N 1.33 0.246 0 C-N-CA 120.99 -0.624 . . . . 22.670000000000002 112.629 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 85.6 mmm -134.57 153.66 51.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.701 0.286 . . . . 22.91 110.545 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.663 HG23 ' HB2' ' A' ' 140' ' ' GLU . 43.4 mm -114.79 141.81 29.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 121.091 0.472 . . . . 18.41 111.563 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . 0.477 ' ND2' ' H ' ' A' ' 138' ' ' TYR . 3.5 t-20 -114.89 156.42 25.02 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.258 -0.883 . . . . 16.82 108.801 178.345 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.694 ' O ' HG23 ' A' ' 142' ' ' VAL . 6.8 t80 -40.08 -24.8 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 120.706 0.288 . . . . 14.65 111.487 179.698 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.435 ' N ' ' O ' ' A' ' 137' ' ' ASN . 14.3 mm-40 -80.28 -55.78 4.67 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.876 0.37 . . . . 14.82 111.01 -179.353 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.663 ' HB2' HG23 ' A' ' 136' ' ' ILE . 35.5 mt-10 -57.74 -31.17 66.19 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.005 -0.543 . . . . 17.460000000000001 110.401 179.742 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.554 ' CE2' HD13 ' A' ' 145' ' ' ILE . 90.0 t80 -69.58 -56.04 8.44 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.599 -0.728 . . . . 12.93 110.708 -179.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.694 HG23 ' O ' ' A' ' 138' ' ' TYR . 52.0 t -46.58 -38.22 3.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.002 -0.545 . . . . 10.699999999999999 111.958 179.626 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' TRP . . . . . 0.451 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 91.0 t90 -71.08 -55.87 7.32 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.469 0.544 . . . . 13.66 112.469 -178.809 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . 0.581 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 18.4 ptt? -62.47 -25.0 67.76 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 112.971 0.73 . . . . 14.5 112.971 -177.75 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . 0.587 HD11 ' HB3' ' A' ' 85' ' ' MET . 45.1 pt -80.93 -40.47 18.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 N-CA-C 112.168 0.433 . . . . 11.25 112.168 -179.83 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . 0.538 ' N ' HG13 ' A' ' 145' ' ' ILE . 88.1 p -61.31 -14.82 29.72 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-O 121.494 0.664 . . . . 8.5399999999999991 109.557 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 147' ' ' GLN . . . . . 0.451 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 2.7 mm-40 -113.6 -11.51 12.99 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 114.899 -1.046 . . . . 11.869999999999999 109.897 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . 0.579 ' HB2' ' HA ' ' A' ' 145' ' ' ILE . 28.0 ttpp . . . . . 0 C--O 1.25 1.085 0 CA-C-O 118.247 -0.882 . . . . 13.68 110.92 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 149' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 151' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 53.4 m . . . . . 0 N--CA 1.486 1.325 0 CA-C-O 120.919 0.39 . . . . 4.8899999999999997 110.996 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -142.74 142.02 31.87 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.121 -0.49 . . . . 3.2599999999999998 110.87 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.598 HD13 ' SG ' ' A' ' 69' ' ' CYS . 33.2 mt -70.75 82.78 0.63 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.325 -0.398 . . . . 1.27 110.614 179.738 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 56.5 p -70.99 -165.4 0.12 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.132 -0.486 . . . . 1.1200000000000001 111.194 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -75.48 -42.79 52.16 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.995 0.426 . . . . 2.2000000000000002 110.472 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -73.06 -35.13 66.63 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.834 -0.621 . . . . 1.3500000000000001 110.536 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -70.85 -47.21 60.59 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.922 -0.581 . . . . 2.2200000000000002 110.817 179.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.517 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 35.4 mt -58.46 -41.26 81.18 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 116.271 -0.422 . . . . 0.54000000000000004 110.912 179.828 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -76.06 -22.05 56.08 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.438 -0.347 . . . . 0.5 111.043 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -68.47 -57.1 6.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.199 -0.455 . . . . 2.27 111.736 -179.425 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.517 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 11.5 p90 -76.76 -25.29 53.27 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.678 -0.409 . . . . 0.37 110.489 -179.721 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.404 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 18.9 tptm -63.33 -34.01 76.77 Favored 'General case' 0 CA--C 1.519 -0.242 0 N-CA-C 108.87 -0.789 . . . . 1.23 108.87 178.227 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.608 ' O ' HG22 ' A' ' 17' ' ' VAL . 14.0 t70 -69.74 -53.02 20.39 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 109.013 -0.736 . . . . 0.44 109.013 178.418 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.05 -15.23 21.26 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.821 -0.627 . . . . 0.28999999999999998 110.508 178.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.404 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 66.1 t80 -80.69 -44.76 18.24 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.746 -0.661 . . . . 0.47999999999999998 111.001 -179.729 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.608 HG22 ' O ' ' A' ' 14' ' ' ASP . 25.7 m -69.33 -21.14 24.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.983 0.42 . . . . 1.1100000000000001 110.675 -179.664 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.55 ' HG3' ' O ' ' A' ' 14' ' ' ASP . 83.8 mt-30 -63.69 -25.29 68.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.83 -0.623 . . . . 1.6000000000000001 111.3 179.814 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -104.9 25.06 10.93 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.57 -0.286 . . . . 0.64000000000000001 111.617 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -116.74 80.64 1.5 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.059 0.457 . . . . 0.44 110.723 179.336 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 30.2 mmmt -93.83 5.14 52.63 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.85 -0.614 . . . . 2.1000000000000001 111.176 -179.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -103.89 -1.26 27.99 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.316 -0.402 . . . . 1.8 111.35 -179.371 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 63.48 10.39 36.03 Favored Glycine 0 CA--C 1.517 0.201 0 C-N-CA 120.921 -0.657 . . . . 0.46000000000000002 113.144 179.578 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 30.4 p -90.15 10.85 22.84 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.699 0.285 . . . . 0.40000000000000002 111.122 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 56.26 18.13 20.12 Favored Glycine 0 C--N 1.332 0.306 0 C-N-CA 120.766 -0.73 . . . . 0.33000000000000002 111.912 -179.653 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.531 ' C ' HE22 ' A' ' 62' ' ' GLN . 32.1 mtpt -129.58 155.95 44.97 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.594 -0.303 . . . . 1.1000000000000001 110.819 -179.339 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.492 ' N ' HE22 ' A' ' 62' ' ' GLN . 35.7 pt -120.87 129.96 75.13 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 120.934 0.397 . . . . 0.5 111.359 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -47.78 137.46 9.6 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.144 -0.48 . . . . 0.29999999999999999 111.336 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.494 HG23 ' HD2' ' A' ' 30' ' ' ARG . 5.5 t -67.31 -0.27 3.41 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.926 -0.579 . . . . 1.03 110.873 179.804 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.494 ' HD2' HG23 ' A' ' 29' ' ' THR . 3.6 mmm180 -94.28 -17.8 22.27 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.98 -0.554 . . . . 3.0800000000000001 110.28 179.839 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -102.07 -3.0 28.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.56 -0.745 . . . . 2.2599999999999998 110.503 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.445 HD12 HD11 ' A' ' 51' ' ' LEU . 3.2 tm? -58.08 -50.66 72.68 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.009 -0.542 . . . . 1.3700000000000001 110.311 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -54.34 -38.56 62.5 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.49 -0.862 . . . . 0.32000000000000001 111.524 179.301 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 92.8 m -65.95 -34.53 78.33 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.006 0.432 . . . . 0.31 110.429 179.145 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 48.3 tp -68.3 -36.68 79.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.789 -0.641 . . . . 1.24 110.909 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.452 ' HG3' ' HG3' ' A' ' 43' ' ' PRO . 40.0 mmm -65.46 -40.19 92.91 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.88 -0.415 . . . . 1.1000000000000001 109.88 179.549 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 74.9 mtp180 -67.9 -30.39 69.71 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.266 -0.642 . . . . 2.6899999999999999 109.266 178.705 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 96.2 m -65.97 -21.29 66.41 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 115.286 -0.87 . . . . 1.0600000000000001 110.415 179.245 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 10.3 mp -114.49 156.96 23.62 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.493 -0.776 . . . . 1.26 110.413 179.757 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -53.16 -8.12 0.64 Allowed Glycine 0 CA--C 1.52 0.402 0 C-N-CA 121.109 -0.567 . . . . 0.68999999999999995 113.339 -179.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 82.9 mm-40 -60.43 176.14 0.38 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.089 0.471 . . . . 1.97 111.343 179.752 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 16.8 p-10 -169.81 72.27 0.66 Allowed Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 115.782 -0.645 . . . . 2.6600000000000001 110.85 179.8 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.452 ' HG3' ' HG3' ' A' ' 36' ' ' MET . 56.9 Cg_endo -68.84 142.29 51.68 Favored 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.595 2.196 . . . . 0.51000000000000001 112.316 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 26.9 m -64.22 148.46 50.05 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.243 -0.435 . . . . 0.72999999999999998 110.168 179.346 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.479 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 6.7 tp10 -48.15 -55.69 9.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.595 0.236 . . . . 2.7000000000000002 110.999 -179.356 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -51.13 -52.13 46.9 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.144 -0.48 . . . . 0.46000000000000002 111.42 -179.837 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -50.01 -50.45 47.29 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.375 -0.375 . . . . 2.23 110.702 179.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 12.8 mt -57.07 -45.48 83.26 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.229 -0.441 . . . . 1.3600000000000001 110.676 179.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.479 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 30.4 mm-40 -60.73 -32.31 71.59 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.811 0.339 . . . . 1.22 110.911 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -73.71 -55.52 6.16 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.204 -0.453 . . . . 0.62 112.185 -179.086 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.445 HD11 HD12 ' A' ' 32' ' ' LEU . 1.8 pp -66.59 -36.72 83.3 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 111.613 0.227 . . . . 0.39000000000000001 111.613 -179.13 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 78.9 mt -64.81 -43.25 96.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.702 0.287 . . . . 0.5 110.483 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.54 -28.84 68.14 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.2 -0.454 . . . . 0.58999999999999997 110.372 179.328 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -66.05 -51.36 58.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.93 -0.577 . . . . 2.54 110.228 179.452 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -78.51 -14.72 59.22 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.055 -0.52 . . . . 0.53000000000000003 111.429 179.708 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.477 ' HA ' HG21 ' A' ' 29' ' ' THR . 40.7 tt0 -59.97 -44.09 94.68 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.504 -0.316 . . . . 1.95 111.051 -179.807 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -122.45 57.64 1.08 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.306 -0.406 . . . . 2.48 110.984 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -149.26 -30.53 0.24 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.157 -0.474 . . . . 2.48 110.782 179.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 27.7 m-80 -128.7 25.69 5.65 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.139 -0.482 . . . . 2.0499999999999998 110.784 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . 0.565 ' N ' HD22 ' A' ' 60' ' ' ASN . 0.8 OUTLIER 62.69 11.37 4.8 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.96 -0.564 . . . . 1.47 111.667 179.846 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 104.18 37.95 2.78 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.687 -0.768 . . . . 0.42999999999999999 112.647 179.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.531 HE22 ' C ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -140.56 154.31 46.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.139 0.495 . . . . 0.38 111.438 179.921 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 81.3 mt -122.02 147.76 45.67 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.742 -0.663 . . . . 1.4299999999999999 110.146 179.607 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -112.9 156.76 22.4 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.61 -0.268 . . . . 1.1899999999999999 110.507 -179.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.444 ' O ' ' HB2' ' A' ' 69' ' ' CYS . 78.3 t80 -43.69 -42.6 5.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.206 -0.452 . . . . 0.40000000000000002 111.287 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.27 -34.11 74.27 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 111.874 0.324 . . . . 0.81000000000000005 111.874 -179.713 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -63.09 -54.02 44.56 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.097 0.475 . . . . 1.3600000000000001 110.239 179.501 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.48 ' HE2' ' HB2' ' A' ' 12' ' ' PHE . 28.7 t80 -64.14 -45.01 90.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.752 -0.658 . . . . 0.51000000000000001 110.752 179.676 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.598 ' SG ' HD13 ' A' ' 4' ' ' LEU . 3.9 t -58.15 -44.19 87.74 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.079 -0.509 . . . . 0.75 110.156 179.62 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -53.26 -48.16 60.02 Favored Glycine 0 N--CA 1.45 -0.432 0 CA-C-N 115.622 -0.717 . . . . 0.40999999999999998 111.674 179.536 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.494 HG23 ' CE ' ' A' ' 74' ' ' LYS . 14.4 mt -62.75 -44.7 99.7 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.363 0 CA-C-O 121.091 0.472 . . . . 0.51000000000000001 110.426 179.257 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -53.33 -27.12 21.66 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.555 -0.748 . . . . 1.01 110.035 179.472 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -74.48 -47.29 34.13 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.907 -0.588 . . . . 0.69999999999999996 111.034 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.494 ' CE ' HG23 ' A' ' 71' ' ' ILE . 63.1 pttt -68.74 -27.5 65.98 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 116.551 -0.295 . . . . 1.3799999999999999 111.247 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 22.3 mt-30 -81.24 -50.41 9.59 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.796 0.332 . . . . 1.98 111.497 179.061 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 33.1 mtt -58.66 -40.13 82.61 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 112.373 0.509 . . . . 1.2 112.373 -178.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.435 ' NE ' ' HA ' ' A' ' 74' ' ' LYS . 10.0 ptp180 -53.6 -43.52 68.69 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-O 121.024 0.44 . . . . 4.6900000000000004 109.939 -179.346 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.422 ' O ' ' C ' ' A' ' 79' ' ' THR . 7.1 pt-20 -89.52 -117.84 0.06 Allowed 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 108.912 -0.773 . . . . 4.0099999999999998 108.912 178.067 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.422 ' C ' ' O ' ' A' ' 78' ' ' GLU . 19.6 m 34.23 49.31 0.31 Allowed 'General case' 0 CA--C 1.531 0.221 0 CA-C-O 121.26 0.552 . . . . 5.2800000000000002 111.099 179.701 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -163.26 -2.09 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.093 -0.503 . . . . 5.5999999999999996 111.305 -179.6 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.519 ' O ' ' HG2' ' A' ' 85' ' ' MET . 13.0 t -44.91 126.63 5.93 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.213 -0.449 . . . . 7.29 111.163 -179.76 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.438 ' HA ' ' HG2' ' A' ' 85' ' ' MET . 41.9 mt-10 -75.61 -14.4 60.37 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.21 -0.45 . . . . 9.7400000000000002 111.495 -179.273 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -60.78 -55.29 34.92 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.384 -0.371 . . . . 12.109999999999999 111.614 -179.716 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -65.74 -20.52 66.3 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.303 -0.408 . . . . 10.869999999999999 111.23 -179.503 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . 0.539 ' HB3' HD11 ' A' ' 145' ' ' ILE . 1.5 mmm -80.46 -36.01 34.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.991 0.424 . . . . 11.09 110.78 -179.353 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 29.4 ttt180 -67.96 -42.44 80.88 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.821 -0.627 . . . . 15.52 110.487 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -68.06 -37.93 81.86 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.078 -0.51 . . . . 14.85 110.002 179.161 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -71.16 -31.15 67.33 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.972 -0.558 . . . . 14.109999999999999 110.854 179.499 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -67.71 -40.45 84.27 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.118 -0.492 . . . . 15.73 110.456 179.766 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -66.5 -39.91 88.97 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.914 -0.585 . . . . 17.66 110.559 179.493 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 96.9 mt -64.47 -47.93 87.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.845 -0.616 . . . . 18.149999999999999 110.795 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.482 ' HD2' HG11 ' A' ' 108' ' ' VAL . 4.4 m-85 -63.85 -57.14 10.77 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.114 -0.494 . . . . 18.34 110.695 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.601 ' HA ' HH21 ' A' ' 94' ' ' ARG . 27.4 t0 -53.51 127.3 24.67 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 120.787 0.327 . . . . 19.289999999999999 110.228 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.731 ' H ' ' HE ' ' A' ' 94' ' ' ARG . 0.0 OUTLIER -98.19 -24.18 15.38 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.28 -0.418 . . . . 22.25 111.788 -178.665 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -101.84 -179.93 4.15 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.969 0.414 . . . . 23.34 111.026 -179.794 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.26 3.3 56.67 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.886 -0.673 . . . . 22.0 112.024 179.628 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -71.63 -36.14 70.66 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.869 0.366 . . . . 22.280000000000001 111.24 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 90.38 27.15 21.31 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.737 -0.744 . . . . 19.93 112.494 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . 0.422 ' HA ' ' O ' ' A' ' 136' ' ' ILE . 86.3 m-85 -132.32 142.81 49.49 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.569 0.223 . . . . 20.300000000000001 110.764 179.839 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.579 ' HB ' ' HB ' ' A' ' 136' ' ' ILE . 41.5 mt -114.47 126.28 71.97 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-O 120.923 0.392 . . . . 19.370000000000001 111.268 179.893 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 26.8 p -116.05 156.12 47.19 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 115.94 -0.573 . . . . 22.489999999999998 110.555 179.794 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_exo -41.63 -36.33 3.1 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 122.448 2.099 . . . . 23.0 112.464 -179.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.416 ' O ' ' HG3' ' A' ' 106' ' ' ARG . . . -64.89 -49.98 68.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.08 0.467 . . . . 24.559999999999999 110.591 179.554 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.582 ' HB3' ' CZ ' ' A' ' 94' ' ' ARG . 38.1 mt-10 -63.24 -50.25 70.94 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.935 -0.575 . . . . 22.23 110.677 179.337 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.626 HD23 ' HB ' ' A' ' 121' ' ' ILE . 48.0 tp -51.55 -35.43 40.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.642 -0.708 . . . . 20.359999999999999 111.799 -179.081 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.448 ' HG3' ' N ' ' A' ' 107' ' ' PHE . 0.1 OUTLIER -76.28 -32.15 58.65 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.91 0.386 . . . . 27.190000000000001 110.551 -179.677 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . 0.448 ' N ' ' HG3' ' A' ' 106' ' ' ARG . 85.5 t80 -72.62 -34.75 67.57 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.901 -0.591 . . . . 25.359999999999999 111.732 -179.883 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.487 HG13 ' N ' ' A' ' 109' ' ' MET . 7.3 p -77.86 -47.0 26.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 N-CA-C 112.011 0.374 . . . . 21.059999999999999 112.011 -179.203 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.487 ' N ' HG13 ' A' ' 108' ' ' VAL . 0.2 OUTLIER -51.6 -36.99 47.89 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.724 0.297 . . . . 20.93 111.533 -179.321 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.428 HG13 ' O ' ' A' ' 106' ' ' ARG . 75.7 mt -69.47 -26.8 32.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.349 -0.387 . . . . 25.129999999999999 111.082 -179.827 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -73.29 -41.14 63.94 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.195 -0.457 . . . . 23.32 110.619 179.635 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 9.2 mp -63.5 -44.37 94.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.914 -0.585 . . . . 21.07 110.945 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 133.6 1.88 3.72 Favored Glycine 0 C--N 1.331 0.286 0 C-N-CA 120.688 -0.768 . . . . 23.050000000000001 112.753 179.562 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -103.16 115.38 30.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.784 0.326 . . . . 22.59 111.291 -179.637 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -76.09 128.52 35.15 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.196 -0.456 . . . . 27.960000000000001 110.256 179.434 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . 0.466 ' HB ' HG23 ' A' ' 121' ' ' ILE . 3.1 m -142.36 155.6 18.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 121.18 0.514 . . . . 24.75 111.802 -179.474 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . 0.456 ' O ' HG12 ' A' ' 121' ' ' ILE . 43.0 p -103.44 147.49 27.07 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.472 -0.785 . . . . 27.239999999999998 110.208 179.646 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -51.95 -19.69 1.94 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.241 -0.436 . . . . 26.629999999999999 111.519 -179.635 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -77.9 -54.92 5.76 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.523 -0.308 . . . . 29.140000000000001 111.704 -179.535 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.431 ' OE1' HG12 ' A' ' 116' ' ' VAL . 14.6 pt-20 -63.17 -39.57 95.03 Favored 'General case' 0 C--N 1.332 -0.196 0 N-CA-C 112.034 0.383 . . . . 24.190000000000001 112.034 -179.182 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.626 ' HB ' HD23 ' A' ' 105' ' ' LEU . 15.2 pt -71.63 -40.28 70.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 C-N-CA 121.022 -0.271 . . . . 22.329999999999998 111.63 -179.485 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.532 ' N ' HG13 ' A' ' 121' ' ' ILE . 15.4 t70 -57.79 -43.13 85.43 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.741 0.305 . . . . 24.289999999999999 110.538 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -63.0 -43.7 98.07 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.07 -0.514 . . . . 24.739999999999998 110.171 179.415 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.455 ' HE3' HD21 ' A' ' 105' ' ' LEU . 56.0 ttp -57.15 -33.89 67.87 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.002 -0.545 . . . . 19.710000000000001 110.362 179.148 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.653 HG23 HD11 ' A' ' 136' ' ' ILE . 97.3 mt -67.36 -43.72 87.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.815 -0.629 . . . . 19.949999999999999 110.533 179.638 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 32.3 ttm180 -60.3 -32.6 71.37 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.937 -0.574 . . . . 24.949999999999999 110.801 179.593 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -63.67 -29.73 70.93 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.13 -0.487 . . . . 18.690000000000001 111.278 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.686 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -104.28 -15.37 15.49 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.3 -0.409 . . . . 16.469999999999999 111.329 -179.86 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -93.98 103.53 15.61 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.108 -0.496 . . . . 20.399999999999999 110.771 -179.666 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -96.52 -31.09 12.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.883 -0.599 . . . . 21.43 111.32 -179.427 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -70.69 -15.85 62.75 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.389 -0.369 . . . . 23.370000000000001 110.74 179.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 58.88 85.29 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 121.024 -0.607 . . . . 24.32 112.946 179.557 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -152.21 1.98 0.34 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.684 0.278 . . . . 23.879999999999999 111.073 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 69.28 20.85 75.5 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.81 -0.709 . . . . 22.670000000000002 112.753 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 82.1 mmm -135.12 155.04 51.4 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.591 0.234 . . . . 22.91 110.523 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.674 HG23 ' HB2' ' A' ' 140' ' ' GLU . 46.4 mm -116.79 143.81 26.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 121.093 0.473 . . . . 18.41 111.491 179.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . 0.404 ' C ' ' N ' ' A' ' 139' ' ' GLU . 30.2 m-20 -114.41 156.67 24.07 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.267 -0.878 . . . . 16.82 108.711 178.465 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.686 ' O ' HG23 ' A' ' 142' ' ' VAL . 16.9 t80 -42.65 -23.47 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.673 0.273 . . . . 14.65 111.151 179.823 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.404 ' N ' ' C ' ' A' ' 137' ' ' ASN . 12.0 mm-40 -80.52 -56.03 4.46 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 120.904 0.383 . . . . 14.82 110.831 -179.799 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.674 ' HB2' HG23 ' A' ' 136' ' ' ILE . 29.6 mt-10 -57.96 -27.26 63.26 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.139 -0.482 . . . . 17.460000000000001 110.121 179.616 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.585 ' HA ' ' HE2' ' A' ' 144' ' ' MET . 90.3 t80 -70.4 -55.71 8.41 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.746 -0.661 . . . . 12.93 110.035 179.435 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.686 HG23 ' O ' ' A' ' 138' ' ' TYR . 55.1 t -46.03 -36.91 2.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 115.781 -0.645 . . . . 10.699999999999999 111.507 178.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 79.5 t90 -71.81 -55.5 7.47 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 112.563 0.579 . . . . 13.66 112.563 -178.809 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . 0.686 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 20.8 ptt? -64.28 -22.63 67.02 Favored 'General case' 0 N--CA 1.463 0.203 0 N-CA-C 112.921 0.711 . . . . 14.5 112.921 -177.637 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . 0.694 ' HA ' ' HB2' ' A' ' 148' ' ' LYS . 28.3 pt -80.55 -42.58 21.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 C-N-CA 120.702 -0.399 . . . . 11.25 111.416 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . 0.469 ' N ' HG13 ' A' ' 145' ' ' ILE . 82.3 p -65.04 -14.15 59.7 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.519 0.676 . . . . 8.5399999999999991 109.421 179.235 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 -125.94 19.5 7.76 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 114.839 -1.073 . . . . 11.869999999999999 110.066 -179.589 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . 0.694 ' HB2' ' HA ' ' A' ' 145' ' ' ILE . 24.1 ttpp . . . . . 0 C--O 1.25 1.107 0 CA-C-O 118.296 -0.859 . . . . 13.68 110.898 -179.618 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 149' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 151' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 57.9 m . . . . . 0 N--CA 1.485 1.313 0 CA-C-O 120.839 0.352 . . . . 4.8899999999999997 110.892 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -163.81 118.69 1.57 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 3.2599999999999998 111.034 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 51.3 mt -63.49 118.02 7.55 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.031 -0.531 . . . . 1.27 111.105 -179.678 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -98.07 165.16 12.03 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.205 -0.452 . . . . 1.1200000000000001 110.838 179.822 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -51.59 -39.05 57.21 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.797 0.332 . . . . 2.2000000000000002 111.51 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.444 ' HG3' ' N ' ' A' ' 8' ' ' GLN . 11.6 pt-20 -72.08 -46.7 55.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.278 -0.419 . . . . 1.3500000000000001 111.075 -179.406 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.444 ' N ' ' HG3' ' A' ' 7' ' ' GLU . 96.7 mt-30 -61.04 -42.55 98.69 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.885 -0.598 . . . . 2.2200000000000002 110.945 -179.812 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.483 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 77.1 mt -59.29 -51.94 66.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.951 -0.568 . . . . 0.54000000000000004 110.893 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.0 -26.8 67.86 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.12 -0.491 . . . . 0.5 111.654 -179.718 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -69.45 -56.72 6.61 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 112.155 0.428 . . . . 2.27 112.155 -178.834 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.483 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 8.5 p90 -77.89 -25.03 48.29 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 120.466 -0.494 . . . . 0.37 110.908 -179.544 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.457 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 41.6 tptt -64.45 -34.12 77.47 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 108.969 -0.752 . . . . 1.23 108.969 178.707 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -70.12 -48.95 55.35 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 108.697 -0.853 . . . . 0.44 108.697 177.689 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.84 -14.06 41.26 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.268 -0.878 . . . . 0.28999999999999998 110.355 178.697 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.457 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 31.2 t80 -80.04 -54.04 6.16 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.809 -0.632 . . . . 0.47999999999999998 111.0 -179.501 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 15.6 m -62.25 -22.73 30.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 121.105 0.479 . . . . 1.1100000000000001 110.334 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 75.6 mm-40 -61.09 -32.41 72.07 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.624 -0.716 . . . . 1.6000000000000001 111.543 179.597 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 99.7 m-85 -101.97 33.89 2.88 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.741 0.305 . . . . 0.64000000000000001 111.631 -179.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -125.64 75.5 1.49 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.042 0.449 . . . . 0.44 110.425 179.32 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 41.1 tptt -87.01 -33.85 19.43 Favored 'General case' 0 N--CA 1.436 -1.129 0 CA-C-N 115.824 -0.625 . . . . 2.1000000000000001 110.925 -179.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -63.24 -15.68 57.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.102 -0.499 . . . . 1.8 111.384 -179.52 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.48 10.7 84.6 Favored Glycine 0 C--N 1.331 0.264 0 C-N-CA 120.832 -0.699 . . . . 0.46000000000000002 112.833 179.553 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 20.3 p -86.9 15.35 5.98 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.637 0.256 . . . . 0.40000000000000002 111.213 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 53.35 26.39 29.57 Favored Glycine 0 C--N 1.333 0.388 0 C-N-CA 120.851 -0.69 . . . . 0.33000000000000002 112.234 -179.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.474 ' C ' HE22 ' A' ' 62' ' ' GLN . 31.5 mtmm -135.0 156.57 48.82 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.822 0.344 . . . . 1.1000000000000001 111.054 -179.646 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.616 HG13 ' HB2' ' A' ' 63' ' ' LEU . 23.8 pt -114.11 126.02 71.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 121.115 0.483 . . . . 0.5 111.468 -179.649 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -54.49 138.17 41.07 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.861 -0.609 . . . . 0.29999999999999999 111.213 179.707 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 9.4 t -68.31 -9.44 47.75 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.061 -0.518 . . . . 1.03 111.382 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.421 ' HD3' ' N ' ' A' ' 30' ' ' ARG . 0.0 OUTLIER -87.13 -14.14 42.15 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.256 -0.429 . . . . 3.0800000000000001 110.681 179.902 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -108.19 -0.28 21.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.093 -0.503 . . . . 2.2599999999999998 110.632 179.768 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.447 HD22 ' HA ' ' A' ' 32' ' ' LEU . 1.0 OUTLIER -60.08 -46.08 90.77 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.072 -0.513 . . . . 1.3700000000000001 109.972 179.665 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.589 ' HA2' HD11 ' A' ' 48' ' ' LEU . . . -56.89 -36.8 74.8 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.507 -0.854 . . . . 0.32000000000000001 111.277 179.051 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 87.6 m -70.54 -32.5 69.98 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.007 0.432 . . . . 0.31 110.027 179.047 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.46 ' O ' ' HG ' ' A' ' 39' ' ' LEU . 1.2 tt -65.48 -35.47 80.98 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.679 -0.691 . . . . 1.24 110.165 179.68 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.571 ' HG3' ' HG3' ' A' ' 43' ' ' PRO . 21.7 mmt -69.52 -42.17 75.03 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.215 -0.448 . . . . 1.1000000000000001 110.482 179.301 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 62.7 mtp180 -53.19 -51.65 61.39 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.617 -0.719 . . . . 2.6899999999999999 111.403 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 10.2 t -62.99 -12.78 28.1 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.433 -0.349 . . . . 1.0600000000000001 111.538 -179.785 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.46 ' HG ' ' O ' ' A' ' 35' ' ' LEU . 47.1 mt -113.06 156.65 22.75 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.364 -0.38 . . . . 1.26 110.708 -179.827 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -76.88 39.89 1.6 Allowed Glycine 0 CA--C 1.52 0.357 0 C-N-CA 120.88 -0.676 . . . . 0.68999999999999995 113.912 -178.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 67.2 mm-40 -94.3 -59.98 1.83 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 117.148 0.474 . . . . 1.97 110.745 179.034 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.567 HD22 ' N ' ' A' ' 42' ' ' ASN . 0.8 OUTLIER 57.15 66.28 3.17 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.132 -0.486 . . . . 2.6600000000000001 111.088 179.965 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.571 ' HG3' ' HG3' ' A' ' 36' ' ' MET . 43.5 Cg_endo -67.42 167.95 19.26 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.593 2.195 . . . . 0.51000000000000001 112.117 179.723 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 20.6 m -74.43 150.09 40.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.184 -0.462 . . . . 0.72999999999999998 110.511 179.654 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -54.76 -48.01 73.17 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.654 0.264 . . . . 2.7000000000000002 111.434 -179.716 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.81 -47.19 81.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.375 -0.375 . . . . 0.46000000000000002 111.498 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.451 ' O ' HD23 ' A' ' 51' ' ' LEU . 10.0 tp10 -56.46 -48.79 76.33 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.03 0.443 . . . . 2.23 110.48 -179.554 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.589 HD11 ' HA2' ' A' ' 33' ' ' GLY . 33.4 tp -57.45 -41.24 80.16 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.555 -0.748 . . . . 1.3600000000000001 110.938 -179.759 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 67.8 mt-30 -72.17 -25.95 61.88 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.058 -0.519 . . . . 1.22 111.212 -179.595 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -71.12 -55.05 9.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.483 -0.326 . . . . 0.62 111.565 -179.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.451 HD23 ' O ' ' A' ' 47' ' ' GLU . 0.9 OUTLIER -64.9 -38.8 92.16 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.459 -0.337 . . . . 0.39000000000000001 111.844 -179.226 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 94.5 mt -65.5 -48.37 83.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.841 0.353 . . . . 0.5 110.837 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.92 -26.33 66.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.192 -0.458 . . . . 0.58999999999999997 110.745 179.635 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -69.79 -53.98 15.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.991 -0.549 . . . . 2.54 110.416 179.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -72.7 -14.3 61.54 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.996 -0.547 . . . . 0.53000000000000003 111.176 179.735 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -55.53 -30.61 61.02 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.097 -0.501 . . . . 1.95 111.406 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -118.57 -33.23 4.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.506 -0.316 . . . . 2.48 111.337 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -69.58 -34.64 74.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.412 -0.358 . . . . 2.48 111.133 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . 0.453 ' O ' ' HB2' ' A' ' 60' ' ' ASN . 13.5 m120 -114.7 6.25 15.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.315 -0.402 . . . . 2.0499999999999998 111.246 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . 0.453 ' HB2' ' O ' ' A' ' 59' ' ' ASN . 39.6 m-80 74.0 -49.66 0.68 Allowed 'General case' 0 N--CA 1.466 0.375 0 O-C-N 123.607 0.567 . . . . 1.47 111.527 -179.867 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 169.43 7.52 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.598 -0.81 . . . . 0.42999999999999999 112.992 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.474 HE22 ' C ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -124.66 155.03 39.85 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.995 0.426 . . . . 0.38 111.284 179.837 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.616 ' HB2' HG13 ' A' ' 27' ' ' ILE . 27.3 mt -129.28 156.56 43.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.867 -0.606 . . . . 1.4299999999999999 110.854 -179.79 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . 0.421 ' H ' ' CG ' ' A' ' 67' ' ' GLU . 44.3 m-80 -112.34 157.26 21.21 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.526 -0.307 . . . . 1.1899999999999999 110.493 179.902 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.473 ' O ' ' HB2' ' A' ' 69' ' ' CYS . 87.8 t80 -43.06 -38.46 2.34 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.986 -0.552 . . . . 0.40000000000000002 110.654 179.589 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -72.81 -37.71 67.44 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.063 -0.517 . . . . 0.81000000000000005 111.922 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.421 ' CG ' ' H ' ' A' ' 64' ' ' ASN . 20.6 mm-40 -59.65 -49.97 75.69 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.179 0.514 . . . . 1.3600000000000001 109.918 179.562 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.466 ' HE2' ' HB2' ' A' ' 12' ' ' PHE . 34.2 t80 -68.5 -53.7 21.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.525 -0.761 . . . . 0.51000000000000001 110.839 179.763 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.473 ' HB2' ' O ' ' A' ' 65' ' ' PHE . 1.8 t -51.52 -41.02 60.74 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-O 120.971 0.415 . . . . 0.75 110.267 179.667 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -56.94 -50.38 64.45 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.864 -0.684 . . . . 0.40999999999999998 111.526 179.577 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.453 ' HA ' ' HE2' ' A' ' 74' ' ' LYS . 11.4 mt -62.38 -36.69 76.02 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.407 0 CA-C-O 120.88 0.372 . . . . 0.51000000000000001 110.852 179.344 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . 0.406 ' HG2' ' O ' ' A' ' 68' ' ' PHE . 95.0 mmm -59.2 -41.34 88.32 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.153 0.501 . . . . 1.01 109.679 179.104 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -55.93 -52.7 63.19 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.463 -0.79 . . . . 0.69999999999999996 110.659 178.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.453 ' HE2' ' HA ' ' A' ' 71' ' ' ILE . 55.3 pttt -68.7 -30.52 69.2 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.287 -0.415 . . . . 1.3799999999999999 111.15 -179.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . 0.491 ' NE2' ' HB3' ' A' ' 43' ' ' PRO . 5.1 tp-100 -68.64 -45.61 71.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.92 0.39 . . . . 1.98 110.884 179.624 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 45.1 mtt -58.92 -43.78 91.19 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 115.861 -0.609 . . . . 1.2 111.022 -179.744 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 76.6 mtp180 -79.29 -18.86 51.83 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.125 -0.489 . . . . 4.6900000000000004 111.051 179.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -64.92 -46.13 82.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.3 -0.409 . . . . 4.0099999999999998 111.215 -179.629 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.482 HG22 ' N ' ' A' ' 80' ' ' ASP . 94.5 m -83.76 -99.84 0.05 Allowed 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 116.381 -0.372 . . . . 5.2800000000000002 111.497 -179.396 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . 0.482 ' N ' HG22 ' A' ' 79' ' ' THR . 3.2 p30 175.31 17.75 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 117.468 0.122 . . . . 5.5999999999999996 110.842 -179.392 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.532 ' O ' ' HG2' ' A' ' 85' ' ' MET . 3.0 t 37.01 69.04 0.23 Allowed 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 121.17 0.509 . . . . 7.29 111.07 -179.417 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -49.92 -18.95 0.59 Allowed 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 115.281 -0.872 . . . . 9.7400000000000002 113.112 -178.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -60.35 -56.28 23.35 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 111.854 0.316 . . . . 12.109999999999999 111.854 -179.213 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -72.73 -13.65 61.38 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.357 -0.383 . . . . 10.869999999999999 111.285 -179.455 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . 0.628 ' HB3' HG22 ' A' ' 142' ' ' VAL . 5.6 mmm -79.34 -49.28 12.66 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.468 -0.333 . . . . 11.09 110.627 -179.197 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 16.3 ttp180 -63.45 -42.23 98.65 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 116.219 -0.446 . . . . 15.52 109.912 179.586 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -60.11 -42.14 94.1 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.013 -0.539 . . . . 14.85 109.795 179.105 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -72.17 -23.23 61.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.75 -0.659 . . . . 14.109999999999999 110.597 179.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -68.95 -43.44 75.04 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.194 -0.457 . . . . 15.73 110.482 179.649 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 47.7 mtmt -68.32 -40.99 81.46 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.135 -0.484 . . . . 17.66 110.353 179.482 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 93.0 mt -64.47 -46.36 93.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.89 -0.595 . . . . 18.149999999999999 111.106 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.457 ' HA ' HG21 ' A' ' 108' ' ' VAL . 0.6 OUTLIER -65.93 -49.13 69.03 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.281 -0.418 . . . . 18.34 110.907 -179.963 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -61.06 98.63 0.08 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.28 -0.418 . . . . 19.289999999999999 110.069 179.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.43 ' HG2' ' HB3' ' A' ' 104' ' ' GLU . 18.9 mmm180 -51.7 -27.77 12.76 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.918 -0.583 . . . . 22.25 111.231 -179.414 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.423 ' HB2' ' OD1' ' A' ' 97' ' ' ASP . 4.0 m-20 -112.22 169.9 8.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.3 -0.409 . . . . 23.34 110.731 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.41 5.6 57.31 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.891 -0.671 . . . . 22.0 112.051 179.675 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.423 ' OD1' ' HB2' ' A' ' 95' ' ' ASP . 7.8 p-10 -57.43 -32.7 67.16 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.687 0.28 . . . . 22.280000000000001 111.23 -179.659 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 107.43 12.97 22.06 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.698 -0.763 . . . . 19.93 112.926 179.626 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . 0.455 ' HA ' ' O ' ' A' ' 136' ' ' ILE . 97.3 m-85 -138.69 145.26 40.14 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.834 0.349 . . . . 20.300000000000001 111.071 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 48.5 mt -115.85 137.81 48.33 Favored 'Isoleucine or valine' 0 C--O 1.232 0.148 0 CA-C-N 116.151 -0.477 . . . . 19.370000000000001 111.445 -179.726 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 28.3 p -115.84 156.31 46.65 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 115.827 -0.624 . . . . 22.489999999999998 110.606 179.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_exo -44.34 -38.01 11.0 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.396 2.064 . . . . 23.0 112.552 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -63.89 -40.05 95.6 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.055 -0.521 . . . . 24.559999999999999 111.037 179.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.526 ' O ' HG23 ' A' ' 108' ' ' VAL . 42.2 mt-10 -72.82 -41.44 64.9 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.473 -0.785 . . . . 22.23 110.369 -179.896 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.583 HD23 ' HE1' ' A' ' 109' ' ' MET . 4.9 tp -58.05 -55.04 40.14 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.695 -0.684 . . . . 20.359999999999999 110.381 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 9.0 ttp180 -54.61 -49.78 69.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.588 -0.733 . . . . 27.190000000000001 111.573 -179.813 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 55.3 t80 -54.59 -33.8 60.93 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.203 -0.453 . . . . 25.359999999999999 111.786 -178.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.526 HG23 ' O ' ' A' ' 104' ' ' GLU . 58.3 t -79.23 -55.43 9.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 112.113 0.412 . . . . 21.059999999999999 112.113 -179.187 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.583 ' HE1' HD23 ' A' ' 105' ' ' LEU . 49.5 mtm -50.64 -41.23 55.02 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.524 0.202 . . . . 20.93 111.429 -179.278 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 88.9 mt -62.85 -32.59 56.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.928 0.394 . . . . 25.129999999999999 110.546 179.36 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 95.8 m-20 -71.46 -38.27 71.29 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.007 -0.542 . . . . 23.32 110.828 179.501 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.489 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 2.3 mt -74.66 -25.94 59.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.191 -0.459 . . . . 21.07 110.936 -179.708 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 98.23 46.87 2.12 Favored Glycine 0 N--CA 1.453 -0.23 0 C-N-CA 120.887 -0.673 . . . . 23.050000000000001 112.433 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -100.26 -27.02 13.71 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.523 0.201 . . . . 22.59 111.359 -179.684 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 13.4 mmmm 52.3 85.97 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.327 -0.397 . . . . 27.960000000000001 110.809 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . 0.457 HG21 ' SD ' ' A' ' 109' ' ' MET . 2.8 m -129.44 155.38 41.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.122 -0.49 . . . . 24.75 111.824 -179.514 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 59.2 p -95.87 146.71 24.35 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.798 -0.637 . . . . 27.239999999999998 109.864 178.608 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -55.54 -15.85 3.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.476 -0.329 . . . . 26.629999999999999 111.618 -179.453 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -79.21 -55.22 5.26 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.498 -0.319 . . . . 29.140000000000001 111.612 -179.573 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.413 ' OE1' HG12 ' A' ' 116' ' ' VAL . 13.3 pt-20 -62.03 -37.34 84.54 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 111.824 0.305 . . . . 24.190000000000001 111.824 -179.347 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.549 ' HB ' HD23 ' A' ' 105' ' ' LEU . 33.3 pt -74.89 -38.19 43.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 N-CA-C 111.887 0.329 . . . . 22.329999999999998 111.887 -179.06 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.504 ' N ' HG13 ' A' ' 121' ' ' ILE . 18.0 t70 -62.33 -43.94 97.66 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.872 0.367 . . . . 24.289999999999999 110.561 179.753 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -62.55 -43.03 99.83 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.03 -0.532 . . . . 24.739999999999998 110.565 179.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 45.4 ttp -56.41 -36.95 69.51 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.063 -0.517 . . . . 19.710000000000001 110.651 179.389 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.644 HG23 HD11 ' A' ' 136' ' ' ILE . 71.9 mt -65.24 -43.05 95.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.045 -0.525 . . . . 19.949999999999999 110.514 179.751 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 69.9 ttt180 -59.4 -37.92 79.25 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.815 -0.63 . . . . 24.949999999999999 111.046 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -70.92 -24.48 62.47 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.202 -0.454 . . . . 18.690000000000001 111.315 -179.635 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.577 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -98.94 -12.77 20.37 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.309 -0.405 . . . . 16.469999999999999 111.272 -179.831 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 62.1 t0 -103.32 96.45 6.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.204 -0.453 . . . . 20.399999999999999 110.935 -179.553 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -66.38 -54.05 28.88 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.896 -0.593 . . . . 21.43 111.128 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -61.14 -19.3 61.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.153 -0.476 . . . . 23.370000000000001 111.042 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 52.16 77.38 0.14 Allowed Glycine 0 N--CA 1.453 -0.186 0 C-N-CA 120.904 -0.665 . . . . 24.32 112.753 179.718 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -128.75 -0.3 5.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.825 0.345 . . . . 23.879999999999999 110.667 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 80.74 19.66 67.56 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.9 -0.667 . . . . 22.670000000000002 112.617 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 38.2 mtp -139.33 149.33 44.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.65 0.262 . . . . 22.91 110.419 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.723 HG23 ' HB2' ' A' ' 140' ' ' GLU . 47.4 mm -116.62 142.3 30.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 121.254 0.549 . . . . 18.41 111.95 -179.408 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . 0.543 ' ND2' ' HB2' ' A' ' 139' ' ' GLU . 1.2 p-10 -114.94 158.75 21.58 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.159 -0.928 . . . . 16.82 109.239 178.647 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.699 ' O ' HG23 ' A' ' 142' ' ' VAL . 11.8 t80 -37.72 -27.56 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 112.481 0.549 . . . . 14.65 112.481 -179.067 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.543 ' HB2' ' ND2' ' A' ' 137' ' ' ASN . 43.3 mt-10 -80.54 -55.73 4.66 Favored 'General case' 0 C--N 1.328 -0.327 0 O-C-N 122.155 -0.34 . . . . 14.82 111.236 -179.328 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.723 ' HB2' HG23 ' A' ' 136' ' ' ILE . 71.4 mt-10 -59.15 -29.76 67.66 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.228 -0.442 . . . . 17.460000000000001 110.504 179.819 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.536 ' CE2' HD13 ' A' ' 145' ' ' ILE . 78.7 t80 -70.23 -55.61 8.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.821 -0.627 . . . . 12.93 110.575 179.715 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.699 HG23 ' O ' ' A' ' 138' ' ' TYR . 53.7 t -48.25 -35.86 5.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 115.917 -0.583 . . . . 10.699999999999999 111.972 179.728 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' TRP . . . . . 0.487 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 91.4 t90 -72.23 -56.06 6.16 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.469 0.544 . . . . 13.66 112.469 -179.018 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . 0.694 ' HE2' HG21 ' A' ' 136' ' ' ILE . 18.2 ptt? -61.35 -25.76 67.37 Favored 'General case' 0 N--CA 1.464 0.244 0 N-CA-C 112.93 0.715 . . . . 14.5 112.93 -177.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . 0.561 HD11 ' HB3' ' A' ' 85' ' ' MET . 45.6 pt -80.48 -40.78 19.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 112.022 0.378 . . . . 11.25 112.022 -179.559 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . 0.546 ' N ' HG13 ' A' ' 145' ' ' ILE . 22.6 t -59.7 -14.49 14.34 Favored 'General case' 0 CA--C 1.519 -0.25 0 CA-C-O 121.45 0.643 . . . . 8.5399999999999991 109.841 -179.804 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 147' ' ' GLN . . . . . 0.487 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 2.6 mm-40 -114.63 -15.54 11.95 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.887 -1.051 . . . . 11.869999999999999 110.242 -179.579 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.312 -0.851 . . . . 13.68 110.904 179.822 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 149' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 151' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 66.4 m . . . . . 0 N--CA 1.485 1.283 0 CA-C-O 120.658 0.266 . . . . 4.8899999999999997 110.929 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 28.7 mm-40 65.19 136.07 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 115.958 -0.564 . . . . 3.2599999999999998 111.337 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.552 HD13 ' SG ' ' A' ' 69' ' ' CYS . 31.3 mt -76.86 82.92 3.43 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.106 -0.497 . . . . 1.27 110.925 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 76.3 p -70.34 -167.84 0.2 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.259 -0.428 . . . . 1.1200000000000001 111.057 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.426 ' HG3' ' N ' ' A' ' 7' ' ' GLU . 10.0 pt-20 -72.64 -40.46 66.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.908 0.385 . . . . 2.2000000000000002 110.505 -179.91 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.426 ' N ' ' HG3' ' A' ' 6' ' ' GLU . 9.4 pt-20 -74.18 -39.05 63.46 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.936 -0.574 . . . . 1.3500000000000001 110.515 179.733 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -65.13 -48.99 71.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.905 -0.588 . . . . 2.2200000000000002 110.64 179.721 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.53 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 61.9 mt -55.8 -50.59 67.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.389 -0.369 . . . . 0.54000000000000004 110.705 179.829 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.61 -23.11 66.13 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.163 -0.472 . . . . 0.5 111.255 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -69.71 -56.35 7.45 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.295 -0.412 . . . . 2.27 111.828 -179.108 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.53 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 12.3 p90 -78.22 -25.47 46.99 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 120.586 -0.446 . . . . 0.37 110.879 -179.775 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.471 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 20.0 tptm -63.32 -36.23 83.02 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 108.989 -0.745 . . . . 1.23 108.989 178.484 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.463 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 15.7 t70 -68.44 -51.98 37.75 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 108.825 -0.806 . . . . 0.44 108.825 177.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.34 -13.81 22.31 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.399 -0.819 . . . . 0.28999999999999998 110.568 179.069 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.471 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 55.0 t80 -79.43 -51.45 9.35 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.886 -0.597 . . . . 0.47999999999999998 110.597 -179.697 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.442 HG22 ' O ' ' A' ' 14' ' ' ASP . 26.9 m -65.36 -18.92 24.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 121.003 0.43 . . . . 1.1100000000000001 110.294 179.913 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.463 ' HG2' ' O ' ' A' ' 14' ' ' ASP . 29.2 mm-40 -63.2 -29.62 70.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.648 -0.705 . . . . 1.6000000000000001 111.719 179.483 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -105.87 27.1 8.85 Favored 'General case' 0 N--CA 1.463 0.217 0 N-CA-C 112.04 0.385 . . . . 0.64000000000000001 112.04 -179.185 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -113.94 86.74 2.47 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.988 0.423 . . . . 0.44 110.589 179.217 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.546 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -94.85 -38.01 10.94 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.917 -0.583 . . . . 2.1000000000000001 111.438 -179.599 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -56.8 -24.59 51.73 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.307 -0.406 . . . . 1.8 111.477 -179.583 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 87.28 1.92 83.56 Favored Glycine 0 C--N 1.33 0.209 0 C-N-CA 120.793 -0.717 . . . . 0.46000000000000002 112.88 179.62 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 26.8 p -82.35 16.07 2.2 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.688 0.28 . . . . 0.40000000000000002 111.195 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 54.93 25.55 38.17 Favored Glycine 0 C--N 1.331 0.299 0 C-N-CA 120.721 -0.752 . . . . 0.33000000000000002 111.766 -179.539 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.503 ' C ' HE22 ' A' ' 62' ' ' GLN . 35.4 mtmm -132.38 156.61 46.34 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.842 0.353 . . . . 1.1000000000000001 111.067 -179.382 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.711 HG13 ' HB2' ' A' ' 63' ' ' LEU . 31.1 pt -114.33 124.94 71.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 121.001 0.429 . . . . 0.5 111.341 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -51.2 141.19 15.05 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.063 -0.517 . . . . 0.29999999999999999 111.416 179.736 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 8.3 t -65.91 -11.84 50.13 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.94 -0.573 . . . . 1.03 111.313 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.459 ' HD2' ' N ' ' A' ' 30' ' ' ARG . 2.5 mpt_? -90.76 5.25 49.05 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.971 0.415 . . . . 3.0800000000000001 110.492 179.777 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -120.86 -9.43 9.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.923 -0.58 . . . . 2.2599999999999998 110.788 -179.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.521 HD22 HD11 ' A' ' 51' ' ' LEU . 7.9 tt -53.25 -52.46 58.92 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.317 -0.401 . . . . 1.3700000000000001 110.747 179.671 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.482 ' HA2' HD11 ' A' ' 48' ' ' LEU . . . -54.3 -48.01 65.97 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.427 -0.892 . . . . 0.32000000000000001 111.602 179.551 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 30.2 m -58.3 -29.25 65.71 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 121.423 0.63 . . . . 0.31 109.643 178.688 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.475 ' O ' HG22 ' A' ' 38' ' ' THR . 1.2 tt -72.67 -35.07 67.62 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.163 -0.926 . . . . 1.24 109.905 179.391 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.557 ' SD ' ' HG3' ' A' ' 43' ' ' PRO . 7.4 mtp -76.92 -16.9 59.23 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.976 -0.556 . . . . 1.1000000000000001 110.297 179.89 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -80.63 -41.78 23.3 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.977 -0.556 . . . . 2.6899999999999999 110.302 179.049 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.475 HG22 ' O ' ' A' ' 35' ' ' LEU . 10.4 t -67.32 -12.44 60.16 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.991 -0.55 . . . . 1.0600000000000001 110.769 179.568 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 26.4 mt -112.28 155.53 23.9 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.918 -0.583 . . . . 1.26 110.136 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -72.42 16.83 1.62 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.834 -0.698 . . . . 0.68999999999999995 113.462 -179.272 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 85.1 mm-40 -68.09 -63.2 1.11 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.907 0.384 . . . . 1.97 110.932 179.602 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 69.7 m-20 55.57 70.77 1.43 Allowed Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 115.936 -0.574 . . . . 2.6600000000000001 111.061 -179.707 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.557 ' HG3' ' SD ' ' A' ' 36' ' ' MET . 57.5 Cg_endo -67.97 -167.78 0.18 Allowed 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.87 2.38 . . . . 0.51000000000000001 112.307 179.645 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 41.1 m -100.17 144.23 29.44 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.036 -0.529 . . . . 0.72999999999999998 110.489 179.45 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -48.99 -55.14 12.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.742 0.306 . . . . 2.7000000000000002 111.364 -179.442 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -54.49 -48.24 72.09 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.204 -0.453 . . . . 0.46000000000000002 111.622 -179.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.452 ' HG2' HD23 ' A' ' 51' ' ' LEU . 37.8 tt0 -56.4 -47.29 79.27 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.813 0.339 . . . . 2.23 110.651 -179.778 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.482 HD11 ' HA2' ' A' ' 33' ' ' GLY . 13.9 tp -58.83 -41.88 87.92 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.936 -0.575 . . . . 1.3600000000000001 111.112 -179.764 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 82.8 mm-40 -71.12 -31.76 68.15 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.249 -0.432 . . . . 1.22 111.759 -179.384 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.465 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 28.8 m-20 -74.07 -55.88 5.58 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 111.919 0.34 . . . . 0.62 111.919 -179.199 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.521 HD11 HD22 ' A' ' 32' ' ' LEU . 3.1 pp -59.51 -37.29 77.93 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.696 -0.229 . . . . 0.39000000000000001 111.285 -179.314 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 76.8 mt -69.35 -35.39 67.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.754 0.312 . . . . 0.5 110.556 179.539 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.68 -36.55 81.19 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.301 -0.409 . . . . 0.58999999999999997 110.756 179.45 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.465 ' HG2' ' O ' ' A' ' 50' ' ' ASP . 3.3 mm-40 -73.23 -50.38 22.72 Favored 'General case' 0 CA--C 1.516 -0.365 0 N-CA-C 109.623 -0.51 . . . . 2.54 109.623 179.178 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -63.12 -14.36 47.66 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.551 -0.749 . . . . 0.53000000000000003 110.975 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -57.47 -37.26 72.6 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.975 -0.557 . . . . 1.95 111.61 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 6.8 p30 -127.09 -36.95 2.12 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.597 -0.274 . . . . 2.48 111.563 -179.416 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 19.9 m120 -62.0 -15.53 44.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.557 -0.292 . . . . 2.48 111.37 -179.777 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . 0.407 ' C ' ' H ' ' A' ' 61' ' ' GLY . 14.4 m120 -123.24 1.28 9.09 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.436 -0.347 . . . . 2.0499999999999998 110.972 179.861 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 12.5 m120 73.24 -31.24 0.22 Allowed 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.99 -0.55 . . . . 1.47 111.766 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . 0.407 ' H ' ' C ' ' A' ' 59' ' ' ASN . . . 140.5 15.5 0.49 Allowed Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.553 -0.832 . . . . 0.42999999999999999 112.738 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.503 HE22 ' C ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -138.66 151.49 47.24 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.077 0.465 . . . . 0.38 111.195 179.825 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.711 ' HB2' HG13 ' A' ' 27' ' ' ILE . 6.3 mp -119.12 150.02 40.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.627 -0.715 . . . . 1.4299999999999999 110.685 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . 0.446 ' H ' ' HB2' ' A' ' 67' ' ' GLU . 50.0 m-80 -113.94 157.67 22.12 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.961 -0.385 . . . . 1.1899999999999999 109.961 178.876 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.544 ' O ' ' HB2' ' A' ' 69' ' ' CYS . 85.3 t80 -43.68 -35.32 1.76 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.881 0.372 . . . . 0.40000000000000002 110.411 179.147 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -77.08 -37.84 53.64 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.994 -0.548 . . . . 0.81000000000000005 111.748 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.446 ' HB2' ' H ' ' A' ' 64' ' ' ASN . 10.2 mm-40 -59.64 -49.4 77.88 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.144 0.497 . . . . 1.3600000000000001 110.016 179.486 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.487 ' HE2' ' HB2' ' A' ' 12' ' ' PHE . 28.5 t80 -69.08 -52.85 24.2 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.548 -0.751 . . . . 0.51000000000000001 111.087 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.552 ' SG ' HD13 ' A' ' 4' ' ' LEU . 1.4 t -52.44 -45.02 65.82 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 121.002 0.43 . . . . 0.75 110.311 179.788 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . 0.422 ' O ' ' HB3' ' A' ' 73' ' ' ALA . . . -54.26 -50.85 54.46 Favored Glycine 0 N--CA 1.451 -0.32 0 CA-C-N 115.644 -0.707 . . . . 0.40999999999999998 112.046 179.766 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.454 HG23 ' HE3' ' A' ' 74' ' ' LYS . 11.7 mt -62.54 -40.57 88.72 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.375 0 CA-C-O 120.973 0.416 . . . . 0.51000000000000001 110.523 179.296 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . 0.514 ' HA ' HE21 ' A' ' 75' ' ' GLN . 3.6 mtp -58.92 -22.72 60.29 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.784 -0.644 . . . . 1.01 109.998 179.43 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.422 ' HB3' ' O ' ' A' ' 70' ' ' GLY . . . -74.89 -52.23 11.82 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.03 -0.532 . . . . 0.69999999999999996 109.969 178.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.454 ' HE3' HG23 ' A' ' 71' ' ' ILE . 61.2 pttt -67.05 -24.25 65.97 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 121.08 0.467 . . . . 1.3799999999999999 110.07 179.164 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . 0.514 HE21 ' HA ' ' A' ' 72' ' ' MET . 7.7 tt0 -78.08 -49.72 13.41 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.756 -0.657 . . . . 1.98 110.593 178.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . 0.469 ' SD ' HD23 ' A' ' 4' ' ' LEU . 38.9 mtt -67.9 -13.71 62.37 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.82 -0.627 . . . . 1.2 110.84 179.744 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 23.7 tpt180 -44.11 -21.33 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.734 -0.666 . . . . 4.6900000000000004 112.196 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -51.54 -27.1 9.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.71 0.291 . . . . 4.0099999999999998 111.624 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.4 HG23 ' N ' ' A' ' 80' ' ' ASP . 9.2 t -62.32 -44.33 96.75 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.318 0.488 . . . . 5.2800000000000002 112.318 -178.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . 0.4 ' N ' HG23 ' A' ' 79' ' ' THR . 1.0 OUTLIER -80.04 -65.11 1.05 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.608 0.242 . . . . 5.5999999999999996 111.511 -179.613 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.596 ' O ' ' HG2' ' A' ' 85' ' ' MET . 91.9 m 56.67 81.66 0.13 Allowed 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.377 -0.374 . . . . 7.29 110.477 -179.296 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.435 ' HB3' ' OH ' ' A' ' 138' ' ' TYR . 32.3 mt-10 -59.27 -14.88 12.68 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 113.034 0.753 . . . . 9.7400000000000002 113.034 -178.507 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -64.61 -56.71 12.14 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 120.821 0.344 . . . . 12.109999999999999 111.66 -179.259 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -67.43 -16.55 64.29 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.134 0.492 . . . . 10.869999999999999 110.381 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . 0.596 ' HG2' ' O ' ' A' ' 81' ' ' THR . 7.1 mmm -80.36 -34.96 36.09 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.646 -0.706 . . . . 11.09 109.768 -179.702 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 17.8 ttm180 -65.82 -42.6 90.42 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.643 -0.708 . . . . 15.52 109.512 179.039 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.425 ' HA ' ' HE3' ' A' ' 90' ' ' LYS . 1.9 tm-20 -59.87 -47.43 85.77 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 109.272 -0.64 . . . . 14.85 109.272 178.62 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.79 -26.08 68.19 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.59 -0.732 . . . . 14.109999999999999 110.553 179.155 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -69.77 -38.22 76.65 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.203 -0.453 . . . . 15.73 110.229 179.481 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.425 ' HE3' ' HA ' ' A' ' 87' ' ' GLU . 9.6 mtmp? -63.09 -48.79 77.09 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.929 -0.578 . . . . 17.66 110.416 179.57 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 84.1 mt -61.21 -46.25 96.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.179 -0.464 . . . . 18.149999999999999 110.882 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.671 ' HA ' HG21 ' A' ' 108' ' ' VAL . 0.9 OUTLIER -60.43 -39.91 89.16 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.147 -0.478 . . . . 18.34 111.132 -179.871 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 36.7 t0 -72.83 95.54 1.95 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.943 0.401 . . . . 19.289999999999999 110.0 179.425 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.444 ' HG3' ' HA ' ' A' ' 104' ' ' GLU . 0.6 OUTLIER -56.75 -16.25 6.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.754 -0.657 . . . . 22.25 111.177 -179.366 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.447 ' HB2' ' OD1' ' A' ' 97' ' ' ASP . 24.2 m-20 -118.14 169.43 9.69 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.94 0.4 . . . . 23.34 110.859 179.73 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.27 5.4 57.45 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.869 -0.681 . . . . 22.0 112.342 179.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.447 ' OD1' ' HB2' ' A' ' 95' ' ' ASP . 5.7 p-10 -62.0 -41.69 98.33 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.716 0.293 . . . . 22.280000000000001 111.147 -179.758 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 117.69 10.94 8.9 Favored Glycine 0 C--N 1.332 0.335 0 C-N-CA 120.717 -0.754 . . . . 19.93 112.767 179.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -137.87 150.84 47.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.786 0.327 . . . . 20.300000000000001 110.948 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 46.6 mt -114.81 139.44 40.97 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.141 0 CA-C-N 116.253 -0.43 . . . . 19.370000000000001 111.315 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 74.2 m -114.53 156.24 44.9 Favored Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 115.894 -0.594 . . . . 22.489999999999998 110.045 179.512 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_exo -44.16 -36.3 8.71 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.304 2.003 . . . . 23.0 112.846 -179.43 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.63 -39.72 88.41 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.223 0.535 . . . . 24.559999999999999 110.884 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.491 ' O ' HG23 ' A' ' 108' ' ' VAL . 42.1 mt-10 -74.51 -44.65 50.31 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.409 -0.814 . . . . 22.23 110.202 -179.847 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.501 HD23 ' HE1' ' A' ' 109' ' ' MET . 2.8 tp -54.32 -51.66 63.98 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.232 -0.894 . . . . 20.359999999999999 110.246 179.733 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.443 ' HA ' ' HE3' ' A' ' 109' ' ' MET . 10.7 ttt85 -57.07 -55.24 37.32 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.337 -0.847 . . . . 27.190000000000001 111.633 -179.749 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 36.0 t80 -46.11 -44.35 15.6 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.102 -0.499 . . . . 25.359999999999999 112.32 -178.753 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.671 HG21 ' HA ' ' A' ' 92' ' ' PHE . 23.0 t -69.62 -54.55 18.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 N-CA-C 112.235 0.457 . . . . 21.059999999999999 112.235 -178.706 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.501 ' HE1' HD23 ' A' ' 105' ' ' LEU . 62.3 mtm -52.51 -37.38 57.31 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 120.886 0.374 . . . . 20.93 110.531 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 72.5 mt -64.88 -36.47 77.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.987 -0.552 . . . . 25.129999999999999 110.162 178.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 14.4 m120 -67.31 -34.92 78.39 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.844 -0.616 . . . . 23.32 110.504 179.448 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 69.5 mt -72.0 -40.83 68.24 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.875 -0.602 . . . . 21.07 110.825 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 129.51 -3.48 6.18 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.759 -0.734 . . . . 23.050000000000001 112.557 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -86.94 93.92 9.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.679 0.276 . . . . 22.59 110.984 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -64.7 119.34 10.38 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.274 -0.421 . . . . 27.960000000000001 110.635 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 4.8 m -137.89 154.9 29.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.992 -0.549 . . . . 24.75 111.398 -179.638 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 71.3 p -98.12 147.37 24.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.804 -0.634 . . . . 27.239999999999998 110.576 179.463 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . 0.427 ' HA ' HG12 ' A' ' 121' ' ' ILE . 21.3 m-20 -53.7 -21.42 7.04 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.23 -0.441 . . . . 26.629999999999999 111.065 -179.908 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -80.5 -50.41 10.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.257 -0.429 . . . . 29.140000000000001 111.106 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.3 -33.62 75.91 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 116.265 -0.425 . . . . 24.190000000000001 111.121 -179.483 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.453 HG13 ' N ' ' A' ' 122' ' ' ASP . 32.6 pt -79.17 -35.08 16.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.399 -0.364 . . . . 22.329999999999998 110.946 -179.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.453 ' N ' HG13 ' A' ' 121' ' ' ILE . 14.8 t70 -62.13 -32.0 72.54 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.041 0.448 . . . . 24.289999999999999 109.827 179.307 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -72.79 -47.08 49.61 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.763 -0.653 . . . . 24.739999999999998 110.203 179.278 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 49.3 ttp -55.62 -40.13 71.7 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.977 -0.556 . . . . 19.710000000000001 110.526 179.375 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.494 HD11 HD22 ' A' ' 105' ' ' LEU . 85.7 mt -65.89 -41.85 90.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.089 -0.505 . . . . 19.949999999999999 110.27 179.33 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 56.1 ttt180 -59.76 -31.96 70.14 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.697 -0.683 . . . . 24.949999999999999 110.826 179.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -77.79 -28.18 50.39 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.142 -0.481 . . . . 18.690000000000001 111.101 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.639 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -92.7 -14.13 28.44 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.17 -0.468 . . . . 16.469999999999999 111.029 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . 0.447 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 30.0 t70 -100.86 106.64 18.03 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.045 -0.525 . . . . 20.399999999999999 110.613 -179.798 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 74.1 m-85 -93.4 -41.83 9.61 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.739 -0.664 . . . . 21.43 111.499 -179.351 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -56.19 -26.17 49.82 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.417 -0.356 . . . . 23.370000000000001 111.021 -179.76 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 76.26 62.85 2.5 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.879 -0.677 . . . . 24.32 112.432 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . 0.4 ' OD2' ' HB2' ' A' ' 135' ' ' MET . 3.3 p-10 -130.35 -0.73 4.51 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.69 0.281 . . . . 23.879999999999999 111.258 -179.697 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 66.98 18.2 68.54 Favored Glycine 0 C--N 1.33 0.245 0 C-N-CA 120.814 -0.708 . . . . 22.670000000000002 112.731 179.825 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . 0.4 ' HB2' ' OD2' ' A' ' 133' ' ' ASP . 68.4 mtp -134.3 155.36 50.35 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 110.183 -0.303 . . . . 22.91 110.183 179.857 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.696 HG23 ' HB2' ' A' ' 140' ' ' GLU . 47.5 mm -114.12 145.59 19.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 121.497 0.665 . . . . 18.41 112.119 -179.089 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . 0.567 HD22 ' H ' ' A' ' 139' ' ' GLU . 6.5 t30 -118.64 158.41 25.53 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 114.901 -1.045 . . . . 16.82 108.922 178.508 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.576 ' O ' HG23 ' A' ' 142' ' ' VAL . 8.2 t80 -38.72 -26.6 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 112.009 0.374 . . . . 14.65 112.009 -179.664 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.567 ' H ' HD22 ' A' ' 137' ' ' ASN . 45.4 mt-10 -80.68 -55.85 4.55 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.774 0.321 . . . . 14.82 111.097 -179.546 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.696 ' HB2' HG23 ' A' ' 136' ' ' ILE . 27.5 mt-10 -60.87 -24.41 65.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.164 0.507 . . . . 17.460000000000001 110.214 179.712 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.594 ' HA ' ' HE2' ' A' ' 144' ' ' MET . 86.6 t80 -74.0 -55.56 5.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.556 -0.747 . . . . 12.93 110.527 179.857 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.576 HG23 ' O ' ' A' ' 138' ' ' TYR . 42.9 t -48.63 -37.0 7.9 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 CA-C-N 115.9 -0.591 . . . . 10.699999999999999 111.417 179.499 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 76.8 t90 -70.57 -55.0 9.87 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.265 0.469 . . . . 13.66 112.265 -179.165 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . 0.639 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 24.6 ptt? -65.13 -22.22 66.9 Favored 'General case' 0 N--CA 1.464 0.274 0 N-CA-C 113.339 0.866 . . . . 14.5 113.339 -177.611 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . 0.642 ' HA ' ' HB2' ' A' ' 148' ' ' LYS . 39.6 pt -80.55 -44.6 21.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 C-N-CA 120.751 -0.38 . . . . 11.25 111.833 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . 0.538 ' N ' HG13 ' A' ' 145' ' ' ILE . 78.7 p -64.29 -14.19 54.41 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-O 121.448 0.642 . . . . 8.5399999999999991 109.59 179.629 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 8.0 mm-40 -125.35 19.93 8.11 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 114.967 -1.015 . . . . 11.869999999999999 110.245 -179.417 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . 0.642 ' HB2' ' HA ' ' A' ' 145' ' ' ILE . 16.5 ttpp . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.267 -0.873 . . . . 13.68 111.069 -179.451 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 149' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 151' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.535 ' HB3' ' HB3' ' A' ' 76' ' ' MET . 47.7 t . . . . . 0 N--CA 1.485 1.323 0 CA-C-O 120.781 0.324 . . . . 4.8899999999999997 110.906 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -133.73 138.98 46.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.106 -0.497 . . . . 3.2599999999999998 110.544 -179.928 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 65.2 mt -59.14 95.49 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.209 -0.451 . . . . 1.27 110.898 -179.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.402 HG21 ' HB3' ' A' ' 147' ' ' GLN . 67.6 p -87.01 -165.55 1.32 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.242 -0.435 . . . . 1.1200000000000001 111.15 -179.92 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -73.78 -39.78 63.92 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.991 0.424 . . . . 2.2000000000000002 110.762 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -74.46 -41.13 61.32 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.827 -0.624 . . . . 1.3500000000000001 110.813 -179.665 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 -63.74 -49.39 73.2 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.164 -0.471 . . . . 2.2200000000000002 110.79 179.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.538 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 63.8 mt -55.95 -52.44 49.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.445 -0.343 . . . . 0.54000000000000004 110.882 179.76 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.86 -21.54 66.82 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.38 -0.373 . . . . 0.5 111.371 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -71.23 -56.75 5.41 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 116.441 -0.345 . . . . 2.27 111.923 -179.181 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.538 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 17.9 p90 -78.51 -26.11 45.81 Favored 'General case' 0 C--N 1.332 -0.154 0 C-N-CA 120.579 -0.448 . . . . 0.37 110.931 -179.666 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 49.9 tptt -66.15 -34.95 79.22 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.348 -0.612 . . . . 1.23 109.348 178.769 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.449 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 24.8 t70 -68.83 -50.94 45.84 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.349 -0.612 . . . . 0.44 109.349 178.489 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.58 -14.3 57.1 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.823 -0.626 . . . . 0.28999999999999998 110.445 178.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -80.09 -44.38 20.1 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.816 -0.629 . . . . 0.47999999999999998 111.016 -179.442 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.417 HG22 ' O ' ' A' ' 14' ' ' ASP . 34.2 m -73.45 -22.75 19.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.336 -0.393 . . . . 1.1100000000000001 111.021 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.449 ' HG2' ' O ' ' A' ' 14' ' ' ASP . 82.5 mm-40 -63.21 -34.16 77.05 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.137 -0.483 . . . . 1.6000000000000001 111.201 179.74 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 46.9 m-85 -86.95 -13.38 44.79 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.473 -0.331 . . . . 0.64000000000000001 111.579 -179.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -90.35 87.62 6.88 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.832 0.349 . . . . 0.44 110.596 179.777 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 70.4 mmtt -95.0 -19.78 19.91 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.078 -0.51 . . . . 2.1000000000000001 111.292 -179.605 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -78.59 -42.29 29.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.252 -0.431 . . . . 1.8 111.204 -179.669 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.95 3.94 29.77 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.649 -0.786 . . . . 0.46000000000000002 112.735 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 49.4 p -73.06 1.09 9.69 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.628 0.251 . . . . 0.40000000000000002 111.216 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 61.6 23.73 63.24 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.503 -0.856 . . . . 0.33000000000000002 111.679 -179.369 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.661 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 28.9 mtpt -133.83 155.76 49.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.817 0.341 . . . . 1.1000000000000001 111.065 -179.748 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.56 HG13 ' HB3' ' A' ' 63' ' ' LEU . 23.3 pt -117.41 131.77 69.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.108 -0.496 . . . . 0.5 111.714 -179.257 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -54.97 130.46 41.63 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.27 -0.423 . . . . 0.29999999999999999 110.974 179.599 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 81.5 p -62.68 -22.46 66.49 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.154 -0.475 . . . . 1.03 111.13 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 52.6 mtp180 -73.25 -18.03 61.27 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.087 -0.506 . . . . 3.0800000000000001 110.41 179.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -102.6 0.85 33.95 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.75 -0.659 . . . . 2.2599999999999998 110.595 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.488 HD23 HD22 ' A' ' 63' ' ' LEU . 0.5 OUTLIER -60.07 -52.44 65.36 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.939 -0.573 . . . . 1.3700000000000001 110.646 -179.818 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -54.12 -39.54 64.04 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.628 -0.796 . . . . 0.32000000000000001 111.799 179.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.408 ' O ' HG22 ' A' ' 38' ' ' THR . 60.7 m -70.04 -28.11 65.21 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.021 0.439 . . . . 0.31 110.559 179.462 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 52.4 tp -72.23 -34.41 68.3 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.66 -0.7 . . . . 1.24 111.526 -179.324 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.434 ' SD ' ' HG3' ' A' ' 43' ' ' PRO . 26.7 mtp -80.4 -29.02 37.73 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.439 -0.346 . . . . 1.1000000000000001 110.8 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 76.3 mtp180 -68.21 -41.86 80.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.269 -0.423 . . . . 2.6899999999999999 110.466 179.557 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.426 HG23 ' CD1' ' A' ' 39' ' ' LEU . 1.8 t -66.13 -13.07 59.54 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.153 -0.476 . . . . 1.0600000000000001 111.006 179.51 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.426 ' CD1' HG23 ' A' ' 38' ' ' THR . 10.5 mp -113.12 156.06 23.84 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.982 -0.553 . . . . 1.26 110.553 179.574 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -42.32 -33.48 1.38 Allowed Glycine 0 CA--C 1.52 0.378 0 C-N-CA 121.305 -0.474 . . . . 0.68999999999999995 113.817 -179.173 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 24.8 mp0 -52.52 143.7 15.06 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.883 0.373 . . . . 1.97 111.282 -179.544 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -133.43 72.75 74.45 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 115.886 -0.597 . . . . 2.6600000000000001 110.869 179.706 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.434 ' HG3' ' SD ' ' A' ' 36' ' ' MET . 28.0 Cg_endo -60.54 150.08 83.43 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.814 2.343 . . . . 0.51000000000000001 112.482 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.414 HG22 ' N ' ' A' ' 45' ' ' GLU . 9.3 m -78.61 159.92 27.83 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.191 -0.458 . . . . 0.72999999999999998 110.456 179.662 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.414 ' N ' HG22 ' A' ' 44' ' ' THR . 39.7 tt0 -59.52 -55.23 37.17 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.768 0.318 . . . . 2.7000000000000002 111.242 -179.741 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.0 -49.18 77.08 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.303 -0.408 . . . . 0.46000000000000002 111.459 -179.725 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.496 ' O ' HD23 ' A' ' 51' ' ' LEU . 42.2 tt0 -55.06 -43.95 74.31 Favored 'General case' 0 CA--C 1.518 -0.25 0 CA-C-N 116.322 -0.399 . . . . 2.23 110.086 -179.798 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.425 ' HA ' HD21 ' A' ' 51' ' ' LEU . 55.9 tp -56.55 -44.78 81.25 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.577 -0.738 . . . . 1.3600000000000001 110.806 179.765 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -70.59 -25.55 63.12 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.081 -0.509 . . . . 1.22 111.251 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -68.6 -51.54 41.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.539 -0.3 . . . . 0.62 111.39 179.904 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.496 HD23 ' O ' ' A' ' 47' ' ' GLU . 0.9 OUTLIER -70.64 -36.14 73.25 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.502 -0.317 . . . . 0.39000000000000001 111.363 -179.643 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.401 HD12 ' HG ' ' A' ' 48' ' ' LEU . 75.8 mt -65.68 -46.03 90.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.459 -0.337 . . . . 0.5 111.033 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.56 -34.45 78.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.393 -0.367 . . . . 0.58999999999999997 110.882 179.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -65.12 -47.12 78.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.136 -0.484 . . . . 2.54 110.691 179.778 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -79.0 -14.62 59.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.139 -0.482 . . . . 0.53000000000000003 111.383 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -71.33 -37.47 71.72 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.265 -0.425 . . . . 1.95 111.391 -179.556 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 30.5 p-10 -106.91 10.73 30.47 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.503 -0.317 . . . . 2.48 111.654 -179.372 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 24.0 t-20 -125.87 -11.99 6.54 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.91 0.386 . . . . 2.48 110.939 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -138.42 18.8 2.74 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.089 -0.505 . . . . 2.0499999999999998 110.599 179.764 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 21.6 m-80 64.6 -80.26 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 115.672 -0.694 . . . . 1.47 111.544 179.666 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -153.93 4.1 0.29 Allowed Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.502 -0.856 . . . . 0.42999999999999999 112.681 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.661 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -118.46 155.3 31.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.011 0.434 . . . . 0.38 111.271 179.88 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.658 ' HG ' ' HB2' ' A' ' 67' ' ' GLU . 2.4 tp -126.64 155.21 42.92 Favored 'General case' 0 C--O 1.223 -0.304 0 CA-C-N 115.778 -0.647 . . . . 1.4299999999999999 110.554 -179.389 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . 0.477 ' OD1' ' HE3' ' A' ' 26' ' ' LYS . 0.7 OUTLIER -110.43 155.58 22.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.893 0.377 . . . . 1.1899999999999999 111.3 -179.113 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 82.0 t80 -44.93 -46.07 10.79 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.618 -0.719 . . . . 0.40000000000000002 111.424 179.869 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -64.3 -33.89 76.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.433 -0.349 . . . . 0.81000000000000005 111.926 -179.594 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.658 ' HB2' ' HG ' ' A' ' 63' ' ' LEU . 12.3 mm-40 -63.18 -55.84 21.73 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.778 0.323 . . . . 1.3600000000000001 110.446 179.901 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.466 ' HE2' ' HB2' ' A' ' 12' ' ' PHE . 41.6 t80 -59.93 -49.36 77.99 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.262 -0.426 . . . . 0.51000000000000001 110.337 179.142 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 1.7 t -53.22 -45.25 68.61 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.131 -0.486 . . . . 0.75 110.305 179.548 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -51.5 -47.14 52.24 Favored Glycine 0 N--CA 1.448 -0.512 0 N-CA-C 111.103 -0.799 . . . . 0.40999999999999998 111.103 179.135 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.528 HG23 ' HE3' ' A' ' 74' ' ' LYS . 14.1 mt -63.96 -40.99 91.05 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.45 0 CA-C-O 120.851 0.358 . . . . 0.51000000000000001 110.664 179.104 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . 0.431 ' HG2' ' O ' ' A' ' 68' ' ' PHE . 95.3 mmm -51.82 -41.76 61.99 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.986 -0.552 . . . . 1.01 109.659 179.346 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.84 -55.35 35.26 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.561 -0.745 . . . . 0.69999999999999996 110.938 179.12 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.528 ' HE3' HG23 ' A' ' 71' ' ' ILE . 21.8 pttp -64.15 -25.95 68.31 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.422 -0.354 . . . . 1.3799999999999999 111.715 -179.411 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -81.92 -33.7 30.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.352 0.596 . . . . 1.98 110.55 -179.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . 0.535 ' HB3' ' HB3' ' A' ' 2' ' ' SER . 54.7 mtt -74.12 -19.45 60.57 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.055 -0.975 . . . . 1.2 111.053 -179.614 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 28.9 mmt180 -54.04 -19.0 4.14 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.112 -0.495 . . . . 4.6900000000000004 111.785 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -120.8 86.53 2.59 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.843 0.354 . . . . 4.0099999999999998 111.802 -179.595 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.486 HG22 ' O ' ' A' ' 76' ' ' MET . 14.9 t -176.31 2.01 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.104 -0.498 . . . . 5.2800000000000002 110.939 179.483 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.4 p-10 -70.09 -63.51 1.07 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.129 -0.487 . . . . 5.5999999999999996 111.489 -179.762 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.588 ' O ' ' HG2' ' A' ' 85' ' ' MET . 52.7 m 58.33 91.66 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.11 0 CA-C-N 116.352 -0.385 . . . . 7.29 110.374 -179.275 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -68.44 -25.12 64.85 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 112.857 0.688 . . . . 9.7400000000000002 112.857 -178.478 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 -54.35 -55.79 25.03 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 111.957 0.354 . . . . 12.109999999999999 111.957 -178.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -63.97 -20.82 66.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.949 0.404 . . . . 10.869999999999999 111.065 -179.743 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . 0.632 ' HB3' HD11 ' A' ' 145' ' ' ILE . 4.7 mmm -79.89 -25.67 40.54 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.07 -0.514 . . . . 11.09 110.175 -179.336 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 29.2 ttt180 -74.19 -50.09 20.72 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.517 -0.765 . . . . 15.52 109.754 179.619 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -59.86 -36.45 76.9 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.826 -0.624 . . . . 14.85 109.512 178.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -72.16 -35.5 69.05 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-N 115.663 -0.698 . . . . 14.109999999999999 110.897 179.249 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -67.76 -20.57 65.24 Favored 'General case' 0 CA--C 1.52 -0.183 0 CA-C-O 121.326 0.584 . . . . 15.73 110.093 179.49 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 15.6 tttt -79.91 -47.13 15.55 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 115.298 -0.865 . . . . 17.66 110.169 179.775 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 73.7 mt -64.29 -43.47 97.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.496 -0.775 . . . . 18.149999999999999 111.111 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.536 ' HD1' HG11 ' A' ' 108' ' ' VAL . 5.5 m-85 -66.82 -52.66 41.13 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.271 -0.422 . . . . 18.34 111.025 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -59.63 99.83 0.07 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.303 -0.408 . . . . 19.289999999999999 110.386 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.522 ' HG2' ' HB3' ' A' ' 104' ' ' GLU . 22.4 mmm180 -53.04 -37.2 61.37 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.859 -0.61 . . . . 22.25 111.316 -179.393 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -107.84 -176.73 3.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.9 0.381 . . . . 23.34 111.09 -179.697 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.77 4.26 56.25 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.944 -0.646 . . . . 22.0 112.631 179.754 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -63.66 -31.25 72.37 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.64 0.257 . . . . 22.280000000000001 111.29 -179.761 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 92.89 35.18 6.49 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.791 -0.718 . . . . 19.93 112.83 179.771 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . 0.425 ' HA ' ' O ' ' A' ' 136' ' ' ILE . 96.6 m-85 -147.54 142.27 26.7 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.638 0.256 . . . . 20.300000000000001 110.811 179.857 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 59.6 mt -114.35 125.83 71.74 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.162 0 CA-C-O 121.054 0.454 . . . . 19.370000000000001 110.998 179.672 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 23.5 p -114.48 156.07 45.07 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 115.793 -0.639 . . . . 22.489999999999998 110.626 -179.843 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_exo -39.95 -35.61 1.16 Allowed 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.608 2.206 . . . . 23.0 112.681 -179.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.07 -53.43 25.63 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.254 -0.43 . . . . 24.559999999999999 110.973 179.782 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.522 ' HB3' ' HG2' ' A' ' 94' ' ' ARG . 46.8 mt-10 -62.29 -38.78 90.66 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.872 -0.604 . . . . 22.23 110.55 179.87 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.54 HD23 ' HB ' ' A' ' 121' ' ' ILE . 39.9 tp -64.48 -35.6 81.47 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.541 -0.754 . . . . 20.359999999999999 110.869 -179.892 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 10.4 ttp180 -63.97 -52.53 59.25 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.343 -0.389 . . . . 27.190000000000001 110.858 179.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 35.7 t80 -54.27 -47.92 71.79 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.088 -0.506 . . . . 25.359999999999999 111.563 -179.407 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.536 HG11 ' HD1' ' A' ' 92' ' ' PHE . 7.7 p -70.77 -46.98 66.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 N-CA-C 112.144 0.424 . . . . 21.059999999999999 112.144 -179.14 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.516 ' N ' HG13 ' A' ' 108' ' ' VAL . 0.4 OUTLIER -57.2 -20.68 28.37 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 111.728 0.27 . . . . 20.93 111.728 -179.018 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.589 ' HA ' ' HA ' ' A' ' 114' ' ' GLU . 83.0 mt -82.67 -28.71 8.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 120.943 0.402 . . . . 25.129999999999999 110.353 178.915 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -73.87 -36.21 64.79 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.103 -0.499 . . . . 23.32 109.904 178.765 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.47 HD13 HG22 ' A' ' 108' ' ' VAL . 7.0 mp -85.85 -41.69 14.78 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.648 -0.705 . . . . 21.07 109.762 179.223 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -148.93 80.83 0.2 Allowed Glycine 0 C--N 1.33 0.235 0 CA-C-N 115.33 -0.85 . . . . 23.050000000000001 111.769 179.498 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.589 ' HA ' ' HA ' ' A' ' 110' ' ' ILE . 0.0 OUTLIER -48.14 160.48 0.15 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.064 0.459 . . . . 22.59 112.136 -179.356 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 23.6 ttmm 70.67 62.97 0.19 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.238 -0.892 . . . . 27.960000000000001 111.858 179.488 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . 0.495 HG12 ' OE1' ' A' ' 120' ' ' GLU . 1.6 m -125.81 114.73 40.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.165 -0.47 . . . . 24.75 110.625 178.286 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 72.7 p -67.51 147.42 52.84 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.295 -0.411 . . . . 27.239999999999998 110.419 179.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 28.8 m-20 -56.3 -14.73 3.09 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.208 -0.451 . . . . 26.629999999999999 110.581 179.804 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.4 ' O ' ' HG2' ' A' ' 123' ' ' GLU . 12.6 mm-40 -79.7 -55.17 5.2 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.032 -0.531 . . . . 29.140000000000001 111.249 -179.876 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.495 ' OE1' HG12 ' A' ' 116' ' ' VAL . 14.0 pt-20 -58.57 -42.56 88.25 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.748 -0.205 . . . . 24.190000000000001 111.46 -179.576 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.54 ' HB ' HD23 ' A' ' 105' ' ' LEU . 2.7 pt -68.37 -42.92 84.5 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-O 120.643 0.259 . . . . 22.329999999999998 111.144 179.487 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.513 ' H ' HG13 ' A' ' 121' ' ' ILE . 17.8 t70 -60.24 -40.42 90.17 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.826 0.346 . . . . 24.289999999999999 110.444 179.666 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.4 ' HG2' ' O ' ' A' ' 119' ' ' GLU . 16.5 mm-40 -58.34 -46.05 86.96 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.002 -0.545 . . . . 24.739999999999998 110.201 179.382 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.42 ' HE1' HD11 ' A' ' 105' ' ' LEU . 58.9 ttp -55.54 -37.17 67.62 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.214 -0.448 . . . . 19.710000000000001 110.328 179.195 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.5 HG23 HD11 ' A' ' 136' ' ' ILE . 78.6 mt -65.92 -42.38 91.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.049 -0.523 . . . . 19.949999999999999 110.337 179.341 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 21.4 tpp180 -63.43 -25.26 68.19 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.806 -0.634 . . . . 24.949999999999999 111.042 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -78.53 -30.02 46.81 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.229 -0.441 . . . . 18.690000000000001 111.308 -179.535 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.709 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -99.73 -12.39 20.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.309 -0.405 . . . . 16.469999999999999 111.479 -179.689 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . 0.457 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 25.4 t0 -100.68 104.03 15.31 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.977 0.418 . . . . 20.399999999999999 110.906 -179.615 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 88.1 m-85 -82.79 -39.46 21.74 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.962 -0.563 . . . . 21.43 111.174 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -69.07 -13.35 62.39 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.381 -0.372 . . . . 23.370000000000001 111.007 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 47.63 82.38 0.03 OUTLIER Glycine 0 C--N 1.331 0.256 0 C-N-CA 121.19 -0.528 . . . . 24.32 113.212 179.629 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -133.22 -24.49 1.84 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.846 0.355 . . . . 23.879999999999999 110.617 179.579 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 105.84 10.62 30.16 Favored Glycine 0 C--N 1.332 0.321 0 C-N-CA 120.794 -0.717 . . . . 22.670000000000002 112.562 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 91.1 mmm -135.37 150.42 49.92 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.805 0.336 . . . . 22.91 110.756 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.587 HG23 ' HB2' ' A' ' 140' ' ' GLU . 46.9 mm -114.83 141.17 32.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.037 0.446 . . . . 18.41 111.486 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . 0.451 ' O ' ' N ' ' A' ' 139' ' ' GLU . 29.2 p-10 -114.78 157.51 23.13 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.002 -0.74 . . . . 16.82 109.002 178.405 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.566 ' O ' HG23 ' A' ' 142' ' ' VAL . 42.4 t80 -40.59 -21.51 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 111.97 0.359 . . . . 14.65 111.97 -179.754 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.451 ' N ' ' O ' ' A' ' 137' ' ' ASN . 44.2 mt-10 -80.76 -56.76 3.92 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.786 0.327 . . . . 14.82 111.261 -179.615 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.587 ' HB2' HG23 ' A' ' 136' ' ' ILE . 45.5 mt-10 -61.16 -29.82 70.02 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 121.0 0.429 . . . . 17.460000000000001 110.102 179.93 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.562 ' CE2' HD13 ' A' ' 145' ' ' ILE . 83.9 t80 -67.09 -55.52 13.93 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.848 -0.614 . . . . 12.93 110.186 179.403 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.566 HG23 ' O ' ' A' ' 138' ' ' TYR . 42.9 t -51.42 -30.77 11.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.667 -0.697 . . . . 10.699999999999999 111.392 179.811 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 143' ' ' TRP . . . . . 0.495 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 90.3 t90 -70.65 -55.84 7.82 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.496 0.554 . . . . 13.66 112.496 -179.122 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . 0.709 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 18.8 ptt? -63.48 -28.79 70.2 Favored 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 113.272 0.842 . . . . 14.5 113.272 -177.771 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . 0.632 HD11 ' HB3' ' A' ' 85' ' ' MET . 42.8 pt -80.76 -35.9 15.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 112.383 0.512 . . . . 11.25 112.383 -179.304 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . 0.493 ' N ' HG13 ' A' ' 145' ' ' ILE . 42.0 t -60.69 -14.12 18.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.198 0.523 . . . . 8.5399999999999991 110.432 -179.679 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 147' ' ' GLN . . . . . 0.495 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 4.0 mm-40 -101.04 -16.22 17.19 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.362 -0.835 . . . . 11.869999999999999 111.089 -179.053 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 65.1 mttm . . . . . 0 C--O 1.25 1.111 0 CA-C-O 118.296 -0.859 . . . . 13.68 110.829 179.685 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 149' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 151' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 76.4 p . . . . . 0 N--CA 1.486 1.334 0 CA-C-O 120.834 0.35 . . . . 4.8899999999999997 110.881 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -80.95 167.17 20.15 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.223 -0.444 . . . . 3.2599999999999998 110.89 179.896 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.5 mp -53.12 102.64 0.06 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.956 -0.565 . . . . 1.27 110.961 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.52 ' H ' HE21 ' A' ' 8' ' ' GLN . 6.8 m -90.49 158.89 16.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.034 -0.53 . . . . 1.1200000000000001 110.565 179.853 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -47.34 -42.83 22.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.709 0.29 . . . . 2.2000000000000002 111.63 -179.651 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -73.32 -41.41 63.56 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.033 0.444 . . . . 1.3500000000000001 111.005 -179.476 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.52 HE21 ' H ' ' A' ' 5' ' ' THR . 24.1 mt-30 -63.99 -40.43 96.36 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.833 -0.622 . . . . 2.2200000000000002 111.001 -179.879 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.496 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 89.2 mt -62.11 -50.79 78.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.117 -0.492 . . . . 0.54000000000000004 110.628 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.41 -24.81 67.6 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.001 -0.545 . . . . 0.5 111.366 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -69.91 -56.35 7.27 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.39 -0.368 . . . . 2.27 111.939 -179.033 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.496 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 10.5 p90 -78.4 -28.07 46.81 Favored 'General case' 0 C--N 1.332 -0.155 0 C-N-CA 120.603 -0.439 . . . . 0.37 111.009 -179.532 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 21.2 tptm -62.65 -35.62 80.2 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.153 -0.684 . . . . 1.23 109.153 178.669 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.472 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 33.1 t70 -69.44 -50.12 48.66 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 115.706 -0.679 . . . . 0.44 109.179 178.315 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.27 -17.67 54.63 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.68 -0.691 . . . . 0.28999999999999998 110.574 179.058 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -77.96 -48.21 16.78 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.003 -0.544 . . . . 0.47999999999999998 110.638 -179.495 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 23.3 m -70.32 -15.85 19.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.146 -0.479 . . . . 1.1100000000000001 110.532 179.648 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.472 ' HG3' ' O ' ' A' ' 14' ' ' ASP . 73.2 mt-30 -64.01 -44.53 92.3 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.787 -0.642 . . . . 1.6000000000000001 111.111 179.326 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -90.39 31.16 1.04 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.16 -0.473 . . . . 0.64000000000000001 111.71 -179.298 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -118.96 70.96 0.84 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.001 0.429 . . . . 0.44 110.4 179.284 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 33.7 mmtp -76.5 -17.63 59.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.866 -0.606 . . . . 2.1000000000000001 111.205 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -83.05 -10.94 58.47 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.212 -0.449 . . . . 1.8 110.907 -179.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 65.44 14.3 59.72 Favored Glycine 0 C--N 1.33 0.236 0 C-N-CA 120.869 -0.681 . . . . 0.46000000000000002 112.648 179.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 30.0 p -83.74 11.86 6.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.671 0.272 . . . . 0.40000000000000002 111.205 -179.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 56.22 18.88 22.3 Favored Glycine 0 C--N 1.332 0.361 0 C-N-CA 120.709 -0.758 . . . . 0.33000000000000002 111.596 -179.383 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.633 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 51.7 mtpt -135.43 155.26 50.84 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.501 -0.35 . . . . 1.1000000000000001 110.334 -179.488 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.421 ' N ' HE22 ' A' ' 62' ' ' GLN . 42.4 pt -120.9 140.65 44.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.871 0.367 . . . . 0.5 111.286 -179.799 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -57.97 135.95 57.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.153 -0.476 . . . . 0.29999999999999999 110.612 179.651 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.418 ' HA ' HD23 ' A' ' 63' ' ' LEU . 5.7 t -64.69 -8.56 15.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.19 -0.459 . . . . 1.03 110.994 179.808 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 43.5 mtt180 -89.76 -11.21 42.89 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.043 -0.526 . . . . 3.0800000000000001 110.851 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -107.57 -4.58 18.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.92 -0.582 . . . . 2.2599999999999998 110.908 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.647 HD23 HD21 ' A' ' 63' ' ' LEU . 1.4 tm? -57.72 -51.0 71.32 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.355 -0.384 . . . . 1.3700000000000001 110.311 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -53.59 -42.71 67.25 Favored Glycine 0 C--N 1.332 0.344 0 C-N-CA 120.617 -0.801 . . . . 0.32000000000000001 111.692 179.438 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 94.9 m -63.88 -36.07 82.73 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.226 0.536 . . . . 0.31 109.868 179.038 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 38.8 tp -65.94 -24.05 66.74 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.369 -0.832 . . . . 1.24 110.773 -179.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.462 ' HG2' ' O ' ' A' ' 32' ' ' LEU . 79.9 mmm -80.36 -37.87 31.53 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.252 -0.431 . . . . 1.1000000000000001 110.19 179.346 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 69.6 mtp180 -59.64 -44.34 93.53 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.942 -0.572 . . . . 2.6899999999999999 110.964 179.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.426 HG23 HD13 ' A' ' 39' ' ' LEU . 1.3 t -64.23 -13.52 49.61 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.235 -0.439 . . . . 1.0600000000000001 111.321 179.835 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.426 HD13 HG23 ' A' ' 38' ' ' THR . 10.8 mp -113.75 156.14 24.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.115 -0.493 . . . . 1.26 110.412 179.365 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -58.35 -5.69 2.67 Favored Glycine 0 CA--C 1.518 0.255 0 CA-C-N 116.014 -0.539 . . . . 0.68999999999999995 113.759 -178.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 15.9 mp0 -88.29 130.91 34.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 117.107 0.453 . . . . 1.97 110.972 179.746 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -131.88 87.05 46.06 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.092 -0.503 . . . . 2.6600000000000001 110.775 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -70.47 151.37 64.98 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 122.511 2.141 . . . . 0.51000000000000001 112.275 -179.839 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 27.4 m -64.35 150.06 46.99 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.22 -0.445 . . . . 0.72999999999999998 110.738 179.746 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -48.07 -54.51 12.86 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.562 -0.29 . . . . 2.7000000000000002 111.336 -179.631 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.57 -53.27 54.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.264 -0.426 . . . . 0.46000000000000002 111.745 -179.574 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -53.79 -46.03 70.9 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-O 120.938 0.399 . . . . 2.23 110.446 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.569 HD12 HD11 ' A' ' 51' ' ' LEU . 32.5 tp -57.27 -42.69 82.12 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.741 -0.663 . . . . 1.3600000000000001 110.71 179.837 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -68.46 -30.19 69.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.227 -0.442 . . . . 1.22 111.095 -179.8 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -68.45 -53.55 22.81 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.382 -0.372 . . . . 0.62 110.965 179.551 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.569 HD11 HD12 ' A' ' 48' ' ' LEU . 1.0 OUTLIER -65.38 -34.87 79.34 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.318 -0.401 . . . . 0.39000000000000001 110.979 179.931 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 34.9 mt -59.78 -44.73 94.58 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.134 0 CA-C-N 116.523 -0.308 . . . . 0.5 110.458 179.467 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.68 -32.47 73.81 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.236 -0.438 . . . . 0.58999999999999997 110.53 179.624 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -66.53 -46.04 77.48 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.007 -0.542 . . . . 2.54 110.178 179.352 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.433 ' HB1' ' HB3' ' A' ' 63' ' ' LEU . . . -76.21 -20.76 57.17 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.014 -0.539 . . . . 0.53000000000000003 111.078 179.585 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -80.35 -31.74 37.89 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.277 -0.42 . . . . 1.95 110.985 -179.88 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -91.98 -12.95 31.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.053 -0.522 . . . . 2.48 110.763 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.492 HD22 ' C ' ' A' ' 58' ' ' ASN . 0.2 OUTLIER -81.2 -84.02 0.11 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.098 -0.501 . . . . 2.48 110.785 -179.852 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . 0.492 ' HB2' ' O ' ' A' ' 62' ' ' GLN . 15.7 m-80 -101.54 35.97 2.16 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.885 0.374 . . . . 2.0499999999999998 110.805 -179.914 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.8 m120 62.27 -132.82 0.55 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.883 -0.599 . . . . 1.47 111.116 179.62 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -78.71 29.65 2.04 Favored Glycine 0 C--N 1.334 0.419 0 C-N-CA 120.638 -0.791 . . . . 0.42999999999999999 112.526 -179.706 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.633 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -145.1 155.32 43.25 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.17 0.51 . . . . 0.38 111.338 179.829 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.647 HD21 HD23 ' A' ' 32' ' ' LEU . 2.1 pp -142.07 157.93 44.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.442 -0.799 . . . . 1.4299999999999999 109.084 179.529 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . 0.482 ' OD1' ' HE3' ' A' ' 26' ' ' LYS . 0.7 OUTLIER -110.23 157.37 19.51 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.74 -0.384 . . . . 1.1899999999999999 111.856 -177.411 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -39.28 -33.47 0.15 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.476 -0.784 . . . . 0.40000000000000002 111.846 -179.794 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 2.8 m -64.25 -43.9 93.47 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 111.663 0.245 . . . . 0.81000000000000005 111.663 -179.582 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.535 ' HB2' HD13 ' A' ' 63' ' ' LEU . 22.7 mm-40 -61.96 -55.14 32.49 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.853 0.359 . . . . 1.3600000000000001 110.958 179.818 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -59.39 -49.7 76.78 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.041 -0.527 . . . . 0.51000000000000001 111.376 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 6.3 t -61.14 -39.24 89.3 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-O 120.869 0.366 . . . . 0.75 110.692 -179.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . 0.528 ' O ' ' HB3' ' A' ' 73' ' ' ALA . . . -60.08 -42.86 98.65 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.648 -0.787 . . . . 0.40999999999999998 111.85 179.783 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.56 HD13 HD13 ' A' ' 51' ' ' LEU . 64.8 mt -63.59 -51.23 72.92 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.688 0 CA-C-O 121.657 0.742 . . . . 0.51000000000000001 109.294 177.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . 0.497 ' O ' ' HB2' ' A' ' 76' ' ' MET . 14.2 mtp -53.73 -29.63 40.36 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.027 -0.988 . . . . 1.01 108.729 178.375 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.528 ' HB3' ' O ' ' A' ' 70' ' ' GLY . . . -72.14 -35.39 69.06 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.12 -0.945 . . . . 0.69999999999999996 110.623 179.866 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.555 ' HG2' ' O ' ' A' ' 71' ' ' ILE . 0.1 OUTLIER -80.34 -32.83 37.75 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.338 -0.392 . . . . 1.3799999999999999 111.73 -179.724 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -82.71 -42.72 17.72 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.082 0.468 . . . . 1.98 111.195 -178.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . 0.497 ' HB2' ' O ' ' A' ' 72' ' ' MET . 80.7 mtp -69.89 -55.33 10.0 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.574 -0.739 . . . . 1.2 112.005 -179.299 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 80.6 mtt180 -61.4 -13.95 24.08 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.648 0.261 . . . . 4.6900000000000004 111.328 -179.296 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -60.07 -17.28 38.36 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.328 -0.396 . . . . 4.0099999999999998 111.381 -179.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.457 HG22 ' O ' ' A' ' 76' ' ' MET . 8.4 t -89.63 -15.17 33.31 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 111.953 0.353 . . . . 5.2800000000000002 111.953 -179.189 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.76 -23.16 67.06 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.569 -0.287 . . . . 5.5999999999999996 110.858 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.509 ' O ' ' HG2' ' A' ' 85' ' ' MET . 3.9 t 34.98 65.66 0.35 Allowed 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 116.058 -0.519 . . . . 7.29 111.298 -179.567 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -47.32 -24.23 0.72 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.51 -0.768 . . . . 9.7400000000000002 112.3 -179.138 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -64.14 -55.28 22.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.753 0.311 . . . . 12.109999999999999 111.391 -179.78 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -64.03 -18.3 64.19 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.379 -0.373 . . . . 10.869999999999999 110.908 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . 0.554 ' HB3' HD11 ' A' ' 145' ' ' ILE . 4.1 mmm -78.81 -48.03 15.55 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.104 -0.498 . . . . 11.09 110.059 -179.662 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 21.0 ttt180 -55.71 -39.0 70.45 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.517 -0.765 . . . . 15.52 110.134 179.272 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -65.2 -47.66 76.15 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.989 -0.551 . . . . 14.85 110.228 179.158 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -65.57 -24.26 67.05 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.057 -0.52 . . . . 14.109999999999999 111.332 179.781 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 86.7 t80 -73.83 -46.91 42.18 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.95 0.405 . . . . 15.73 110.852 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -60.65 -38.31 84.42 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.991 -0.549 . . . . 17.66 110.866 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 67.7 mt -70.98 -46.27 68.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.863 -0.608 . . . . 18.149999999999999 111.166 -179.631 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.514 ' HA ' HG21 ' A' ' 108' ' ' VAL . 0.7 OUTLIER -66.96 -26.67 66.94 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.382 -0.372 . . . . 18.34 111.099 -179.885 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 23.7 t0 -96.16 93.92 7.21 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.153 -0.476 . . . . 19.289999999999999 110.237 179.69 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -69.61 -11.46 60.85 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.083 -0.508 . . . . 22.25 111.354 -179.386 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 47.8 m-20 -101.71 167.75 9.9 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.341 -0.391 . . . . 23.34 110.94 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.07 5.18 57.66 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.842 -0.694 . . . . 22.0 112.072 179.513 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -70.84 -31.47 68.19 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.682 0.277 . . . . 22.280000000000001 111.267 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 92.37 27.25 15.81 Favored Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.686 -0.768 . . . . 19.93 112.519 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 90.1 m-85 -139.47 147.23 41.04 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.498 0.19 . . . . 20.300000000000001 110.632 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.466 ' HB ' ' HB ' ' A' ' 136' ' ' ILE . 71.1 mt -113.92 131.37 66.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 121.149 0.5 . . . . 19.370000000000001 111.223 179.789 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 79.4 p -114.02 157.8 41.09 Favored Pre-proline 0 C--N 1.326 -0.42 0 CA-C-N 115.509 -0.769 . . . . 22.489999999999998 110.049 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_exo -47.94 -31.55 15.9 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.068 1.845 . . . . 23.0 111.676 -179.658 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.57 -36.86 79.33 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.726 -0.67 . . . . 24.559999999999999 111.11 179.668 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.431 ' O ' HG23 ' A' ' 108' ' ' VAL . 39.0 mt-10 -80.26 -36.68 34.23 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.938 -0.574 . . . . 22.23 109.889 -179.477 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.563 HD22 ' HB ' ' A' ' 121' ' ' ILE . 5.5 tt -62.12 -43.57 98.54 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.331 -0.85 . . . . 20.359999999999999 110.267 179.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.432 ' O ' HG13 ' A' ' 110' ' ' ILE . 61.1 ttt180 -65.59 -54.63 25.24 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.933 -0.576 . . . . 27.190000000000001 110.89 179.783 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 4.3 m-85 -49.38 -49.46 44.46 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.137 -0.483 . . . . 25.359999999999999 111.973 -179.454 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.514 HG21 ' HA ' ' A' ' 92' ' ' PHE . 83.6 t -64.46 -50.72 74.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.695 -0.23 . . . . 21.059999999999999 111.557 -179.475 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.464 ' HG3' HD23 ' A' ' 105' ' ' LEU . 0.3 OUTLIER -53.15 -39.22 63.38 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.741 0.305 . . . . 20.93 110.739 -179.951 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.432 HG13 ' O ' ' A' ' 106' ' ' ARG . 82.7 mt -70.74 -29.59 38.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 120.999 0.428 . . . . 25.129999999999999 110.28 179.329 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -71.13 -39.73 71.83 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.828 -0.624 . . . . 23.32 110.741 179.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.433 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 38.2 mt -65.33 -32.57 74.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.043 -0.526 . . . . 21.07 110.664 179.879 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 126.87 -11.98 6.92 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.828 -0.701 . . . . 23.050000000000001 112.271 -179.854 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -91.06 114.49 27.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.743 0.306 . . . . 22.59 111.127 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.43 ' HD3' ' N ' ' A' ' 115' ' ' LYS . 3.8 mppt? -84.08 125.65 32.32 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.225 -0.443 . . . . 27.960000000000001 110.779 179.848 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . 0.403 HG12 ' OE1' ' A' ' 120' ' ' GLU . 2.4 m -135.57 147.27 28.79 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.241 -0.436 . . . . 24.75 111.44 -179.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 82.2 p -87.99 147.24 25.11 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.935 -0.575 . . . . 27.239999999999998 110.198 179.105 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . 0.408 ' O ' ' HB2' ' A' ' 122' ' ' ASP . 8.1 m-20 -53.64 -19.93 4.63 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.259 -0.428 . . . . 26.629999999999999 111.576 -179.529 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 23.1 mm-40 -77.61 -55.69 5.15 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.01 0.374 . . . . 29.140000000000001 112.01 -179.264 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.403 ' OE1' HG12 ' A' ' 116' ' ' VAL . 14.6 pt-20 -58.47 -41.69 85.82 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.636 0.255 . . . . 24.190000000000001 111.563 -179.306 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.563 ' HB ' HD22 ' A' ' 105' ' ' LEU . 45.7 pt -70.74 -33.59 53.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 C-N-CA 120.903 -0.319 . . . . 22.329999999999998 110.749 179.67 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.408 ' HB2' ' O ' ' A' ' 118' ' ' ASP . 16.2 t70 -56.03 -50.98 69.41 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 120.768 0.318 . . . . 24.289999999999999 110.617 179.401 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.55 -43.35 99.02 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.204 -0.453 . . . . 24.739999999999998 110.736 179.797 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 51.0 ttp -54.66 -38.6 67.13 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.174 -0.466 . . . . 19.710000000000001 110.915 179.65 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.551 HG23 HD11 ' A' ' 136' ' ' ILE . 85.0 mt -68.47 -37.07 77.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.232 -0.44 . . . . 19.949999999999999 110.742 179.682 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 70.3 ttt180 -65.94 -30.08 70.59 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.155 -0.475 . . . . 24.949999999999999 110.637 179.677 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -74.67 -24.86 58.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.077 -0.511 . . . . 18.690000000000001 111.173 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.613 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -100.58 -13.63 18.52 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.183 -0.462 . . . . 16.469999999999999 111.118 179.855 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -97.14 105.31 17.43 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.052 -0.522 . . . . 20.399999999999999 110.931 -179.684 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 -97.96 -33.94 11.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.931 -0.577 . . . . 21.43 111.153 -179.651 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -66.02 -13.86 60.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.365 -0.38 . . . . 23.370000000000001 110.777 -179.835 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 62.13 85.31 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.834 -0.698 . . . . 24.32 112.521 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -153.8 -19.53 0.14 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.661 0.267 . . . . 23.879999999999999 111.475 -179.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 87.21 16.25 61.09 Favored Glycine 0 N--CA 1.453 -0.211 0 C-N-CA 120.67 -0.776 . . . . 22.670000000000002 112.6 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 70.3 mtp -132.72 155.54 48.65 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.625 0.25 . . . . 22.91 110.539 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.742 HG23 ' HB2' ' A' ' 140' ' ' GLU . 50.5 mm -114.61 138.65 44.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.367 0.604 . . . . 18.41 112.076 -179.238 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . 0.472 ' O ' ' N ' ' A' ' 139' ' ' GLU . 21.8 p30 -115.5 159.06 21.69 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.194 -0.912 . . . . 16.82 108.644 177.893 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.611 ' O ' HG23 ' A' ' 142' ' ' VAL . 47.0 t80 -38.21 -24.67 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 112.416 0.524 . . . . 14.65 112.416 -178.789 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.472 ' N ' ' O ' ' A' ' 137' ' ' ASN . 47.2 mt-10 -80.44 -55.27 5.0 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.742 0.306 . . . . 14.82 111.19 -179.636 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.742 ' HB2' HG23 ' A' ' 136' ' ' ILE . 30.2 mt-10 -60.69 -28.4 68.6 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.319 -0.4 . . . . 17.460000000000001 110.738 -179.851 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.681 ' HA ' ' HE2' ' A' ' 144' ' ' MET . 86.5 t80 -72.46 -56.12 5.93 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.292 -0.413 . . . . 12.93 110.703 179.841 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.611 HG23 ' O ' ' A' ' 138' ' ' TYR . 50.3 t -48.32 -37.01 7.09 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 CA-C-N 115.939 -0.573 . . . . 10.699999999999999 111.589 179.478 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 143' ' ' TRP . . . . . 0.522 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 92.7 t90 -71.11 -55.58 7.91 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.296 0.48 . . . . 13.66 112.296 -178.872 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . 0.681 ' HE2' ' HA ' ' A' ' 141' ' ' PHE . 22.8 ptt? -63.11 -24.38 67.87 Favored 'General case' 0 N--CA 1.464 0.237 0 N-CA-C 112.957 0.725 . . . . 14.5 112.957 -177.808 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . 0.554 HD11 ' HB3' ' A' ' 85' ' ' MET . 48.6 pt -80.73 -40.48 19.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 N-CA-C 112.182 0.438 . . . . 11.25 112.182 -179.513 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . 0.521 ' N ' HG13 ' A' ' 145' ' ' ILE . 86.4 p -59.38 -13.61 9.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.275 0.559 . . . . 8.5399999999999991 110.436 -179.759 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 147' ' ' GLN . . . . . 0.522 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 4.4 mm-40 -105.34 26.71 9.08 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.304 -0.862 . . . . 11.869999999999999 111.529 -178.692 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 9.6 mtmp? . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.158 -0.925 . . . . 13.68 110.721 179.593 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 149' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 151' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 44.7 t . . . . . 0 N--CA 1.485 1.278 0 CA-C-O 120.744 0.307 . . . . 4.8899999999999997 110.983 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -152.74 76.29 1.13 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.239 -0.437 . . . . 3.2599999999999998 111.217 -179.828 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 20.1 mt -58.22 108.02 0.56 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.276 -0.42 . . . . 1.27 110.806 179.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 6.2 m -84.0 158.99 21.31 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.139 -0.482 . . . . 1.1200000000000001 110.801 -179.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -47.63 -30.84 4.0 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 111.818 0.303 . . . . 2.2000000000000002 111.818 -179.624 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.413 ' HG3' ' N ' ' A' ' 8' ' ' GLN . 11.0 pt-20 -76.58 -51.29 11.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.947 0.403 . . . . 1.3500000000000001 110.916 -179.567 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.413 ' N ' ' HG3' ' A' ' 7' ' ' GLU . 26.1 mt-30 -63.18 -36.08 82.44 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.025 -0.534 . . . . 2.2200000000000002 110.682 179.924 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.559 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 97.1 mt -62.68 -52.09 63.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.959 -0.564 . . . . 0.54000000000000004 110.65 179.859 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.25 -26.48 67.78 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.888 -0.596 . . . . 0.5 111.4 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -69.61 -56.93 5.91 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 111.889 0.329 . . . . 2.27 111.889 -179.161 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.559 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 4.1 p90 -76.47 -23.6 53.83 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 120.54 -0.464 . . . . 0.37 110.92 -179.557 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.442 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 18.1 tptm -66.33 -35.59 80.76 Favored 'General case' 0 C--N 1.332 -0.163 0 N-CA-C 109.145 -0.687 . . . . 1.23 109.145 178.911 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.44 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 23.5 t70 -68.03 -49.82 59.1 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 108.777 -0.823 . . . . 0.44 108.777 177.995 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.28 -13.95 52.82 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.303 -0.862 . . . . 0.28999999999999998 110.453 178.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.519 ' HA ' HD11 ' A' ' 35' ' ' LEU . 83.4 t80 -79.65 -48.9 12.96 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.842 -0.617 . . . . 0.47999999999999998 110.823 -179.629 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 19.7 m -67.89 -20.88 26.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 120.974 0.416 . . . . 1.1100000000000001 110.415 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.44 ' HG2' ' O ' ' A' ' 14' ' ' ASP . 77.6 mm-40 -60.36 -32.82 71.63 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.827 -0.624 . . . . 1.6000000000000001 111.455 179.334 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 82.3 m-85 -93.93 4.02 54.52 Favored 'General case' 0 N--CA 1.463 0.191 0 N-CA-C 111.721 0.267 . . . . 0.64000000000000001 111.721 -179.578 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -101.79 87.21 3.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.002 0.43 . . . . 0.44 110.672 179.672 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -97.4 -15.0 20.88 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.9 -0.591 . . . . 2.1000000000000001 111.322 -179.878 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -83.58 1.14 43.58 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.225 -0.443 . . . . 1.8 111.365 -179.547 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 63.67 16.07 58.43 Favored Glycine 0 C--N 1.331 0.268 0 C-N-CA 120.987 -0.625 . . . . 0.46000000000000002 113.032 179.645 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 46.1 p -92.65 8.34 39.55 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.642 0.258 . . . . 0.40000000000000002 111.124 179.838 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 57.1 18.19 26.35 Favored Glycine 0 C--N 1.331 0.304 0 C-N-CA 120.823 -0.703 . . . . 0.33000000000000002 111.822 -179.677 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.492 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 35.7 mtpt -127.4 155.54 43.47 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.82 0.343 . . . . 1.1000000000000001 111.06 -179.512 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.445 ' N ' HE22 ' A' ' 62' ' ' GLN . 43.6 pt -116.67 134.72 59.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.272 -0.422 . . . . 0.5 111.601 -179.711 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -53.47 138.91 32.49 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.083 -0.508 . . . . 0.29999999999999999 111.282 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.585 ' HA ' HD11 ' A' ' 63' ' ' LEU . 7.7 t -68.98 -5.39 21.35 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.073 -0.512 . . . . 1.03 111.161 -179.901 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 49.6 mtp180 -97.53 4.93 50.22 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.954 -0.566 . . . . 3.0800000000000001 110.385 179.717 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -128.7 -1.49 5.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.864 -0.607 . . . . 2.2599999999999998 110.824 -179.862 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.461 HD21 ' CD1' ' A' ' 68' ' ' PHE . 2.6 tm? -55.3 -54.15 47.11 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.158 -0.474 . . . . 1.3700000000000001 110.495 179.834 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.411 ' O ' ' HG3' ' A' ' 37' ' ' ARG . . . -56.01 -42.25 86.59 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.578 -0.82 . . . . 0.32000000000000001 111.815 179.433 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 56.6 m -55.63 -37.19 67.86 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.023 0.44 . . . . 0.31 110.256 179.291 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.519 HD11 ' HA ' ' A' ' 16' ' ' PHE . 1.2 tt -65.36 -36.23 83.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.681 -0.69 . . . . 1.24 110.031 179.386 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.495 ' SD ' ' HG3' ' A' ' 43' ' ' PRO . 25.1 mtp -78.2 -20.35 52.04 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.788 -0.642 . . . . 1.1000000000000001 110.853 179.887 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.411 ' HG3' ' O ' ' A' ' 33' ' ' GLY . 62.3 mtp180 -77.57 -38.52 48.28 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.315 -0.402 . . . . 2.6899999999999999 110.498 179.527 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.444 HG23 ' CD1' ' A' ' 39' ' ' LEU . 1.5 t -71.39 -13.31 61.81 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.222 -0.444 . . . . 1.0600000000000001 110.943 179.588 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.449 ' HB3' ' OE1' ' A' ' 41' ' ' GLN . 10.9 mp -113.28 156.23 23.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.096 -0.502 . . . . 1.26 110.701 179.691 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -49.5 -20.69 2.67 Favored Glycine 0 CA--C 1.521 0.46 0 CA-C-N 115.679 -0.691 . . . . 0.68999999999999995 114.303 -178.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.701 ' HG2' HE22 ' A' ' 75' ' ' GLN . 20.0 mp0 -60.78 139.06 58.04 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 117.382 0.591 . . . . 1.97 111.09 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 74.9 m-20 -130.97 78.51 73.32 Favored Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 116.179 -0.464 . . . . 2.6600000000000001 110.966 179.851 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.495 ' HG3' ' SD ' ' A' ' 36' ' ' MET . 59.9 Cg_endo -68.97 147.59 68.3 Favored 'Trans proline' 0 C--N 1.343 0.259 0 C-N-CA 122.767 2.311 . . . . 0.51000000000000001 112.256 179.757 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 63.5 m -68.9 143.34 54.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.339 -0.391 . . . . 0.72999999999999998 110.59 179.505 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.47 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 8.9 tp10 -47.93 -55.32 10.2 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.612 0.244 . . . . 2.7000000000000002 111.051 -179.601 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -55.09 -45.08 75.41 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.296 -0.411 . . . . 0.46000000000000002 111.164 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -53.27 -53.8 45.49 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.278 -0.419 . . . . 2.23 110.704 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.442 ' HA ' HD21 ' A' ' 51' ' ' LEU . 12.3 mt -56.6 -38.14 71.62 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.313 -0.403 . . . . 1.3600000000000001 110.47 179.44 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.47 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 84.0 mm-40 -67.25 -27.17 66.99 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.394 -0.366 . . . . 1.22 110.585 179.603 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 38.5 m-20 -77.35 -55.35 5.48 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.207 -0.451 . . . . 0.62 111.8 -179.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.56 HD13 HD13 ' A' ' 71' ' ' ILE . 1.1 pp -65.8 -35.88 81.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.497 -0.319 . . . . 0.39000000000000001 111.8 -179.19 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 82.6 mt -71.21 -43.22 74.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.698 0.285 . . . . 0.5 111.016 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.58 -49.94 71.39 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.406 -0.361 . . . . 0.58999999999999997 111.0 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -58.91 -36.15 74.23 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.892 0.377 . . . . 2.54 110.072 179.474 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.451 ' HA ' HD22 ' A' ' 59' ' ' ASN . . . -76.23 -19.63 58.18 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.077 -0.511 . . . . 0.53000000000000003 110.767 179.217 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -79.16 -31.21 43.91 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.164 -0.471 . . . . 1.95 110.802 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 14.4 m120 -111.5 41.75 1.83 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.145 -0.48 . . . . 2.48 110.875 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.456 HD22 ' C ' ' A' ' 58' ' ' ASN . 0.2 OUTLIER -158.03 -63.42 0.09 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.076 -0.511 . . . . 2.48 110.519 179.985 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . 0.451 HD22 ' HA ' ' A' ' 55' ' ' ALA . 25.2 m-80 -87.42 23.1 1.98 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.122 -0.49 . . . . 2.0499999999999998 110.803 179.827 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 11.3 m120 66.27 -76.69 0.05 OUTLIER 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 116.009 -0.541 . . . . 1.47 111.086 -179.814 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -165.15 21.01 0.12 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.842 -0.694 . . . . 0.42999999999999999 112.373 179.767 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.492 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -132.14 155.22 48.56 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.982 0.42 . . . . 0.38 111.406 -179.814 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.585 HD11 ' HA ' ' A' ' 29' ' ' THR . 24.1 mt -123.88 152.38 42.43 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.837 -0.619 . . . . 1.4299999999999999 110.403 179.858 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 19.9 m-80 -113.2 157.77 21.29 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.884 0.373 . . . . 1.1899999999999999 111.132 -179.757 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -42.3 -37.71 1.6 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.67 -0.695 . . . . 0.40000000000000002 111.158 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -72.32 -38.96 68.56 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.206 -0.452 . . . . 0.81000000000000005 111.544 179.8 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -58.07 -51.2 70.66 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.026 0.441 . . . . 1.3600000000000001 110.4 179.744 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.461 ' CD1' HD21 ' A' ' 32' ' ' LEU . 29.5 t80 -67.1 -46.83 73.03 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.739 -0.664 . . . . 0.51000000000000001 110.797 179.904 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 10.6 m -55.12 -50.82 68.29 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.148 -0.478 . . . . 0.75 111.038 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -52.82 -52.4 39.1 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.891 -0.671 . . . . 0.40999999999999998 112.007 179.799 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.687 HG23 ' HE2' ' A' ' 74' ' ' LYS . 70.2 mt -58.24 -50.28 78.95 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.601 0 CA-C-O 120.967 0.413 . . . . 0.51000000000000001 110.8 179.204 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 2.3 mtp -43.39 -37.63 2.39 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.569 -0.741 . . . . 1.01 110.819 179.625 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.27 -55.28 10.98 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.118 -0.492 . . . . 0.69999999999999996 111.133 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.687 ' HE2' HG23 ' A' ' 71' ' ' ILE . 57.7 pttt -59.8 -30.26 68.79 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.963 -0.562 . . . . 1.3799999999999999 111.411 -179.389 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . 0.701 HE22 ' HG2' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -81.59 -46.46 14.39 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.289 -0.414 . . . . 1.98 111.919 -179.369 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 32.4 mtt -49.74 -48.03 50.38 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 116.328 -0.396 . . . . 1.2 111.632 -179.431 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 39.2 ptt180 -80.36 -42.47 22.84 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.093 0.405 . . . . 4.6900000000000004 112.093 -179.174 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -61.85 -21.52 64.73 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.596 0.236 . . . . 4.0099999999999998 111.385 -179.561 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 29.1 m -93.31 -72.56 0.6 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.498 -0.319 . . . . 5.2800000000000002 111.4 -179.616 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -172.83 89.77 0.09 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.723 -0.217 . . . . 5.5999999999999996 111.531 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.53 ' O ' ' HG2' ' A' ' 85' ' ' MET . 1.7 t -49.6 93.3 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 120.972 0.415 . . . . 7.29 110.723 178.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.426 ' HA ' ' HG2' ' A' ' 85' ' ' MET . 43.8 mt-10 -49.34 -19.88 0.58 Allowed 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 113.353 0.871 . . . . 9.7400000000000002 113.353 -178.221 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -62.28 -55.87 24.05 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 120.992 0.425 . . . . 12.109999999999999 111.461 -179.423 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -69.63 -16.01 63.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.131 -0.486 . . . . 10.869999999999999 111.17 -179.525 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . 0.537 ' HB3' HG22 ' A' ' 142' ' ' VAL . 2.8 mmm -82.61 -32.12 28.53 Favored 'General case' 0 CA--C 1.508 -0.639 0 CA-C-O 121.979 0.895 . . . . 11.09 108.84 -179.24 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 25.9 tpt180 -64.67 -50.12 68.28 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 113.655 -1.611 . . . . 15.52 110.037 179.404 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -65.54 -37.09 85.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.8 -0.636 . . . . 14.85 110.195 179.164 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.79 -31.13 69.92 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.973 -0.558 . . . . 14.109999999999999 111.128 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 87.6 t80 -68.04 -39.59 83.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.137 0.494 . . . . 15.73 110.373 179.789 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 65.7 mttm -65.83 -39.51 90.88 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.543 -0.753 . . . . 17.66 110.918 179.769 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 78.2 mt -70.46 -45.43 74.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.059 -0.518 . . . . 18.149999999999999 111.59 -179.755 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.534 ' HD1' HG11 ' A' ' 108' ' ' VAL . 1.9 m-85 -67.51 -55.46 13.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.452 -0.34 . . . . 18.34 111.511 -179.503 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 27.9 t0 -58.35 109.14 0.72 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.879 0.371 . . . . 19.289999999999999 110.523 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.516 ' HG2' ' HB3' ' A' ' 104' ' ' GLU . 22.4 mmm180 -57.88 -37.0 73.18 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.967 -0.56 . . . . 22.25 111.129 -179.464 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.418 ' HB2' ' OD1' ' A' ' 97' ' ' ASP . 0.3 OUTLIER -107.8 176.46 5.14 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.22 -0.445 . . . . 23.34 110.784 -179.78 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.03 5.34 57.79 Favored Glycine 0 N--CA 1.449 -0.433 0 C-N-CA 120.896 -0.668 . . . . 22.0 112.157 179.721 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.437 ' OD2' ' HB2' ' A' ' 99' ' ' PHE . 11.6 p-10 -58.8 -38.79 79.38 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.808 0.337 . . . . 22.280000000000001 110.98 -179.875 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 105.21 28.15 5.62 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.858 -0.687 . . . . 19.93 113.076 179.427 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . 0.437 ' HB2' ' OD2' ' A' ' 97' ' ' ASP . 59.8 m-85 -145.39 139.06 26.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.012 0.435 . . . . 20.300000000000001 111.622 179.89 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.426 ' HB ' ' HB ' ' A' ' 136' ' ' ILE . 84.3 mt -114.84 124.59 71.64 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 115.774 -0.648 . . . . 19.370000000000001 110.619 179.414 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 58.4 m -114.21 156.55 44.1 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.154 -0.475 . . . . 22.489999999999998 110.958 -179.56 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -41.25 -32.54 1.18 Allowed 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 122.723 2.282 . . . . 23.0 112.181 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.55 -51.08 62.53 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.1 0.476 . . . . 24.559999999999999 110.531 179.299 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.543 ' O ' HG12 ' A' ' 108' ' ' VAL . 45.0 mt-10 -69.57 -26.99 64.75 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.674 -0.694 . . . . 22.23 110.875 179.851 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.493 HD23 ' C ' ' A' ' 105' ' ' LEU . 5.8 tt -69.13 -55.83 9.51 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.333 -0.394 . . . . 20.359999999999999 111.161 -179.583 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 7.1 ppt_? -62.49 -30.57 71.36 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.034 0.445 . . . . 27.190000000000001 110.597 -179.679 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -74.19 -36.59 64.02 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.785 -0.643 . . . . 25.359999999999999 112.043 -179.866 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.543 HG12 ' O ' ' A' ' 104' ' ' GLU . 7.2 p -80.0 -44.88 22.85 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 N-CA-C 111.947 0.351 . . . . 21.059999999999999 111.947 -179.352 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.473 ' N ' HG13 ' A' ' 108' ' ' VAL . 12.0 mmt -52.69 -38.98 61.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.49 -0.323 . . . . 20.93 111.429 -179.587 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 89.6 mt -65.65 -34.48 70.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.843 0.354 . . . . 25.129999999999999 110.538 179.488 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 69.7 m-20 -65.64 -22.93 66.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.09 -0.505 . . . . 23.32 110.444 179.559 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 7.5 mt -88.42 -27.87 21.28 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.954 -0.566 . . . . 21.07 110.531 179.722 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 106.22 10.8 29.02 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.896 -0.668 . . . . 23.050000000000001 112.217 -179.741 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -74.61 -34.86 62.9 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.65 0.262 . . . . 22.59 111.306 -179.737 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 57.3 tptt 53.85 90.69 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.119 -0.491 . . . . 27.960000000000001 110.76 -179.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . 0.414 ' HB ' HG23 ' A' ' 121' ' ' ILE . 3.3 m -124.23 156.33 31.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.919 -0.582 . . . . 24.75 111.698 -179.525 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . 0.45 ' O ' HG12 ' A' ' 121' ' ' ILE . 61.9 p -99.22 147.16 25.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.696 -0.683 . . . . 27.239999999999998 110.272 179.676 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . 0.436 ' O ' ' HB2' ' A' ' 122' ' ' ASP . 14.8 m-20 -53.55 -17.67 2.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.258 -0.428 . . . . 26.629999999999999 111.439 -179.593 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -79.93 -55.71 4.77 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.739 0.304 . . . . 29.140000000000001 111.381 -179.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.401 ' OE1' HG12 ' A' ' 116' ' ' VAL . 14.7 pt-20 -61.79 -35.03 76.99 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.412 -0.358 . . . . 24.190000000000001 111.44 -179.539 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.462 ' O ' HG13 ' A' ' 125' ' ' ILE . 7.4 pt -78.01 -33.52 18.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 C-N-CA 120.976 -0.289 . . . . 22.329999999999998 111.174 -179.909 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.442 ' N ' HG13 ' A' ' 121' ' ' ILE . 12.7 t70 -55.85 -44.83 78.37 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.598 -0.519 . . . . 24.289999999999999 109.598 178.819 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -67.66 -42.59 81.95 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.621 -0.718 . . . . 24.739999999999998 110.214 179.073 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 54.7 ttp -58.1 -37.06 73.82 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.026 -0.533 . . . . 19.710000000000001 110.99 179.643 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.462 HG13 ' O ' ' A' ' 121' ' ' ILE . 77.3 mt -65.87 -45.32 91.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.278 -0.419 . . . . 19.949999999999999 110.38 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 61.3 ttt180 -58.68 -38.05 77.38 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.81 -0.632 . . . . 24.949999999999999 111.089 179.753 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -63.01 -28.12 69.89 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.205 -0.452 . . . . 18.690000000000001 111.076 -179.88 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.536 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -103.44 -6.61 21.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.259 -0.428 . . . . 16.469999999999999 111.038 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 54.4 t0 -109.34 100.96 10.0 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.15 -0.477 . . . . 20.399999999999999 111.071 -179.583 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 92.6 m-85 -70.38 -48.82 54.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.948 -0.569 . . . . 21.43 111.018 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -64.99 -21.85 66.91 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.182 -0.463 . . . . 23.370000000000001 110.863 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 55.26 55.51 28.01 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.941 -0.647 . . . . 24.32 112.698 179.74 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -101.73 -7.07 22.93 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.826 0.346 . . . . 23.879999999999999 110.765 179.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 89.93 9.49 65.85 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.844 -0.693 . . . . 22.670000000000002 112.305 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 68.3 mtp -134.93 154.38 51.71 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.843 0.354 . . . . 22.91 110.835 -179.901 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.554 HG23 ' HB2' ' A' ' 140' ' ' GLU . 27.8 mm -114.87 144.0 23.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.1 -0.5 . . . . 18.41 111.812 -179.516 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . 0.582 HD22 ' H ' ' A' ' 139' ' ' GLU . 6.3 t30 -114.59 157.15 23.43 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.43 -0.805 . . . . 16.82 108.993 178.437 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.683 ' O ' HG23 ' A' ' 142' ' ' VAL . 39.4 t80 -40.85 -24.08 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 111.821 0.304 . . . . 14.65 111.821 -179.828 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.582 ' H ' HD22 ' A' ' 137' ' ' ASN . 10.6 mm-40 -80.8 -56.25 4.26 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 120.818 0.342 . . . . 14.82 110.983 -179.359 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.554 ' HB2' HG23 ' A' ' 136' ' ' ILE . 39.5 mt-10 -59.09 -29.45 67.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.134 0.492 . . . . 17.460000000000001 109.892 179.539 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.451 ' CZ ' HG21 ' A' ' 145' ' ' ILE . 86.5 t80 -66.37 -55.41 16.0 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.585 -0.734 . . . . 12.93 109.834 179.141 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.683 HG23 ' O ' ' A' ' 138' ' ' TYR . 55.3 t -47.67 -36.53 5.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.65 -0.704 . . . . 10.699999999999999 111.273 179.022 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 79.4 t90 -67.81 -55.97 10.98 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.833 0.679 . . . . 13.66 112.833 -178.656 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . 0.536 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 15.5 ptt? -65.72 -28.72 69.26 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 113.348 0.87 . . . . 14.5 113.348 -177.564 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . 0.542 ' O ' ' HG2' ' A' ' 148' ' ' LYS . 49.2 pt -73.19 -42.05 58.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 C-N-CA 120.832 -0.347 . . . . 11.25 111.763 -179.388 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . 0.538 ' N ' HG13 ' A' ' 145' ' ' ILE . 79.0 p -64.6 -13.03 51.52 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.227 0.536 . . . . 8.5399999999999991 109.845 179.374 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 147' ' ' GLN . . . . . . . . . . . . . 11.1 mm-40 -122.11 13.1 10.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.265 -0.88 . . . . 11.869999999999999 111.839 -178.355 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . 0.542 ' HG2' ' O ' ' A' ' 145' ' ' ILE . 19.2 pttp . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.162 -0.923 . . . . 13.68 110.914 179.611 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 149' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 151' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 56.5 m . . . . . 0 N--CA 1.486 1.362 0 CA-C-O 120.771 0.319 . . . . 4.8899999999999997 110.929 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -163.79 148.83 10.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.173 -0.467 . . . . 3.2599999999999998 110.886 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.442 HD13 ' SG ' ' A' ' 69' ' ' CYS . 56.2 mt -67.25 91.03 0.23 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.251 -0.431 . . . . 1.27 110.674 -179.98 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 58.8 p -80.02 -170.71 2.58 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.261 -0.427 . . . . 1.1200000000000001 111.423 -179.679 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -66.15 -46.79 76.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.277 -0.42 . . . . 2.2000000000000002 111.259 -179.829 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -71.9 -38.81 69.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.235 -0.439 . . . . 1.3500000000000001 110.947 -179.519 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 15.9 mm100 -64.64 -44.38 90.65 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.108 -0.496 . . . . 2.2200000000000002 110.676 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.519 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 45.7 mt -59.35 -50.47 79.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.376 -0.374 . . . . 0.54000000000000004 110.484 179.598 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.89 -19.78 65.79 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.111 -0.495 . . . . 0.5 111.08 179.888 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -71.44 -56.2 6.42 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.231 -0.44 . . . . 2.27 111.887 -178.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.519 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 20.1 p90 -78.67 -27.96 45.24 Favored 'General case' 0 C--N 1.333 -0.122 0 C-N-CA 120.565 -0.454 . . . . 0.37 110.863 -179.823 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 27.3 tptp -61.83 -37.65 85.23 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.272 -0.64 . . . . 1.23 109.272 178.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.412 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 22.8 t70 -69.39 -49.93 50.82 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.719 -0.673 . . . . 0.44 109.488 178.483 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.26 -14.82 42.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.617 -0.72 . . . . 0.28999999999999998 110.79 179.389 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 47.3 t80 -80.5 -51.84 8.32 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.975 -0.557 . . . . 0.47999999999999998 110.863 -179.61 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 13.6 m -66.1 -19.55 25.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.091 0.472 . . . . 1.1100000000000001 110.629 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.412 ' HG2' ' O ' ' A' ' 14' ' ' ASP . 73.5 mm-40 -65.22 -21.8 66.8 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.648 -0.706 . . . . 1.6000000000000001 111.37 179.588 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 -110.85 12.34 22.34 Favored 'General case' 0 N--CA 1.462 0.174 0 N-CA-C 112.026 0.38 . . . . 0.64000000000000001 112.026 -179.499 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -100.96 92.55 5.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.023 0.44 . . . . 0.44 110.716 179.483 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -99.7 -1.13 38.66 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.885 -0.598 . . . . 2.1000000000000001 111.222 -179.883 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -95.29 -23.19 17.33 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.186 -0.461 . . . . 1.8 111.465 -179.299 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.1 7.21 87.69 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.831 -0.7 . . . . 0.46000000000000002 112.796 179.784 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 24.3 p -84.53 17.36 2.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.589 0.233 . . . . 0.40000000000000002 111.172 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 57.48 18.0 28.27 Favored Glycine 0 C--N 1.332 0.332 0 C-N-CA 120.718 -0.753 . . . . 0.33000000000000002 111.841 -179.475 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.667 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 44.8 mtpt -136.82 154.71 50.45 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.598 -0.301 . . . . 1.1000000000000001 110.444 -179.443 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.48 ' CD1' HD12 ' A' ' 35' ' ' LEU . 44.1 pt -119.68 135.45 59.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 120.612 0.244 . . . . 0.5 111.048 179.948 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -49.17 132.12 19.54 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.499 -0.319 . . . . 0.29999999999999999 110.894 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 5.9 t -61.03 -17.05 50.19 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.129 -0.487 . . . . 1.03 111.019 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 69.3 mtt180 -79.23 -2.67 42.22 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.826 -0.625 . . . . 3.0800000000000001 110.653 179.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -116.83 -8.8 11.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.79 -0.641 . . . . 2.2599999999999998 110.799 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.402 ' O ' ' HG3' ' A' ' 36' ' ' MET . 0.8 OUTLIER -55.64 -48.09 75.55 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.155 -0.475 . . . . 1.3700000000000001 110.228 179.916 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.595 ' HA2' HD11 ' A' ' 48' ' ' LEU . . . -56.1 -41.34 85.44 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.503 -0.856 . . . . 0.32000000000000001 111.485 179.28 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 77.3 m -65.54 -28.91 69.51 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.066 0.46 . . . . 0.31 110.314 179.069 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.48 HD12 ' CD1' ' A' ' 27' ' ' ILE . 0.2 OUTLIER -70.83 -35.07 72.31 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.751 -0.659 . . . . 1.24 110.593 -179.982 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.441 ' SD ' ' HG3' ' A' ' 43' ' ' PRO . 26.7 mtp -80.27 -21.62 42.53 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.224 -0.444 . . . . 1.1000000000000001 110.648 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -77.0 -37.33 55.3 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.069 -0.514 . . . . 2.6899999999999999 110.224 179.277 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 5.9 t -73.41 -12.17 60.72 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.802 -0.636 . . . . 1.0600000000000001 110.636 179.266 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 65.5 mt -111.86 155.71 23.18 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.798 -0.637 . . . . 1.26 110.366 -179.895 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -50.73 -18.12 2.49 Favored Glycine 0 CA--C 1.52 0.352 0 CA-C-N 115.929 -0.578 . . . . 0.68999999999999995 114.358 -178.737 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 26.7 mp0 -65.54 141.61 58.4 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 117.354 0.577 . . . . 1.97 111.352 -179.859 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 48.9 m-80 -129.29 72.65 81.96 Favored Pre-proline 0 C--N 1.331 -0.225 0 CA-C-N 116.196 -0.456 . . . . 2.6600000000000001 110.857 179.393 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.441 ' HG3' ' SD ' ' A' ' 36' ' ' MET . 29.4 Cg_endo -60.83 148.96 90.54 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.719 2.28 . . . . 0.51000000000000001 112.309 179.806 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 32.3 m -77.34 150.02 35.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.167 -0.469 . . . . 0.72999999999999998 110.6 179.565 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.409 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 1.0 OUTLIER -49.41 -55.23 13.79 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.573 0.225 . . . . 2.7000000000000002 111.483 -179.556 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -55.89 -42.79 76.49 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.443 -0.344 . . . . 0.46000000000000002 111.735 -179.497 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -62.29 -53.89 48.62 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.375 -0.375 . . . . 2.23 110.95 -179.57 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.595 HD11 ' HA2' ' A' ' 33' ' ' GLY . 14.5 tp -55.57 -42.22 74.42 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.009 -0.541 . . . . 1.3600000000000001 111.168 -179.745 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.409 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 85.2 mm-40 -69.27 -32.13 71.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.47 -0.332 . . . . 1.22 111.281 -179.686 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 76.6 m-20 -70.62 -51.5 27.7 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.527 -0.306 . . . . 0.62 111.638 -179.727 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.489 HD21 ' HA ' ' A' ' 48' ' ' LEU . 1.8 pp -65.85 -41.16 92.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.624 -0.262 . . . . 0.39000000000000001 111.508 -179.516 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 60.5 mt -62.79 -49.2 84.65 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-O 120.808 0.337 . . . . 0.5 110.477 179.51 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.77 -34.19 76.73 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.214 -0.448 . . . . 0.58999999999999997 110.381 179.471 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -63.85 -50.22 69.7 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.008 -0.542 . . . . 2.54 110.145 179.305 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -71.99 -14.59 61.93 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.93 -0.577 . . . . 0.53000000000000003 110.984 179.446 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -68.99 -55.4 10.98 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.303 -0.408 . . . . 1.95 111.301 -179.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 7.6 p30 -97.03 48.58 1.05 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.033 0.444 . . . . 2.48 111.083 -179.757 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 10.4 m120 -156.21 -41.31 0.08 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.721 -0.672 . . . . 2.48 110.719 179.887 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 21.6 m-80 -115.17 23.33 12.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.967 -0.56 . . . . 2.0499999999999998 110.694 179.866 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 12.3 m120 65.87 -78.21 0.04 OUTLIER 'General case' 0 C--O 1.232 0.178 0 CA-C-N 115.869 -0.605 . . . . 1.47 111.052 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -159.24 23.21 0.3 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.671 -0.776 . . . . 0.42999999999999999 112.729 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.667 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -126.93 155.19 43.47 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.348 0.594 . . . . 0.38 111.639 -179.938 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.492 HD13 ' N ' ' A' ' 64' ' ' ASN . 1.2 tm? -121.97 148.25 45.03 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.108 -0.951 . . . . 1.4299999999999999 109.002 -179.714 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . 0.518 ' OD1' ' HE3' ' A' ' 26' ' ' LYS . 0.1 OUTLIER -111.35 155.67 22.75 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.587 -0.445 . . . . 1.1899999999999999 111.965 -178.561 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.482 ' O ' ' HB2' ' A' ' 69' ' ' CYS . 70.0 t80 -51.99 -31.52 29.83 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.638 -0.71 . . . . 0.40000000000000002 110.713 179.491 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -77.13 -36.6 55.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.327 -0.397 . . . . 0.81000000000000005 111.868 -179.914 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -63.68 -46.46 85.44 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 110.043 -0.354 . . . . 1.3600000000000001 110.043 179.767 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.451 ' HE2' ' HB2' ' A' ' 12' ' ' PHE . 31.0 t80 -68.44 -51.52 42.76 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.183 -0.462 . . . . 0.51000000000000001 110.472 179.263 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.482 ' HB2' ' O ' ' A' ' 65' ' ' PHE . 2.1 t -53.43 -45.86 69.57 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-O 120.945 0.402 . . . . 0.75 110.121 179.739 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -52.61 -51.27 44.84 Favored Glycine 0 N--CA 1.448 -0.542 0 CA-C-N 115.666 -0.697 . . . . 0.40999999999999998 111.68 179.463 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.472 ' HA ' ' HG2' ' A' ' 74' ' ' LYS . 13.0 mt -61.9 -39.44 83.57 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.316 0 CA-C-O 121.026 0.441 . . . . 0.51000000000000001 110.602 179.429 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 3.4 mtp -57.88 -30.21 65.66 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.802 -0.635 . . . . 1.01 110.096 179.618 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.25 -45.72 65.87 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.965 -0.561 . . . . 0.69999999999999996 110.799 179.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.472 ' HG2' ' HA ' ' A' ' 71' ' ' ILE . 58.2 pttt -75.52 -25.46 57.26 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.194 -0.457 . . . . 1.3799999999999999 111.767 -179.667 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . 0.515 ' O ' ' HB3' ' A' ' 78' ' ' GLU . 4.4 tt0 -82.53 -43.95 16.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.056 0.455 . . . . 1.98 110.851 -179.533 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . 0.433 ' SD ' HD23 ' A' ' 4' ' ' LEU . 29.0 mtt -63.37 -40.28 96.84 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.787 -0.642 . . . . 1.2 111.41 179.751 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.433 ' NE ' ' HA ' ' A' ' 74' ' ' LYS . 33.9 ptt180 -67.68 -31.07 70.79 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.321 -0.4 . . . . 4.6900000000000004 111.248 -179.659 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.515 ' HB3' ' O ' ' A' ' 75' ' ' GLN . 2.9 tt0 -42.51 -35.34 1.04 Allowed 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.459 -0.337 . . . . 4.0099999999999998 111.24 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 53.7 m -49.44 -55.32 13.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.152 -0.476 . . . . 5.2800000000000002 110.887 179.636 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -96.78 -80.49 0.43 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.184 -0.462 . . . . 5.5999999999999996 110.641 179.386 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.577 ' O ' ' HG3' ' A' ' 85' ' ' MET . 61.9 m 31.07 86.23 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 116.105 -0.498 . . . . 7.29 111.993 -179.671 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.459 ' HA ' ' SD ' ' A' ' 85' ' ' MET . 38.6 tt0 -44.88 -41.73 7.39 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.002 -0.544 . . . . 9.7400000000000002 112.456 -179.163 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -55.92 -54.02 49.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.786 0.327 . . . . 12.109999999999999 111.623 -179.372 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.528 ' H ' HG22 ' A' ' 81' ' ' THR . 37.0 tt0 -63.24 -18.75 63.89 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.305 -0.407 . . . . 10.869999999999999 111.386 -179.467 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . 0.577 ' HG3' ' O ' ' A' ' 81' ' ' THR . 6.6 mtp -74.74 -35.62 62.62 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-O 121.185 0.517 . . . . 11.09 109.894 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 15.9 ttm180 -68.63 -51.46 41.97 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.542 -0.754 . . . . 15.52 110.295 179.457 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.438 ' HA ' ' HD3' ' A' ' 90' ' ' LYS . 16.2 mm-40 -58.41 -39.16 78.98 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.11 -0.496 . . . . 14.85 110.501 179.32 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -69.87 -33.02 71.68 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.006 -0.543 . . . . 14.109999999999999 110.568 179.543 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 52.8 t80 -66.78 -29.05 68.9 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.949 -0.568 . . . . 15.73 110.234 179.594 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.438 ' HD3' ' HA ' ' A' ' 87' ' ' GLU . 24.9 mtpp -73.32 -46.48 49.19 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.475 -0.784 . . . . 17.66 110.945 179.783 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 75.2 mt -58.6 -50.52 78.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.164 -0.471 . . . . 18.149999999999999 111.245 -179.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.553 ' HD1' HG11 ' A' ' 108' ' ' VAL . 22.3 m-85 -64.08 -43.4 95.51 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.36 -0.382 . . . . 18.34 110.976 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 30.7 t0 -64.47 93.28 0.1 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.997 0.427 . . . . 19.289999999999999 110.297 179.621 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -56.48 -29.42 61.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.778 -0.646 . . . . 22.25 111.532 -179.269 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -101.12 177.97 4.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.874 0.369 . . . . 23.34 111.028 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -101.0 0.27 54.99 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.949 -0.643 . . . . 22.0 112.002 179.364 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -70.36 -22.36 62.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.701 0.286 . . . . 22.280000000000001 111.659 -179.691 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 86.39 45.45 5.56 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.705 -0.76 . . . . 19.93 112.492 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . 0.43 ' HA ' ' O ' ' A' ' 136' ' ' ILE . 99.6 m-85 -147.64 138.86 23.62 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.595 0.236 . . . . 20.300000000000001 111.04 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 53.7 mt -114.13 117.43 55.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 121.009 0.433 . . . . 19.370000000000001 110.756 179.407 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 68.1 m -114.11 157.32 42.49 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 115.736 -0.666 . . . . 22.489999999999998 111.046 -179.296 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . 0.434 ' HG3' HD12 ' A' ' 125' ' ' ILE . 94.4 Cg_exo -41.45 -36.57 2.92 Favored 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 122.602 2.201 . . . . 23.0 112.742 -179.832 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.32 -40.9 81.52 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.161 -0.472 . . . . 24.559999999999999 111.17 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.487 ' O ' HG12 ' A' ' 108' ' ' VAL . 43.2 mt-10 -78.02 -22.85 48.64 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.835 -0.62 . . . . 22.23 109.878 -179.473 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.563 HD22 ' HB ' ' A' ' 121' ' ' ILE . 3.4 tt -77.0 -43.04 36.3 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 115.215 -0.902 . . . . 20.359999999999999 111.128 -179.445 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.414 ' O ' HG13 ' A' ' 110' ' ' ILE . 54.2 ttt180 -66.57 -48.27 70.15 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.468 -0.333 . . . . 27.190000000000001 110.346 179.463 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 8.5 m-85 -55.86 -50.69 69.9 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.159 -0.473 . . . . 25.359999999999999 111.492 -179.681 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.553 HG11 ' HD1' ' A' ' 92' ' ' PHE . 9.3 p -63.99 -43.13 97.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.582 0.229 . . . . 21.059999999999999 111.568 -179.623 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.472 ' N ' HG13 ' A' ' 108' ' ' VAL . 9.0 mmt -58.98 -43.19 91.37 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 120.773 0.32 . . . . 20.93 111.013 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.414 HG13 ' O ' ' A' ' 106' ' ' ARG . 90.9 mt -67.33 -21.6 28.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.144 -0.48 . . . . 25.129999999999999 110.313 179.704 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 84.1 m-20 -79.74 -37.64 35.06 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.861 -0.609 . . . . 23.32 110.495 179.345 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.451 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 58.2 mt -59.64 -36.02 75.54 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.103 -0.499 . . . . 21.07 110.422 179.754 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 133.84 -15.88 4.55 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.858 -0.687 . . . . 23.050000000000001 112.22 -179.808 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -93.62 165.2 12.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.863 0.363 . . . . 22.59 111.227 -179.689 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -124.07 128.06 48.76 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.064 -0.517 . . . . 27.960000000000001 110.676 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . 0.424 ' HB ' HG23 ' A' ' 121' ' ' ILE . 2.8 m -135.57 146.79 29.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.207 -0.451 . . . . 24.75 111.624 -179.885 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 59.5 p -89.32 147.15 24.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.734 -0.666 . . . . 27.239999999999998 110.223 179.331 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -53.74 -19.04 3.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.21 -0.45 . . . . 26.629999999999999 111.411 -179.521 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -78.5 -54.64 5.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.405 -0.362 . . . . 29.140000000000001 111.575 -179.51 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.413 ' OE1' HG12 ' A' ' 116' ' ' VAL . 14.0 pt-20 -61.46 -37.92 85.34 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.557 -0.292 . . . . 24.190000000000001 111.769 -179.063 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.563 ' HB ' HD22 ' A' ' 105' ' ' LEU . 47.8 pt -74.32 -35.88 41.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 C-N-CA 120.689 -0.404 . . . . 22.329999999999998 111.062 179.99 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -58.72 -37.6 76.5 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.915 0.388 . . . . 24.289999999999999 110.365 179.251 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -69.53 -47.1 64.85 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.912 -0.585 . . . . 24.739999999999998 110.709 179.693 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 56.5 ttp -53.37 -38.71 63.59 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 116.246 -0.433 . . . . 19.710000000000001 110.76 179.658 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.535 HG23 HD11 ' A' ' 136' ' ' ILE . 79.7 mt -67.42 -42.99 87.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.118 -0.492 . . . . 19.949999999999999 110.473 179.686 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 3.2 tmt_? -61.87 -30.52 70.92 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.989 -0.551 . . . . 24.949999999999999 110.942 179.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -69.87 -28.01 65.29 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.354 -0.385 . . . . 18.690000000000001 111.127 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.652 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -104.66 -6.73 20.17 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.087 -0.506 . . . . 16.469999999999999 111.347 -179.808 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . 0.409 ' OD1' ' N ' ' A' ' 132' ' ' GLY . 3.0 t0 -112.36 105.0 13.18 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.033 0.444 . . . . 20.399999999999999 111.431 -179.102 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 74.3 m-85 -71.51 -7.58 48.44 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.749 -0.659 . . . . 21.43 111.031 179.597 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -128.21 -7.62 5.35 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.091 -0.504 . . . . 23.370000000000001 110.718 179.914 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . 0.412 ' O ' ' N ' ' A' ' 134' ' ' GLY . . . 61.31 -84.93 0.03 OUTLIER Glycine 0 N--CA 1.447 -0.607 0 CA-C-N 115.703 -0.68 . . . . 24.32 112.049 -179.484 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . 0.474 ' O ' ' HG3' ' A' ' 135' ' ' MET . 0.8 OUTLIER 44.08 17.14 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 123.43 0.692 . . . . 23.879999999999999 111.809 -179.669 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . 0.412 ' N ' ' O ' ' A' ' 132' ' ' GLY . . . 53.33 23.56 19.01 Favored Glycine 0 CA--C 1.522 0.487 0 CA-C-N 115.923 -0.58 . . . . 22.670000000000002 114.085 179.547 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . 0.474 ' HG3' ' O ' ' A' ' 133' ' ' ASP . 40.3 mtp -145.35 142.73 29.65 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 117.431 0.616 . . . . 22.91 110.828 179.408 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.61 HG23 ' HB2' ' A' ' 140' ' ' GLU . 29.9 mm -113.56 146.82 17.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 121.233 0.539 . . . . 18.41 111.586 -179.091 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -114.65 156.96 23.77 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.413 -0.812 . . . . 16.82 109.525 179.025 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 49.1 t80 -43.14 -21.48 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 111.789 0.292 . . . . 14.65 111.789 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -80.95 -56.35 4.17 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 120.949 0.404 . . . . 14.82 111.032 -179.517 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.61 ' HB2' HG23 ' A' ' 136' ' ' ILE . 58.6 mt-10 -61.9 -32.79 73.2 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.216 0.532 . . . . 17.460000000000001 110.104 179.797 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.455 ' CZ ' HG21 ' A' ' 145' ' ' ILE . 81.2 t80 -65.28 -54.15 33.48 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.586 -0.734 . . . . 12.93 109.854 178.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.524 HG13 ' SD ' ' A' ' 85' ' ' MET . 2.5 t -48.89 -35.21 6.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.39 -0.823 . . . . 10.699999999999999 111.555 179.265 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 143' ' ' TRP . . . . . 0.511 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 92.0 t90 -69.27 -55.94 9.03 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.588 0.588 . . . . 13.66 112.588 -179.066 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . 0.652 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 21.9 ptt? -64.26 -24.93 67.84 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 113.324 0.861 . . . . 14.5 113.324 -177.674 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . 0.534 HG13 ' N ' ' A' ' 146' ' ' SER . 39.7 pt -80.61 -38.27 17.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 111.993 0.368 . . . . 11.25 111.993 -179.51 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . 0.534 ' N ' HG13 ' A' ' 145' ' ' ILE . 39.9 t -59.67 -13.55 10.25 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.225 0.536 . . . . 8.5399999999999991 110.559 -179.883 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 147' ' ' GLN . . . . . 0.511 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 2.8 mm-40 -94.51 -22.8 18.0 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.402 -0.817 . . . . 11.869999999999999 111.032 -179.152 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 99.1 mttt . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.223 -0.894 . . . . 13.68 111.003 179.808 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 149' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 151' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 35.5 t . . . . . 0 N--CA 1.485 1.316 0 CA-C-O 120.765 0.317 . . . . 4.8899999999999997 110.836 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 64.23 123.28 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.138 0 CA-C-N 115.974 -0.557 . . . . 3.2599999999999998 111.072 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 18.5 mt -56.29 98.44 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.182 -0.463 . . . . 1.27 110.684 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.55 HG22 ' H ' ' A' ' 6' ' ' GLU . 0.2 OUTLIER -84.87 176.17 8.66 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.006 -0.543 . . . . 1.1200000000000001 110.857 -179.813 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.55 ' H ' HG22 ' A' ' 5' ' ' THR . 33.6 tt0 -62.59 -37.75 87.42 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.251 0.548 . . . . 2.2000000000000002 110.32 179.883 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -75.38 -45.76 37.17 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.377 -0.829 . . . . 1.3500000000000001 110.923 -179.634 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -62.46 -45.73 91.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.056 -0.52 . . . . 2.2200000000000002 110.909 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.543 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 80.7 mt -57.46 -54.74 27.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 116.123 -0.49 . . . . 0.54000000000000004 111.096 179.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.78 -24.08 65.5 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.246 -0.434 . . . . 0.5 111.88 -179.525 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -72.54 -56.19 5.76 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 112.135 0.42 . . . . 2.27 112.135 -179.08 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.543 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 5.2 p90 -76.98 -24.29 52.26 Favored 'General case' 0 C--N 1.332 -0.158 0 C-N-CA 120.614 -0.434 . . . . 0.37 110.728 -179.591 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.429 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 18.6 tptp -65.62 -39.77 91.85 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.259 -0.645 . . . . 1.23 109.259 178.87 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.456 ' O ' HG22 ' A' ' 17' ' ' VAL . 17.9 t70 -68.1 -44.33 76.47 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 108.994 -0.743 . . . . 0.44 108.994 177.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.09 -15.11 62.8 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 115.249 -0.887 . . . . 0.28999999999999998 110.42 179.275 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.429 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 74.1 t80 -79.6 -48.28 14.04 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.821 -0.627 . . . . 0.47999999999999998 110.527 -179.734 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.456 HG22 ' O ' ' A' ' 14' ' ' ASP . 30.1 m -66.01 -23.1 31.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 121.0 0.428 . . . . 1.1100000000000001 110.253 179.822 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.45 ' HG2' ' O ' ' A' ' 14' ' ' ASP . 26.5 mm-40 -57.02 -45.79 82.82 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 115.791 -0.641 . . . . 1.6000000000000001 111.799 179.358 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -85.63 22.5 1.58 Allowed 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 112.053 0.39 . . . . 0.64000000000000001 112.053 -179.252 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -120.87 78.82 1.43 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.026 0.441 . . . . 0.44 110.815 179.646 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 11.4 mmmm -89.86 -24.71 21.33 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.854 -0.612 . . . . 2.1000000000000001 110.999 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -67.54 -35.66 79.48 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.963 -0.562 . . . . 1.8 111.23 -179.608 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 101.83 3.51 52.17 Favored Glycine 0 C--N 1.331 0.255 0 C-N-CA 120.686 -0.768 . . . . 0.46000000000000002 112.819 179.847 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 53.6 p -80.2 7.12 10.02 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.731 0.3 . . . . 0.40000000000000002 111.202 179.885 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 56.96 19.42 30.11 Favored Glycine 0 C--N 1.333 0.405 0 C-N-CA 120.746 -0.74 . . . . 0.33000000000000002 111.986 -179.611 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.467 ' C ' HE22 ' A' ' 62' ' ' GLN . 29.6 mtpt -126.34 155.7 41.64 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.696 0.284 . . . . 1.1000000000000001 111.104 -179.593 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.466 HG13 ' HB2' ' A' ' 63' ' ' LEU . 41.3 pt -114.69 130.12 69.64 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 CA-C-O 120.915 0.388 . . . . 0.5 111.591 -179.843 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -54.53 134.36 46.35 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.091 -0.504 . . . . 0.29999999999999999 111.161 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.486 ' HA ' HD11 ' A' ' 63' ' ' LEU . 6.1 t -66.82 -8.22 27.15 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.055 -0.52 . . . . 1.03 111.053 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 53.9 mtp180 -89.34 -1.19 57.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.912 -0.586 . . . . 3.0800000000000001 110.491 179.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -127.62 2.05 6.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.808 -0.633 . . . . 2.2599999999999998 110.971 -179.658 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.464 HD21 ' CD1' ' A' ' 68' ' ' PHE . 2.7 tm? -57.09 -51.8 67.82 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.396 -0.365 . . . . 1.3700000000000001 110.581 -179.791 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.466 ' O ' ' HG3' ' A' ' 37' ' ' ARG . . . -55.55 -44.22 85.75 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.376 -0.916 . . . . 0.32000000000000001 111.443 179.236 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 87.9 m -56.32 -36.17 68.41 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.105 0.478 . . . . 0.31 110.22 179.124 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.449 ' HB3' ' O ' ' A' ' 32' ' ' LEU . 42.2 tp -65.92 -32.4 73.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.635 -0.712 . . . . 1.24 110.347 179.483 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 16.6 mtp -80.91 -20.17 42.72 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.744 -0.662 . . . . 1.1000000000000001 110.812 179.793 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.466 ' HG3' ' O ' ' A' ' 33' ' ' GLY . 71.8 mtp180 -74.72 -43.36 55.47 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.344 -0.389 . . . . 2.6899999999999999 110.646 179.753 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.3 t -65.74 -14.0 60.45 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.168 -0.469 . . . . 1.0600000000000001 110.981 179.658 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.507 ' HB3' ' OE1' ' A' ' 41' ' ' GLN . 9.7 mp -113.9 156.14 24.5 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.028 -0.533 . . . . 1.26 110.539 179.491 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -55.15 -7.37 1.14 Allowed Glycine 0 CA--C 1.521 0.455 0 N-CA-C 114.931 0.732 . . . . 0.68999999999999995 114.931 -178.497 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.507 ' OE1' ' HB3' ' A' ' 39' ' ' LEU . 16.0 mp0 -59.44 -79.72 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 117.86 0.83 . . . . 1.97 110.998 179.697 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 53.69 74.24 0.79 Allowed Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.216 -0.447 . . . . 2.6600000000000001 111.118 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -71.42 -167.76 0.31 Allowed 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.509 2.14 . . . . 0.51000000000000001 112.442 179.79 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 9.9 m -86.27 157.16 19.99 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.125 -0.489 . . . . 0.72999999999999998 110.934 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -61.32 -55.05 36.1 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.677 0.275 . . . . 2.7000000000000002 111.056 -179.745 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.57 -53.09 56.66 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.216 -0.447 . . . . 0.46000000000000002 111.374 -179.843 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -54.87 -41.66 71.1 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.207 -0.451 . . . . 2.23 110.247 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.451 ' HA ' HD21 ' A' ' 51' ' ' LEU . 27.3 tp -60.61 -39.44 88.19 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.722 -0.672 . . . . 1.3600000000000001 110.641 179.68 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 86.2 mm-40 -70.49 -30.8 67.68 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.145 -0.48 . . . . 1.22 110.823 179.769 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 30.4 m-20 -67.08 -49.31 65.48 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.208 -0.451 . . . . 0.62 111.481 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.451 HD21 ' HA ' ' A' ' 48' ' ' LEU . 1.0 OUTLIER -71.06 -38.96 72.49 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.637 -0.256 . . . . 0.39000000000000001 111.401 -179.586 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 73.4 mt -65.88 -32.19 57.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 120.74 0.305 . . . . 0.5 110.636 179.607 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -68.66 -50.8 48.29 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.254 -0.43 . . . . 0.58999999999999997 110.839 179.695 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -65.24 -32.91 74.82 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.892 0.377 . . . . 2.54 110.277 179.526 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.45 ' HB1' HD21 ' A' ' 63' ' ' LEU . . . -79.85 -14.83 58.37 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.044 -0.525 . . . . 0.53000000000000003 110.838 179.415 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -70.09 -39.41 75.6 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.189 -0.459 . . . . 1.95 110.84 179.838 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -82.64 -22.83 34.53 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.145 -0.48 . . . . 2.48 110.969 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -91.42 136.74 32.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.201 -0.454 . . . . 2.48 111.015 -179.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . 0.418 ' C ' ' H ' ' A' ' 61' ' ' GLY . 88.0 m-20 64.01 6.46 2.85 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.957 -0.565 . . . . 2.0499999999999998 111.362 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 18.6 m-80 71.01 -27.03 0.17 Allowed 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 112.474 0.546 . . . . 1.47 112.474 179.244 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . 0.418 ' H ' ' C ' ' A' ' 59' ' ' ASN . . . 160.91 34.97 0.02 OUTLIER Glycine 0 C--N 1.33 0.23 0 C-N-CA 120.301 -0.952 . . . . 0.42999999999999999 112.933 -179.937 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.513 HE21 ' HA ' ' A' ' 62' ' ' GLN . 0.0 OUTLIER -141.65 154.69 45.52 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.929 0.395 . . . . 0.38 111.167 179.663 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.486 HD11 ' HA ' ' A' ' 29' ' ' THR . 17.9 mt -127.96 153.84 46.26 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.876 -0.602 . . . . 1.4299999999999999 110.332 179.908 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -113.43 156.99 22.5 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 110.288 -0.264 . . . . 1.1899999999999999 110.288 -179.91 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.494 ' O ' ' HB2' ' A' ' 69' ' ' CYS . 77.6 t80 -44.32 -34.6 2.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.813 0.34 . . . . 0.40000000000000002 110.44 179.339 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -76.97 -33.7 57.62 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.088 -0.505 . . . . 0.81000000000000005 111.926 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -64.67 -50.13 68.27 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.012 0.434 . . . . 1.3600000000000001 110.062 179.208 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.466 ' HE2' ' HB2' ' A' ' 12' ' ' PHE . 31.3 t80 -64.8 -53.54 45.26 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.902 -0.59 . . . . 0.51000000000000001 110.518 179.64 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.494 ' HB2' ' O ' ' A' ' 65' ' ' PHE . 0.1 OUTLIER -55.13 -41.38 71.65 Favored 'General case' 0 CA--C 1.521 -0.168 0 CA-C-O 120.827 0.346 . . . . 0.75 110.429 179.691 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -53.06 -46.56 61.58 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.791 -0.718 . . . . 0.40999999999999998 111.392 179.375 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.492 HG23 ' CE ' ' A' ' 74' ' ' LYS . 11.3 mt -65.15 -38.53 82.91 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.421 0 CA-C-O 120.936 0.398 . . . . 0.51000000000000001 110.314 178.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . 0.5 ' O ' ' HG3' ' A' ' 76' ' ' MET . 79.4 mmm -61.99 -30.58 71.04 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.075 -0.511 . . . . 1.01 109.796 179.282 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -67.82 -43.31 79.9 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.807 -0.633 . . . . 0.69999999999999996 110.278 179.512 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.492 ' CE ' HG23 ' A' ' 71' ' ' ILE . 64.1 pttt -75.63 -29.83 59.3 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.32 -0.4 . . . . 1.3799999999999999 110.762 179.572 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 4.6 tt0 -73.0 -55.95 5.82 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.306 -0.406 . . . . 1.98 110.794 179.426 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . 0.5 ' HG3' ' O ' ' A' ' 72' ' ' MET . 43.1 mtt -58.6 -31.95 68.53 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-O 120.933 0.397 . . . . 1.2 110.584 179.375 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 16.1 tpp180 -60.22 -27.86 67.53 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-N 115.794 -0.639 . . . . 4.6900000000000004 111.232 -179.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -47.94 -23.24 0.73 Allowed 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 121.041 0.448 . . . . 4.0099999999999998 111.389 179.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 6.7 t -62.65 -0.91 0.7 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.924 -0.58 . . . . 5.2800000000000002 112.377 -179.185 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -162.52 -29.71 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.846 -0.161 . . . . 5.5999999999999996 111.254 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.474 ' O ' ' HG3' ' A' ' 85' ' ' MET . 2.6 t 36.92 84.12 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 116.082 -0.508 . . . . 7.29 111.736 -179.558 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.49 ' HA ' ' SD ' ' A' ' 85' ' ' MET . 11.7 pt-20 -80.16 -15.85 56.16 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.044 -0.526 . . . . 9.7400000000000002 112.29 -178.895 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -59.74 -55.71 30.87 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 120.988 0.423 . . . . 12.109999999999999 110.991 -179.829 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -67.99 -15.76 63.75 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.976 -0.556 . . . . 10.869999999999999 110.558 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . 0.555 ' SD ' HG13 ' A' ' 142' ' ' VAL . 8.5 mtt -80.4 -34.44 36.29 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.089 -0.505 . . . . 11.09 110.302 -179.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 37.3 ttt180 -68.78 -46.76 67.89 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.747 -0.66 . . . . 15.52 109.875 179.454 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.464 ' O ' HG12 ' A' ' 91' ' ' ILE . 38.3 tt0 -59.45 -45.19 92.3 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.886 -0.597 . . . . 14.85 109.818 178.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -64.88 -35.28 80.64 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.832 -0.622 . . . . 14.109999999999999 111.074 179.755 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 69.6 t80 -58.55 -39.2 79.57 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.099 0.476 . . . . 15.73 110.237 179.637 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 58.7 mttp -68.41 -40.1 81.4 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.665 -0.698 . . . . 17.66 110.682 179.497 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.464 HG12 ' O ' ' A' ' 87' ' ' GLU . 42.0 mm -60.06 -38.54 77.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.086 -0.506 . . . . 18.149999999999999 111.287 -179.826 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.573 ' HA ' HG21 ' A' ' 108' ' ' VAL . 12.8 m-85 -79.21 -35.37 41.78 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.386 -0.37 . . . . 18.34 111.333 -179.798 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 46.4 t0 -79.22 108.16 12.51 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.9 0.381 . . . . 19.289999999999999 110.946 -179.64 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.13 -9.55 58.82 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.979 -0.555 . . . . 22.25 111.313 -179.639 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.433 ' HB2' ' OD1' ' A' ' 97' ' ' ASP . 22.0 m-20 -117.18 168.08 10.62 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.888 0.375 . . . . 23.34 110.85 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -99.76 5.28 58.19 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.781 -0.723 . . . . 22.0 112.081 179.659 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.453 ' OD2' ' HB2' ' A' ' 99' ' ' PHE . 6.0 p-10 -63.27 -39.66 95.23 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.726 0.298 . . . . 22.280000000000001 111.061 -179.612 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 110.99 15.71 10.51 Favored Glycine 0 C--N 1.332 0.324 0 C-N-CA 120.659 -0.781 . . . . 19.93 112.921 179.727 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . 0.453 ' HB2' ' OD2' ' A' ' 97' ' ' ASP . 82.3 m-85 -139.69 152.12 46.45 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.892 0.377 . . . . 20.300000000000001 111.263 179.795 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.449 ' HB ' ' HB ' ' A' ' 136' ' ' ILE . 63.5 mt -114.68 132.13 64.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 115.964 -0.562 . . . . 19.370000000000001 110.8 179.71 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 35.2 p -114.35 155.96 45.06 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.206 -0.452 . . . . 22.489999999999998 110.756 -179.841 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_exo -40.54 -37.6 2.2 Favored 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 122.586 2.191 . . . . 23.0 112.567 -179.842 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.07 -49.52 77.02 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.131 0.491 . . . . 24.559999999999999 110.59 179.461 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.432 ' O ' HG23 ' A' ' 108' ' ' VAL . 40.8 mt-10 -69.46 -32.75 71.88 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.612 -0.722 . . . . 22.23 110.694 179.922 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.55 HD12 HD12 ' A' ' 121' ' ' ILE . 3.4 tm? -62.24 -56.03 22.56 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.018 -0.537 . . . . 20.359999999999999 110.359 -179.775 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 3.2 ttp180 -56.06 -40.59 73.77 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.193 -0.458 . . . . 27.190000000000001 111.03 179.712 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -58.38 -46.9 85.47 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.189 0.44 . . . . 25.359999999999999 112.189 -179.316 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.573 HG21 ' HA ' ' A' ' 92' ' ' PHE . 17.6 t -78.77 -54.06 12.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 N-CA-C 111.967 0.358 . . . . 21.059999999999999 111.967 -179.1 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.495 ' HG3' ' CD1' ' A' ' 105' ' ' LEU . 1.1 mmt -47.03 -22.22 0.31 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 120.706 0.289 . . . . 20.93 111.4 -179.77 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 78.1 mt -95.26 -38.83 9.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 121.023 0.439 . . . . 25.129999999999999 110.354 178.88 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -58.57 -33.16 69.63 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.681 -0.69 . . . . 23.32 110.893 179.858 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.534 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 19.1 mt -66.7 -24.93 66.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.139 -0.482 . . . . 21.07 110.832 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 117.34 -7.99 15.92 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.945 -0.645 . . . . 23.050000000000001 112.49 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -82.54 127.43 33.32 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.718 0.294 . . . . 22.59 110.918 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -87.17 104.38 16.3 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.229 -0.441 . . . . 27.960000000000001 110.713 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . 0.483 ' HB ' HG23 ' A' ' 121' ' ' ILE . 3.2 m -123.42 149.94 27.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.158 -0.474 . . . . 24.75 111.504 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . 0.453 ' O ' HG12 ' A' ' 121' ' ' ILE . 67.5 p -98.73 144.54 27.86 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.791 -0.64 . . . . 27.239999999999998 110.061 179.182 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . 0.464 ' HA ' HD11 ' A' ' 121' ' ' ILE . 5.7 m-20 -48.65 -23.08 0.9 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.051 -0.522 . . . . 26.629999999999999 111.775 -179.492 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -77.31 -55.74 5.15 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 111.743 0.275 . . . . 29.140000000000001 111.743 -179.394 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.406 ' OE1' HG12 ' A' ' 116' ' ' VAL . 13.2 pt-20 -59.52 -38.43 80.96 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.624 -0.262 . . . . 24.190000000000001 111.588 -179.19 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.55 HD12 HD12 ' A' ' 105' ' ' LEU . 33.5 pt -73.15 -34.53 45.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 C-N-CA 120.996 -0.282 . . . . 22.329999999999998 111.515 -179.946 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.415 ' N ' HG13 ' A' ' 121' ' ' ILE . 15.5 t70 -57.05 -46.23 82.61 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.91 -0.404 . . . . 24.289999999999999 109.91 179.513 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.86 -37.69 88.47 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.068 -0.515 . . . . 24.739999999999998 110.119 179.038 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 5.2 ttp -53.16 -48.41 68.01 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.034 -0.53 . . . . 19.710000000000001 110.676 179.237 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.418 HG23 HD11 ' A' ' 136' ' ' ILE . 76.8 mt -61.05 -43.13 95.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.026 -0.534 . . . . 19.949999999999999 110.449 179.711 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 29.3 ttm180 -61.76 -33.82 74.76 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.957 -0.565 . . . . 24.949999999999999 110.87 179.841 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -69.06 -19.17 64.08 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.983 -0.553 . . . . 18.690000000000001 111.171 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.634 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -113.5 -5.06 13.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.228 -0.442 . . . . 16.469999999999999 111.217 -179.922 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 18.9 t0 -107.02 101.61 11.02 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.071 0.462 . . . . 20.399999999999999 110.903 -179.679 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 85.6 m-85 -86.77 -42.72 13.1 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.797 -0.638 . . . . 21.43 111.374 -179.784 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -59.69 -23.72 63.35 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.314 -0.403 . . . . 23.370000000000001 110.909 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 64.25 78.21 0.21 Allowed Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.857 -0.687 . . . . 24.32 112.739 179.632 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -143.38 6.56 1.49 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.844 0.354 . . . . 23.879999999999999 110.794 179.568 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 67.58 20.06 71.58 Favored Glycine 0 C--N 1.331 0.289 0 C-N-CA 120.87 -0.681 . . . . 22.670000000000002 112.698 179.888 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 72.8 mtp -136.76 155.24 50.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.805 0.336 . . . . 22.91 110.636 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.715 HG23 ' HB2' ' A' ' 140' ' ' GLU . 43.6 mm -114.7 144.76 21.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 121.163 0.506 . . . . 18.41 111.51 -179.566 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . 0.435 ' ND2' ' H ' ' A' ' 138' ' ' TYR . 4.0 t-20 -114.58 156.59 24.39 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.44 -0.8 . . . . 16.82 109.031 178.744 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.435 ' H ' ' ND2' ' A' ' 137' ' ' ASN . 34.1 t80 -41.8 -24.07 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 120.864 0.364 . . . . 14.65 111.141 179.82 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.412 ' N ' ' O ' ' A' ' 137' ' ' ASN . 47.3 mt-10 -81.02 -55.35 4.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.113 -0.494 . . . . 14.82 110.632 179.928 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.715 ' HB2' HG23 ' A' ' 136' ' ' ILE . 36.9 mt-10 -57.38 -29.22 63.89 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.905 -0.589 . . . . 17.460000000000001 110.487 179.786 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.648 ' HA ' ' HE2' ' A' ' 144' ' ' MET . 86.0 t80 -71.68 -55.57 7.45 Favored 'General case' 0 C--N 1.334 -0.108 0 CA-C-N 116.06 -0.518 . . . . 12.93 110.122 179.322 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.555 HG13 ' SD ' ' A' ' 85' ' ' MET . 6.7 t -46.69 -35.13 2.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 CA-C-N 115.748 -0.66 . . . . 10.699999999999999 111.507 179.217 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 143' ' ' TRP . . . . . 0.569 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 84.1 t90 -73.35 -55.82 5.89 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.215 0.45 . . . . 13.66 112.215 -179.092 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . 0.648 ' HE2' ' HA ' ' A' ' 141' ' ' PHE . 20.1 ptt? -63.11 -19.97 64.93 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.916 0.709 . . . . 14.5 112.916 -177.884 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . 0.57 HG13 ' N ' ' A' ' 146' ' ' SER . 33.3 pt -81.44 -48.73 18.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 N-CA-C 112.02 0.378 . . . . 11.25 112.02 179.851 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . 0.57 ' N ' HG13 ' A' ' 145' ' ' ILE . 29.3 t -63.95 -14.29 52.66 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-O 121.264 0.554 . . . . 8.5399999999999991 109.999 -179.711 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 147' ' ' GLN . . . . . 0.569 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 7.6 mm-40 -124.67 18.25 8.74 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.188 -0.915 . . . . 11.869999999999999 110.268 -179.235 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . 0.549 ' HB2' ' HA ' ' A' ' 145' ' ' ILE . 14.8 ttpp . . . . . 0 C--O 1.249 1.043 0 CA-C-N 115.289 -0.869 . . . . 13.68 111.053 -179.684 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 149' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 151' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 55.1 m . . . . . 0 N--CA 1.485 1.303 0 CA-C-O 120.769 0.318 . . . . 4.8899999999999997 110.854 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -102.81 153.18 20.43 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.23 -0.441 . . . . 3.2599999999999998 110.894 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.499 HD13 ' SG ' ' A' ' 69' ' ' CYS . 72.5 mt -68.57 96.61 0.72 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.126 -0.488 . . . . 1.27 110.631 179.719 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -77.79 166.62 22.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.986 -0.552 . . . . 1.1200000000000001 111.008 -179.653 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -52.52 -52.31 55.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.512 -0.313 . . . . 2.2000000000000002 111.677 179.822 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -68.58 -40.16 80.65 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.049 0.452 . . . . 1.3500000000000001 110.838 -179.374 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -60.63 -40.88 93.54 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.644 -0.707 . . . . 2.2200000000000002 111.014 -179.837 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.518 ' HA ' ' CZ ' ' A' ' 12' ' ' PHE . 72.7 mt -63.58 -49.4 82.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.264 -0.426 . . . . 0.54000000000000004 110.414 179.821 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.98 -18.96 65.63 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.949 -0.569 . . . . 0.5 110.849 179.658 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -71.76 -56.96 4.81 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 116.06 -0.518 . . . . 2.27 111.646 -179.117 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.518 ' CZ ' ' HA ' ' A' ' 9' ' ' ILE . 9.3 p90 -77.76 -26.65 49.97 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.595 -0.442 . . . . 0.37 110.751 -179.714 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.419 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 20.0 tptm -64.23 -36.71 84.97 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.234 -0.654 . . . . 1.23 109.234 178.639 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.423 ' O ' HG22 ' A' ' 17' ' ' VAL . 19.7 t70 -67.46 -48.18 67.95 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.772 -0.649 . . . . 0.44 109.393 178.374 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.18 -14.81 61.5 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.884 -0.598 . . . . 0.28999999999999998 110.952 179.002 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.419 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 36.9 t80 -79.16 -47.49 15.96 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.866 -0.606 . . . . 0.47999999999999998 110.807 -179.4 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.423 HG22 ' O ' ' A' ' 14' ' ' ASP . 31.6 m -70.18 -24.75 26.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.135 -0.484 . . . . 1.1100000000000001 110.849 -179.916 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.415 ' HG2' ' O ' ' A' ' 14' ' ' ASP . 76.6 mm-40 -60.58 -32.14 71.24 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.96 -0.564 . . . . 1.6000000000000001 111.365 179.816 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 20.5 m-85 -85.93 -20.96 28.2 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.569 -0.287 . . . . 0.64000000000000001 111.537 -179.57 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -80.19 90.13 5.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.934 0.397 . . . . 0.44 110.855 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 12.3 mmmm -100.18 4.49 44.43 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.03 -0.532 . . . . 2.1000000000000001 111.218 -179.688 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -99.41 -36.72 9.49 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.225 -0.443 . . . . 1.8 111.233 -179.434 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 96.85 30.06 7.75 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.774 -0.727 . . . . 0.46000000000000002 112.811 179.614 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 31.1 p -103.57 10.79 36.85 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.655 0.264 . . . . 0.40000000000000002 111.166 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.93 15.96 30.12 Favored Glycine 0 C--N 1.331 0.282 0 C-N-CA 120.715 -0.755 . . . . 0.33000000000000002 112.045 -179.67 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.508 ' HE3' ' HB3' ' A' ' 62' ' ' GLN . 5.1 mtmt -139.79 151.95 46.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.661 0.267 . . . . 1.1000000000000001 110.712 -179.769 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.418 ' N ' HE22 ' A' ' 62' ' ' GLN . 50.3 pt -119.28 136.25 57.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.49 -0.323 . . . . 0.5 111.251 -179.839 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -50.39 125.9 13.81 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.356 -0.384 . . . . 0.29999999999999999 110.949 179.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 6.9 t -62.62 -16.15 55.23 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.119 -0.491 . . . . 1.03 111.036 -179.869 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 65.8 mtp180 -75.99 -18.79 59.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.082 -0.508 . . . . 3.0800000000000001 110.353 179.701 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -104.28 0.57 29.45 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.707 -0.678 . . . . 2.2599999999999998 110.478 179.621 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.419 ' O ' ' HG2' ' A' ' 36' ' ' MET . 0.9 OUTLIER -60.85 -49.49 77.26 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.025 -0.534 . . . . 1.3700000000000001 110.311 179.936 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.584 ' HA2' HD11 ' A' ' 48' ' ' LEU . . . -54.18 -39.17 63.24 Favored Glycine 0 C--N 1.332 0.343 0 C-N-CA 120.502 -0.856 . . . . 0.32000000000000001 111.347 179.077 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 94.2 m -66.24 -33.03 74.83 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.243 0.544 . . . . 0.31 109.963 178.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 65.6 tp -70.96 -20.68 62.42 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.536 -0.756 . . . . 1.24 110.701 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.419 ' HG2' ' O ' ' A' ' 32' ' ' LEU . 90.8 mmm -80.29 -49.64 11.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.259 -0.428 . . . . 1.1000000000000001 111.104 179.757 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 10.6 ptm180 -60.62 -34.39 74.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.446 -0.343 . . . . 2.6899999999999999 110.983 179.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 14.5 t -72.25 -13.16 61.45 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.065 0.46 . . . . 1.0600000000000001 110.611 179.295 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 86.1 mt -113.11 156.91 22.34 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.581 -0.736 . . . . 1.26 110.487 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -44.35 -31.73 2.42 Favored Glycine 0 CA--C 1.52 0.345 0 C-N-CA 120.686 -0.769 . . . . 0.68999999999999995 112.689 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -64.14 160.07 19.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.827 0.346 . . . . 1.97 110.965 179.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 17.6 p-10 -164.28 76.23 1.59 Allowed Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.153 -0.476 . . . . 2.6600000000000001 110.739 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -66.19 150.18 85.07 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.642 2.228 . . . . 0.51000000000000001 112.562 -179.712 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 19.6 m -71.29 157.06 38.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.04 -0.527 . . . . 0.72999999999999998 110.469 179.588 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.425 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 0.9 OUTLIER -48.48 -54.76 13.01 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 111.608 0.225 . . . . 2.7000000000000002 111.608 -179.703 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -48.16 -55.49 10.23 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.569 -0.287 . . . . 0.46000000000000002 111.749 -179.496 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -56.74 -48.44 77.78 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.318 -0.401 . . . . 2.23 110.564 -179.785 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.584 HD11 ' HA2' ' A' ' 33' ' ' GLY . 14.3 tp -57.26 -35.65 70.01 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.116 -0.493 . . . . 1.3600000000000001 110.888 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.425 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 37.0 mm-40 -72.57 -33.33 66.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.386 -0.37 . . . . 1.22 110.509 179.663 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 63.1 m-20 -69.31 -54.11 16.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.083 -0.508 . . . . 0.62 111.707 -179.725 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.54 HD21 ' HA ' ' A' ' 48' ' ' LEU . 1.2 pp -63.78 -44.08 94.44 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 112.077 0.399 . . . . 0.39000000000000001 112.077 -179.123 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 76.8 mt -64.1 -44.94 97.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.742 0.306 . . . . 0.5 111.081 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.77 -52.42 63.26 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.322 -0.399 . . . . 0.58999999999999997 111.152 -179.821 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -60.38 -34.05 73.34 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.423 -0.353 . . . . 2.54 110.637 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -77.78 -15.8 58.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.366 -0.379 . . . . 0.53000000000000003 110.914 179.553 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -80.3 -51.3 9.07 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.252 -0.431 . . . . 1.95 111.309 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 9.5 p30 -88.44 30.4 0.89 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.423 -0.353 . . . . 2.48 111.504 -179.416 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -149.34 -18.09 0.28 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.39 -0.368 . . . . 2.48 110.971 179.534 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 25.2 m-80 -135.79 21.38 3.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.217 -0.447 . . . . 2.0499999999999998 110.731 179.887 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 11.2 m120 61.49 -86.38 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.928 -0.578 . . . . 1.47 111.522 179.821 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -146.53 4.28 1.07 Allowed Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.564 -0.827 . . . . 0.42999999999999999 112.833 -179.683 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.508 ' HB3' ' HE3' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -114.96 150.41 35.79 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.03 0.443 . . . . 0.38 111.093 179.863 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.434 ' HG ' ' HB2' ' A' ' 67' ' ' GLU . 0.5 OUTLIER -118.02 153.02 34.38 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.603 -0.726 . . . . 1.4299999999999999 109.96 -179.939 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . 0.454 ' OD1' ' N ' ' A' ' 64' ' ' ASN . 0.6 OUTLIER -112.59 156.49 22.59 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.648 0.261 . . . . 1.1899999999999999 111.304 -178.388 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -48.54 -38.93 21.71 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.142 -0.481 . . . . 0.40000000000000002 110.919 179.862 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.22 -33.07 71.23 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.502 -0.317 . . . . 0.81000000000000005 111.065 179.779 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.434 ' HB2' ' HG ' ' A' ' 63' ' ' LEU . 12.9 mm-40 -66.32 -47.42 73.57 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.312 0.577 . . . . 1.3600000000000001 109.547 178.616 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.42 ' HE2' ' HB2' ' A' ' 12' ' ' PHE . 27.1 t80 -63.3 -55.35 25.45 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.297 -0.865 . . . . 0.51000000000000001 110.504 179.282 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.499 ' SG ' HD13 ' A' ' 4' ' ' LEU . 0.5 OUTLIER -56.18 -39.1 71.86 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.001 -0.545 . . . . 0.75 110.222 179.609 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -53.27 -50.25 53.02 Favored Glycine 0 N--CA 1.451 -0.343 0 CA-C-N 115.637 -0.711 . . . . 0.40999999999999998 112.148 179.682 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.546 ' O ' ' HG2' ' A' ' 74' ' ' LYS . 11.6 mt -65.48 -44.09 94.29 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.36 0 CA-C-O 121.136 0.494 . . . . 0.51000000000000001 110.66 179.632 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . 0.456 ' O ' ' HB2' ' A' ' 76' ' ' MET . 21.4 mtp -53.27 -33.07 51.63 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.9 -0.591 . . . . 1.01 109.654 179.613 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.11 -44.63 68.6 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.99 -0.55 . . . . 0.69999999999999996 110.791 179.479 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.546 ' HG2' ' O ' ' A' ' 71' ' ' ILE . 0.0 OUTLIER -65.96 -33.25 75.38 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.394 -0.366 . . . . 1.3799999999999999 111.58 -179.355 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . 0.419 ' O ' ' HG2' ' A' ' 78' ' ' GLU . 8.3 tt0 -83.16 -55.42 4.36 Favored 'General case' 0 CA--C 1.521 -0.135 0 CA-C-O 121.235 0.541 . . . . 1.98 111.14 -179.153 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . 0.456 ' HB2' ' O ' ' A' ' 72' ' ' MET . 84.0 mtp -58.23 -20.96 46.12 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.12 -0.946 . . . . 1.2 112.633 -178.82 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 53.5 mtt180 -63.24 -13.91 43.26 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.371 0.508 . . . . 4.6900000000000004 112.371 -179.585 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.444 ' O ' ' HG3' ' A' ' 78' ' ' GLU . 11.9 pt-20 -63.48 77.97 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 121.094 0.473 . . . . 4.0099999999999998 111.555 -179.688 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 95.6 m -166.38 -47.18 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.22 -0.445 . . . . 5.2800000000000002 110.94 -179.72 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -118.75 -0.63 11.23 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.027 -0.533 . . . . 5.5999999999999996 111.25 -179.441 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.507 ' O ' ' HG2' ' A' ' 85' ' ' MET . 5.2 t 32.89 61.82 0.37 Allowed 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 121.039 0.447 . . . . 7.29 111.64 179.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -41.33 -41.84 2.05 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.552 -0.749 . . . . 9.7400000000000002 112.743 -179.025 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -55.52 -53.37 57.25 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 111.861 0.319 . . . . 12.109999999999999 111.861 -179.171 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -64.26 -15.64 60.52 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.36 -0.382 . . . . 10.869999999999999 111.572 -179.308 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . 0.507 ' HG2' ' O ' ' A' ' 81' ' ' THR . 13.3 mmm -81.02 -36.6 30.39 Favored 'General case' 0 CA--C 1.511 -0.537 0 CA-C-O 121.738 0.78 . . . . 11.09 109.304 -178.837 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 6.2 tpt180 -64.2 -52.67 57.75 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.246 -1.343 . . . . 15.52 110.353 179.351 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -58.6 -36.11 73.48 Favored 'General case' 0 C--O 1.233 0.187 0 N-CA-C 109.754 -0.462 . . . . 14.85 109.754 178.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.75 -36.47 80.6 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.049 -0.523 . . . . 14.109999999999999 110.589 178.688 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 94.7 t80 -72.3 -16.82 61.9 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 116.014 -0.539 . . . . 15.73 110.465 179.711 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 16.8 tttt -79.46 -49.03 12.92 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 115.572 -0.74 . . . . 17.66 110.684 -179.625 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 65.7 mt -71.71 -44.79 68.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.809 -0.632 . . . . 18.149999999999999 111.517 -179.708 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.566 ' HD1' HG11 ' A' ' 108' ' ' VAL . 2.5 m-85 -61.11 -44.29 97.58 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.396 -0.365 . . . . 18.34 111.314 -179.656 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 45.7 t0 -72.33 105.03 3.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.386 -0.37 . . . . 19.289999999999999 110.354 179.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.543 ' HG2' ' HB3' ' A' ' 104' ' ' GLU . 19.7 mmm180 -59.42 -53.79 54.07 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.007 -0.542 . . . . 22.25 110.933 -179.561 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.43 ' HB2' ' OD1' ' A' ' 97' ' ' ASP . 0.6 OUTLIER -86.24 170.82 11.76 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.068 -0.515 . . . . 23.34 110.722 -179.88 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -97.74 5.53 62.06 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.901 -0.666 . . . . 22.0 112.155 179.866 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.43 ' OD1' ' HB2' ' A' ' 95' ' ' ASP . 6.5 p-10 -56.97 -43.82 82.02 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.734 0.302 . . . . 22.280000000000001 111.109 -179.777 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 114.61 20.84 5.65 Favored Glycine 0 CA--C 1.518 0.241 0 C-N-CA 120.837 -0.697 . . . . 19.93 112.869 179.633 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . 0.408 ' HA ' ' O ' ' A' ' 136' ' ' ILE . 98.5 m-85 -144.98 145.76 31.66 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.785 0.326 . . . . 20.300000000000001 111.071 179.861 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 56.2 mt -114.6 130.4 69.03 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 CA-C-N 116.208 -0.451 . . . . 19.370000000000001 110.679 179.429 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 68.6 m -114.41 156.06 45.0 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-N 116.148 -0.478 . . . . 22.489999999999998 110.684 -179.666 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_exo -43.59 -37.55 8.2 Favored 'Trans proline' 0 C--N 1.349 0.564 0 C-N-CA 122.38 2.053 . . . . 23.0 112.492 -179.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -62.21 -43.5 98.68 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.096 0.474 . . . . 24.559999999999999 110.657 179.569 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.543 ' HB3' ' HG2' ' A' ' 94' ' ' ARG . 43.8 mt-10 -73.82 -35.91 64.91 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.636 -0.711 . . . . 22.23 110.545 179.827 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.693 HD23 ' HB ' ' A' ' 121' ' ' ILE . 35.7 tp -60.75 -40.6 93.06 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.625 -0.716 . . . . 20.359999999999999 110.873 -179.606 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 8.7 ttm180 -69.98 -46.57 64.9 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.28 -0.418 . . . . 27.190000000000001 110.449 179.16 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -56.18 -41.83 76.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.992 -0.549 . . . . 25.359999999999999 111.58 -179.511 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.566 HG11 ' HD1' ' A' ' 92' ' ' PHE . 5.3 p -73.2 -49.23 39.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 C-N-CA 121.057 -0.257 . . . . 21.059999999999999 111.627 -179.516 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.464 ' N ' HG13 ' A' ' 108' ' ' VAL . 0.4 OUTLIER -50.5 -45.75 56.65 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.804 0.335 . . . . 20.93 110.667 179.936 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 42.4 mt -70.06 -30.16 42.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.174 -0.467 . . . . 25.129999999999999 110.185 179.31 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -68.18 -29.71 68.64 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.735 -0.666 . . . . 23.32 110.538 179.475 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.531 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 62.6 mt -72.97 -40.63 65.13 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.02 -0.536 . . . . 21.07 110.451 179.829 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 136.8 -1.59 3.21 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.941 -0.647 . . . . 23.050000000000001 112.331 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -117.02 130.73 56.87 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.926 0.393 . . . . 22.59 111.298 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 9.8 ptpp? -88.18 153.3 21.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.136 -0.484 . . . . 27.960000000000001 110.928 179.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . 0.435 ' HB ' HG23 ' A' ' 121' ' ' ILE . 0.0 OUTLIER -152.1 155.6 6.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.03 -0.532 . . . . 24.75 111.314 -179.814 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . 0.467 ' O ' HG12 ' A' ' 121' ' ' ILE . 73.0 p -94.42 138.41 32.39 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.935 -0.575 . . . . 27.239999999999998 110.186 179.671 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . 0.414 ' HA ' HD11 ' A' ' 121' ' ' ILE . 22.2 m-20 -50.0 -19.63 0.76 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.017 -0.538 . . . . 26.629999999999999 111.571 -179.49 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -77.48 -55.24 5.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.47 -0.332 . . . . 29.140000000000001 111.842 -179.414 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -62.48 -41.15 98.58 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.479 -0.328 . . . . 24.190000000000001 111.773 -179.091 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.693 ' HB ' HD23 ' A' ' 105' ' ' LEU . 15.1 pt -70.35 -38.14 73.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 C-N-CA 120.982 -0.287 . . . . 22.329999999999998 111.412 -179.431 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.421 ' N ' HG13 ' A' ' 121' ' ' ILE . 17.0 t70 -63.16 -32.87 74.36 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.928 0.394 . . . . 24.289999999999999 110.27 179.303 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 22.3 mm-40 -65.79 -46.97 76.7 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.012 -0.54 . . . . 24.739999999999998 110.53 179.541 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 55.5 ttp -56.73 -39.14 73.4 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.084 -0.507 . . . . 19.710000000000001 110.853 179.526 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.42 HD11 HD22 ' A' ' 105' ' ' LEU . 66.6 mt -64.92 -42.05 93.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.983 0.421 . . . . 19.949999999999999 110.301 179.61 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 35.2 ttp180 -59.14 -46.12 89.18 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.745 -0.662 . . . . 24.949999999999999 110.875 179.517 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -63.43 -29.73 70.97 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.832 -0.622 . . . . 18.690000000000001 111.237 -179.551 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.603 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -91.48 -13.84 31.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.852 0.358 . . . . 16.469999999999999 111.079 179.829 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . 0.42 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 5.9 t70 -101.04 105.86 17.1 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.123 -0.49 . . . . 20.399999999999999 110.924 -179.723 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -89.6 -41.36 12.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.951 -0.568 . . . . 21.43 111.609 -179.6 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -59.95 -26.14 65.75 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.867 0.365 . . . . 23.370000000000001 110.769 -179.614 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 72.05 79.34 0.44 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.804 -0.712 . . . . 24.32 112.87 179.782 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 13.3 p-10 -138.83 -33.28 0.65 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.651 0.263 . . . . 23.879999999999999 111.031 179.641 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 108.21 7.91 29.99 Favored Glycine 0 N--CA 1.452 -0.233 0 C-N-CA 120.799 -0.715 . . . . 22.670000000000002 112.669 179.892 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 63.9 mtp -130.71 155.53 46.46 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.622 0.249 . . . . 22.91 110.508 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.566 HG23 ' HB2' ' A' ' 140' ' ' GLU . 46.6 mm -114.69 143.34 24.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 121.207 0.527 . . . . 18.41 111.973 -179.501 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . 0.443 ' O ' ' N ' ' A' ' 139' ' ' GLU . 28.9 p-10 -115.71 157.94 23.54 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.282 -0.872 . . . . 16.82 108.749 178.257 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.669 ' O ' HG23 ' A' ' 142' ' ' VAL . 48.7 t80 -39.33 -24.23 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 112.312 0.486 . . . . 14.65 112.312 -179.358 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.443 ' N ' ' O ' ' A' ' 137' ' ' ASN . 12.8 mm-40 -80.77 -56.29 4.24 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 120.742 0.306 . . . . 14.82 111.45 -179.55 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.566 ' HB2' HG23 ' A' ' 136' ' ' ILE . 44.0 mt-10 -62.1 -25.57 67.79 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.149 0.499 . . . . 17.460000000000001 110.015 179.788 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.549 ' CE2' HD13 ' A' ' 145' ' ' ILE . 63.7 t80 -70.13 -55.29 9.78 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.618 -0.719 . . . . 12.93 110.111 179.235 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.669 HG23 ' O ' ' A' ' 138' ' ' TYR . 43.6 t -47.83 -44.21 10.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.697 -0.683 . . . . 10.699999999999999 111.463 179.736 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 143' ' ' TRP . . . . . . . . . . . . . 84.2 t90 -63.77 -55.34 23.89 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.406 0.521 . . . . 13.66 112.406 -178.883 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . 0.603 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 18.8 ptt? -61.31 -35.48 77.49 Favored 'General case' 0 N--CA 1.463 0.191 0 N-CA-C 112.726 0.639 . . . . 14.5 112.726 -177.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . 0.549 HD13 ' CE2' ' A' ' 141' ' ' PHE . 13.9 pt -76.53 -23.07 15.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 C-N-CA 120.809 -0.357 . . . . 11.25 111.721 -179.388 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . 0.418 ' HB3' ' NE2' ' A' ' 147' ' ' GLN . 48.0 t -67.64 -29.84 69.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.99 0.424 . . . . 8.5399999999999991 110.245 179.945 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 147' ' ' GLN . . . . . 0.418 ' NE2' ' HB3' ' A' ' 146' ' ' SER . 13.9 mm-40 -91.61 -21.9 20.57 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.728 -0.669 . . . . 11.869999999999999 111.38 -179.759 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . 0.446 ' HG3' ' O ' ' A' ' 144' ' ' MET . 88.1 mttt . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.264 -0.874 . . . . 13.68 111.098 179.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 149' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 151' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 81.0 p . . . . . 0 N--CA 1.486 1.344 0 CA-C-O 120.656 0.265 . . . . 4.8899999999999997 110.943 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 65.26 148.18 0.04 OUTLIER 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 116.053 -0.522 . . . . 3.2599999999999998 111.268 179.863 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.9 mp -79.01 66.35 4.43 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.202 -0.454 . . . . 1.27 110.624 179.448 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -66.19 -153.71 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.846 0.355 . . . . 1.1200000000000001 111.242 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -80.3 -54.95 5.26 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.116 0.484 . . . . 2.2000000000000002 110.537 -179.561 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -70.29 -28.59 65.31 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.722 -0.672 . . . . 1.3500000000000001 110.199 179.812 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -66.57 -48.17 70.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.675 -0.693 . . . . 2.2200000000000002 110.565 179.575 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.541 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 64.5 mt -60.28 -40.68 84.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.08 -0.509 . . . . 0.54000000000000004 110.885 179.831 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -77.12 -18.79 57.66 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.979 0.418 . . . . 0.5 110.673 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -72.24 -56.26 5.83 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.865 -0.607 . . . . 2.27 111.751 -179.154 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.541 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 8.3 p90 -75.99 -26.83 57.1 Favored 'General case' 0 C--N 1.333 -0.152 0 C-N-CA 120.577 -0.449 . . . . 0.37 110.758 -179.843 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 26.1 tptp -64.12 -37.05 86.04 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 109.467 -0.568 . . . . 1.23 109.467 178.74 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -70.12 -46.79 64.06 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.857 -0.61 . . . . 0.44 109.691 178.666 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -64.69 -19.9 66.01 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.903 -0.59 . . . . 0.28999999999999998 110.392 179.246 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -79.4 -39.15 33.16 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.573 -0.739 . . . . 0.47999999999999998 110.522 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -71.57 -26.04 25.63 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.701 0 CA-C-N 115.939 -0.573 . . . . 1.1100000000000001 111.05 -179.888 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 82.2 mm-40 -61.13 -29.48 69.8 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.793 -0.64 . . . . 1.6000000000000001 111.357 -179.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 47.9 m-85 -93.16 -6.95 46.71 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.596 -0.275 . . . . 0.64000000000000001 111.338 -179.792 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -97.85 89.62 4.66 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.889 0.376 . . . . 0.44 110.697 179.395 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -99.52 -21.18 16.03 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.042 -0.526 . . . . 2.1000000000000001 111.266 -179.759 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -78.05 -11.08 59.88 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.262 -0.426 . . . . 1.8 111.193 -179.711 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.5 7.45 87.1 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.765 -0.731 . . . . 0.46000000000000002 112.814 179.702 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 76.2 p -76.67 5.36 7.68 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.674 0.273 . . . . 0.40000000000000002 111.146 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 56.15 23.84 41.58 Favored Glycine 0 C--N 1.332 0.331 0 C-N-CA 120.811 -0.709 . . . . 0.33000000000000002 111.73 -179.608 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.675 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 36.1 mtpt -136.09 155.87 49.56 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.725 0.298 . . . . 1.1000000000000001 111.346 -179.244 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.493 HG13 HD12 ' A' ' 63' ' ' LEU . 44.3 pt -117.93 129.8 73.77 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.2 0 CA-C-O 120.951 0.405 . . . . 0.5 111.367 179.876 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -52.47 141.3 20.33 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.186 -0.461 . . . . 0.29999999999999999 111.29 -179.732 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.511 ' HA ' HD11 ' A' ' 63' ' ' LEU . 38.7 p -66.69 -12.84 60.09 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.852 -0.613 . . . . 1.03 111.254 -179.896 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 39.0 mtp180 -89.43 5.34 45.73 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.974 -0.557 . . . . 3.0800000000000001 110.676 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -124.57 -7.92 7.43 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.081 -0.509 . . . . 2.2599999999999998 111.296 -179.537 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.669 HD23 HD13 ' A' ' 63' ' ' LEU . 1.2 tm? -56.15 -52.73 63.31 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.553 -0.294 . . . . 1.3700000000000001 110.746 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -53.95 -44.9 72.16 Favored Glycine 0 C--N 1.33 0.244 0 C-N-CA 120.598 -0.81 . . . . 0.32000000000000001 111.979 179.701 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 45.2 m -60.55 -32.52 71.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.037 0.446 . . . . 0.31 110.512 179.432 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -69.06 -31.36 70.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.815 -0.63 . . . . 1.24 110.701 -179.99 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.401 ' HG2' ' O ' ' A' ' 32' ' ' LEU . 69.7 mmm -76.96 -24.86 52.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.205 -0.452 . . . . 1.1000000000000001 110.325 179.766 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -71.32 -48.43 50.52 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.256 -0.429 . . . . 2.6899999999999999 110.581 179.319 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.2 t -64.52 -13.81 54.28 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.037 -0.529 . . . . 1.0600000000000001 111.21 179.847 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 10.4 mp -113.54 156.38 23.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.187 -0.46 . . . . 1.26 110.441 179.778 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -50.2 -18.32 2.14 Favored Glycine 0 CA--C 1.52 0.38 0 CA-C-N 115.827 -0.624 . . . . 0.68999999999999995 114.175 -179.014 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 11.8 mp0 -64.61 163.09 14.35 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 117.42 0.61 . . . . 1.97 111.105 -179.881 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -165.21 72.27 1.41 Allowed Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 115.932 -0.576 . . . . 2.6600000000000001 110.834 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -66.61 164.22 29.81 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.648 2.232 . . . . 0.51000000000000001 112.437 -179.833 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 44.2 m -82.58 152.05 26.12 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.028 -0.533 . . . . 0.72999999999999998 110.752 179.757 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -45.47 -52.52 10.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.441 -0.345 . . . . 2.7000000000000002 111.344 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.95 -47.82 70.9 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.215 -0.448 . . . . 0.46000000000000002 111.592 -179.738 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -53.38 -55.0 28.54 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.391 -0.368 . . . . 2.23 111.282 -179.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.408 HD23 HD21 ' A' ' 51' ' ' LEU . 39.6 mt -57.98 -44.86 87.35 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.537 -0.302 . . . . 1.3600000000000001 110.955 -179.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 83.5 mm-40 -62.56 -29.88 70.91 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.728 0.299 . . . . 1.22 111.288 -179.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -76.09 -52.59 9.83 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.345 -0.389 . . . . 0.62 111.903 -179.285 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.408 HD21 HD23 ' A' ' 48' ' ' LEU . 2.2 pp -68.94 -38.19 79.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.567 -0.288 . . . . 0.39000000000000001 111.602 -179.133 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 85.0 mt -65.06 -53.28 43.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.628 -0.26 . . . . 0.5 110.969 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.5 -35.47 79.47 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.799 0.333 . . . . 0.58999999999999997 111.145 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -62.92 -55.16 28.48 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.319 -0.401 . . . . 2.54 110.535 179.734 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -71.18 -14.83 62.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.076 -0.511 . . . . 0.53000000000000003 111.348 179.777 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -65.98 -51.93 54.01 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.435 -0.348 . . . . 1.95 110.979 -179.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 28.7 p-10 -94.58 22.22 6.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.215 -0.448 . . . . 2.48 111.352 -179.649 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 12.1 m120 -134.36 -5.26 2.62 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.371 -0.377 . . . . 2.48 110.979 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 34.3 m-80 -146.4 14.35 1.26 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.34 -0.391 . . . . 2.0499999999999998 111.046 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 28.4 m-80 62.96 7.69 2.79 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.027 -0.533 . . . . 1.47 111.845 179.578 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 108.0 38.66 1.97 Allowed Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.617 -0.801 . . . . 0.42999999999999999 112.945 179.49 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.675 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -144.21 155.51 43.92 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.974 0.416 . . . . 0.38 111.195 179.749 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.669 HD13 HD23 ' A' ' 32' ' ' LEU . 8.4 mt -128.37 153.99 46.47 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-N 116.033 -0.53 . . . . 1.4299999999999999 110.395 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -112.43 156.38 22.64 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 121.143 -0.223 . . . . 1.1899999999999999 110.696 -179.633 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -42.74 -32.44 0.6 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.285 -0.416 . . . . 0.40000000000000002 111.074 179.646 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.49 -41.27 55.82 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.209 -0.45 . . . . 0.81000000000000005 112.012 -179.727 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -63.36 -52.76 60.38 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.323 -0.399 . . . . 1.3600000000000001 110.493 -179.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.488 ' HD1' HD21 ' A' ' 32' ' ' LEU . 17.8 t80 -59.69 -55.16 37.87 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.933 -0.576 . . . . 0.51000000000000001 110.478 179.312 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 8.4 t -55.72 -41.96 74.61 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-N 116.077 -0.51 . . . . 0.75 110.468 179.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -48.81 -55.36 11.5 Favored Glycine 0 N--CA 1.45 -0.378 0 CA-C-N 115.462 -0.79 . . . . 0.40999999999999998 111.952 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.424 ' HA ' ' HG2' ' A' ' 74' ' ' LYS . 9.3 mt -64.41 -36.9 78.57 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 CA-C-O 120.897 0.379 . . . . 0.51000000000000001 110.422 179.386 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . 0.471 ' HG3' ' O ' ' A' ' 68' ' ' PHE . 42.4 mtp -60.57 -28.67 68.64 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.87 -0.604 . . . . 1.01 110.055 179.27 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.31 -47.23 62.06 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.672 -0.694 . . . . 0.69999999999999996 110.433 179.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.424 ' HG2' ' HA ' ' A' ' 71' ' ' ILE . 54.2 pttt -75.14 -24.71 58.02 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.196 -0.457 . . . . 1.3799999999999999 111.203 179.671 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -80.13 -55.39 4.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.18 -0.464 . . . . 1.98 111.452 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 11.5 mtm -63.36 -29.78 71.03 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 116.296 -0.411 . . . . 1.2 111.16 -179.754 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 63.6 ttt180 -69.64 -19.93 63.6 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.026 0.441 . . . . 4.6900000000000004 110.598 179.409 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 -86.29 -49.41 7.7 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.942 -0.572 . . . . 4.0099999999999998 111.29 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 96.3 m -76.51 87.65 3.24 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.294 -0.412 . . . . 5.2800000000000002 111.567 -179.396 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.4 p-10 -178.61 -65.98 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.974 -0.557 . . . . 5.5999999999999996 111.021 179.634 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.622 ' O ' ' HG3' ' A' ' 85' ' ' MET . 96.7 m 58.11 90.26 0.05 OUTLIER 'General case' 0 C--O 1.226 -0.156 0 CA-C-N 116.388 -0.369 . . . . 7.29 110.249 -179.322 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.512 ' HA ' ' SD ' ' A' ' 85' ' ' MET . 11.8 pt-20 -76.9 -20.65 55.97 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 113.362 0.875 . . . . 9.7400000000000002 113.362 -177.895 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.421 ' HG3' ' N ' ' A' ' 84' ' ' GLU . 10.9 pt-20 -59.61 -54.8 42.31 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.949 -0.3 . . . . 12.109999999999999 111.579 -179.245 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.499 ' HG2' HG22 ' A' ' 81' ' ' THR . 13.0 pt-20 -68.21 -14.39 62.95 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.772 0.32 . . . . 10.869999999999999 111.099 -179.678 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . 0.622 ' HG3' ' O ' ' A' ' 81' ' ' THR . 20.2 mtt -77.66 -52.66 8.62 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.224 -0.444 . . . . 11.09 110.75 -179.5 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.403 ' O ' ' HG3' ' A' ' 90' ' ' LYS . 28.2 ttp180 -58.48 -46.92 85.65 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.961 -0.563 . . . . 15.52 110.402 179.862 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.46 ' HA ' ' HE2' ' A' ' 90' ' ' LYS . 1.4 tm-20 -55.78 -48.97 74.41 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 121.146 0.498 . . . . 14.85 109.976 178.917 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -63.76 -28.3 69.78 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.823 -0.626 . . . . 14.109999999999999 110.984 179.631 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 70.6 t80 -67.97 -38.02 82.24 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.018 0.437 . . . . 15.73 110.315 179.586 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.46 ' HE2' ' HA ' ' A' ' 87' ' ' GLU . 44.1 mtmt -64.05 -43.77 94.53 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.837 -0.62 . . . . 17.66 110.496 179.583 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 58.2 mt -63.76 -45.59 96.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.172 -0.467 . . . . 18.149999999999999 111.254 -179.922 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.606 ' HA ' HG21 ' A' ' 108' ' ' VAL . 6.3 m-85 -70.82 -14.7 62.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.473 -0.33 . . . . 18.34 111.449 -179.688 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -105.8 106.3 16.73 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.897 0.379 . . . . 19.289999999999999 110.868 179.791 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.67 -49.56 18.0 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.006 -0.543 . . . . 22.25 111.106 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -74.36 167.52 21.49 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.206 -0.452 . . . . 23.34 110.907 -179.884 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -94.19 5.16 71.42 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.886 -0.673 . . . . 22.0 112.033 179.609 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -67.89 -27.23 66.48 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.757 0.313 . . . . 22.280000000000001 111.189 -179.914 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 87.43 34.41 10.49 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.796 -0.716 . . . . 19.93 112.506 179.658 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . 0.502 ' HA ' ' O ' ' A' ' 136' ' ' ILE . 96.4 m-85 -141.08 147.46 38.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.663 0.268 . . . . 20.300000000000001 110.982 -179.954 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.523 ' HB ' ' HB ' ' A' ' 136' ' ' ILE . 58.3 mt -114.48 122.44 68.6 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 CA-C-N 116.24 -0.436 . . . . 19.370000000000001 111.265 -179.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 23.3 m -115.04 156.7 44.93 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 115.781 -0.645 . . . . 22.489999999999998 110.338 179.796 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 92.1 Cg_exo -41.18 -33.16 1.26 Allowed 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.408 2.072 . . . . 23.0 112.764 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.76 -41.73 87.29 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.249 -0.432 . . . . 24.559999999999999 111.498 -179.776 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.435 ' O ' HG23 ' A' ' 108' ' ' VAL . 44.4 mt-10 -79.87 -49.53 11.81 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.863 -0.608 . . . . 22.23 110.114 -179.482 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.526 HD11 ' HE3' ' A' ' 109' ' ' MET . 49.3 tp -51.95 -32.56 33.78 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.274 -0.875 . . . . 20.359999999999999 110.922 179.515 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 7.3 tmm_? -77.39 -48.23 17.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.754 -0.657 . . . . 27.190000000000001 110.987 -179.747 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 66.2 t80 -58.82 -34.41 71.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.215 -0.448 . . . . 25.359999999999999 111.557 -179.636 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.606 HG21 ' HA ' ' A' ' 92' ' ' PHE . 46.5 t -80.26 -53.71 12.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 N-CA-C 112.352 0.501 . . . . 21.059999999999999 112.352 -178.719 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.526 ' HE3' HD11 ' A' ' 105' ' ' LEU . 1.5 mtt -47.06 -37.44 9.47 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 111.858 0.318 . . . . 20.93 111.858 -179.333 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 89.2 mt -64.7 -35.02 73.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.773 0.32 . . . . 25.129999999999999 110.928 179.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -67.61 -39.1 84.77 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.185 -0.461 . . . . 23.32 110.598 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.411 HD12 ' N ' ' A' ' 112' ' ' LEU . 8.6 mp -67.29 -43.25 82.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.987 -0.551 . . . . 21.07 110.822 -179.971 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 117.98 21.16 4.26 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.771 -0.728 . . . . 23.050000000000001 112.617 179.636 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -83.16 -23.01 33.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.566 0.222 . . . . 22.59 111.352 -179.841 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp 50.21 85.39 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.278 -0.419 . . . . 27.960000000000001 110.994 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . 0.434 HG12 ' OE1' ' A' ' 120' ' ' GLU . 8.8 m -129.17 155.79 41.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.138 -0.483 . . . . 24.75 111.844 -179.545 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . 0.471 ' O ' HG12 ' A' ' 121' ' ' ILE . 57.8 p -100.62 148.48 24.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.673 -0.694 . . . . 27.239999999999998 110.084 179.072 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . 0.455 ' HA ' HD11 ' A' ' 121' ' ' ILE . 9.2 m-20 -51.83 -19.48 1.72 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.363 -0.38 . . . . 26.629999999999999 111.727 -179.37 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -78.95 -55.43 5.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.441 -0.345 . . . . 29.140000000000001 111.755 -179.443 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.434 ' OE1' HG12 ' A' ' 116' ' ' VAL . 14.5 pt-20 -60.84 -39.33 88.7 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.569 -0.287 . . . . 24.190000000000001 111.754 -179.245 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.564 HG13 ' N ' ' A' ' 122' ' ' ASP . 9.5 pt -69.86 -46.69 73.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 120.918 -0.313 . . . . 22.329999999999998 111.517 -179.69 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.564 ' N ' HG13 ' A' ' 121' ' ' ILE . 13.7 t70 -50.95 -41.11 58.83 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.835 0.35 . . . . 24.289999999999999 110.529 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -61.84 -54.37 43.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.045 -0.525 . . . . 24.739999999999998 110.131 179.189 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.431 ' CE ' HD21 ' A' ' 105' ' ' LEU . 5.4 tmm? -51.2 -34.26 31.04 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 115.817 -0.629 . . . . 19.710000000000001 110.745 179.357 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.46 HG13 ' O ' ' A' ' 121' ' ' ILE . 69.9 mt -65.01 -41.3 91.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.0 -0.546 . . . . 19.949999999999999 110.448 179.519 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 55.3 ttt180 -57.62 -38.26 74.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.745 -0.661 . . . . 24.949999999999999 110.402 179.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -61.69 -48.21 81.81 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.647 -0.706 . . . . 18.690000000000001 111.186 179.622 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.57 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -81.73 -7.38 59.59 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.097 -0.502 . . . . 16.469999999999999 111.167 -179.674 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -100.42 107.23 18.92 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.221 -0.445 . . . . 20.399999999999999 110.857 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 68.9 m-85 -94.06 -42.76 8.84 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.684 -0.689 . . . . 21.43 111.128 -179.748 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -55.9 -34.48 65.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.053 -0.521 . . . . 23.370000000000001 111.048 -179.627 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 81.17 72.24 1.24 Allowed Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.858 -0.686 . . . . 24.32 112.589 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -143.08 -5.54 0.87 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.717 0.294 . . . . 23.879999999999999 111.305 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 77.47 8.8 87.1 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.795 -0.717 . . . . 22.670000000000002 112.536 179.839 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 61.9 mtp -121.34 155.33 34.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.752 0.311 . . . . 22.91 110.516 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.712 HG23 ' HB2' ' A' ' 140' ' ' GLU . 38.7 mm -115.61 142.33 29.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 121.217 0.532 . . . . 18.41 112.092 -179.434 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . 0.443 ' O ' ' N ' ' A' ' 139' ' ' GLU . 54.3 t30 -115.71 157.54 24.12 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.323 -0.853 . . . . 16.82 108.985 178.431 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 45.7 t80 -39.7 -24.62 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 120.628 0.251 . . . . 14.65 111.604 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.443 ' N ' ' O ' ' A' ' 137' ' ' ASN . 46.7 mt-10 -80.79 -55.42 4.82 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.724 0.297 . . . . 14.82 110.803 -179.871 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.712 ' HB2' HG23 ' A' ' 136' ' ' ILE . 29.6 mt-10 -58.66 -35.64 72.87 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.152 0.501 . . . . 17.460000000000001 110.256 179.614 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.473 ' CE2' HD13 ' A' ' 145' ' ' ILE . 86.9 t80 -65.39 -55.43 18.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.658 -0.701 . . . . 12.93 110.296 179.484 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.587 HG13 ' SD ' ' A' ' 85' ' ' MET . 2.6 t -48.53 -34.18 5.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.55 -0.75 . . . . 10.699999999999999 111.78 179.366 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 143' ' ' TRP . . . . . 0.515 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 92.5 t90 -71.53 -55.51 7.69 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.577 0.584 . . . . 13.66 112.577 -178.79 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . 0.57 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 21.5 ptt? -63.33 -26.53 68.8 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 112.819 0.674 . . . . 14.5 112.819 -177.675 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . 0.525 HG13 ' N ' ' A' ' 146' ' ' SER . 47.4 pt -81.01 -37.67 16.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 112.318 0.488 . . . . 11.25 112.318 -179.525 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . 0.525 ' N ' HG13 ' A' ' 145' ' ' ILE . 33.2 t -59.32 -14.25 10.92 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.32 0.581 . . . . 8.5399999999999991 110.583 -179.537 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 147' ' ' GLN . . . . . 0.515 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 3.5 mm-40 -100.58 -20.5 15.66 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.298 -0.865 . . . . 11.869999999999999 111.245 -178.993 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 68.5 mttm . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.179 -0.915 . . . . 13.68 110.87 179.744 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 149' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 151' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 88.2 p . . . . . 0 N--CA 1.486 1.356 0 CA-C-O 120.835 0.35 . . . . 4.8899999999999997 110.995 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -164.92 50.85 0.11 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.134 -0.484 . . . . 3.2599999999999998 110.496 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.53 HD12 ' SG ' ' A' ' 69' ' ' CYS . 15.6 mt -58.45 119.45 7.0 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.846 -0.615 . . . . 1.27 111.051 -179.756 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 75.0 p -69.41 -169.11 0.19 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.103 -0.499 . . . . 1.1200000000000001 111.44 -179.65 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -76.25 -38.26 56.54 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.35 -0.386 . . . . 2.2000000000000002 111.025 -179.565 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -72.75 -42.45 64.04 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.143 -0.48 . . . . 1.3500000000000001 110.928 -179.837 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -60.16 -47.81 84.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.144 -0.48 . . . . 2.2200000000000002 110.645 179.758 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.571 ' HA ' ' CE2' ' A' ' 12' ' ' PHE . 82.4 mt -57.38 -52.23 59.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.863 -0.608 . . . . 0.54000000000000004 111.195 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.91 -23.67 65.41 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.276 -0.42 . . . . 0.5 112.024 -179.411 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -71.42 -57.36 4.51 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 111.865 0.32 . . . . 2.27 111.865 -179.124 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.571 ' CE2' ' HA ' ' A' ' 9' ' ' ILE . 17.2 p90 -77.52 -23.43 50.19 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 120.47 -0.492 . . . . 0.37 110.645 -179.546 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.452 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 19.9 tptm -66.94 -36.07 81.4 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 109.229 -0.656 . . . . 1.23 109.229 178.528 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -67.89 -46.3 72.02 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 108.75 -0.833 . . . . 0.44 108.75 178.081 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.03 -14.46 61.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.488 -0.778 . . . . 0.28999999999999998 110.188 178.628 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.452 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 49.9 t80 -80.0 -52.16 8.18 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.819 -0.628 . . . . 0.47999999999999998 110.683 -179.839 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 24.6 m -63.43 -24.95 37.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.118 -0.492 . . . . 1.1100000000000001 110.516 -179.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 61.3 mm-40 -57.7 -28.67 64.04 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.671 -0.695 . . . . 1.6000000000000001 111.331 179.544 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -105.23 36.53 2.45 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.665 0.269 . . . . 0.64000000000000001 111.472 -179.692 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -129.69 68.9 1.42 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.157 0.503 . . . . 0.44 110.396 179.398 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -83.07 5.14 23.4 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.655 -0.702 . . . . 2.1000000000000001 111.222 -179.727 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -103.0 -2.77 27.03 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.367 -0.379 . . . . 1.8 111.193 -179.519 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 63.23 17.89 59.85 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.828 -0.701 . . . . 0.46000000000000002 112.812 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 37.5 p -92.18 8.39 38.24 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.71 0.291 . . . . 0.40000000000000002 111.242 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 54.14 21.45 18.26 Favored Glycine 0 C--N 1.333 0.383 0 C-N-CA 120.732 -0.747 . . . . 0.33000000000000002 111.79 -179.445 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.664 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 36.5 mtpt -133.96 155.76 49.37 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.549 -0.326 . . . . 1.1000000000000001 110.551 -179.295 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.508 ' N ' HE22 ' A' ' 62' ' ' GLN . 49.1 pt -118.73 130.89 72.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 120.901 0.382 . . . . 0.5 111.684 -179.781 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -54.1 135.68 43.1 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.226 -0.443 . . . . 0.29999999999999999 111.025 179.897 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.505 ' HA ' HD11 ' A' ' 63' ' ' LEU . 7.3 t -63.11 -22.2 66.7 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.047 -0.524 . . . . 1.03 111.223 -179.851 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 41.1 mtp180 -77.74 -3.89 43.56 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.082 -0.508 . . . . 3.0800000000000001 110.459 179.774 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -113.53 -5.43 13.45 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.942 -0.572 . . . . 2.2599999999999998 111.142 -179.804 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.57 -44.76 95.84 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 110.15 -0.315 . . . . 1.3700000000000001 110.15 179.65 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -58.43 -43.39 95.86 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.332 -0.937 . . . . 0.32000000000000001 110.976 178.828 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 44.8 m -65.16 -30.72 71.66 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.494 -0.558 . . . . 0.31 109.494 178.544 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 13.7 tp -64.21 -35.4 80.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.382 -0.826 . . . . 1.24 109.506 179.247 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.529 ' HG3' ' HG3' ' A' ' 43' ' ' PRO . 20.3 mmt -66.4 -41.28 89.56 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 115.535 -0.757 . . . . 1.1000000000000001 109.895 178.852 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 59.8 mtp180 -63.5 -26.95 68.95 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.628 -0.715 . . . . 2.6899999999999999 109.93 179.075 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.521 HG22 HD12 ' A' ' 39' ' ' LEU . 2.5 m -79.32 -16.56 56.16 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.536 -0.757 . . . . 1.0600000000000001 110.025 179.322 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.521 HD12 HG22 ' A' ' 38' ' ' THR . 10.3 mp -113.99 157.74 22.07 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.261 -0.881 . . . . 1.26 110.225 179.861 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -74.03 36.33 0.91 Allowed Glycine 0 CA--C 1.519 0.319 0 C-N-CA 120.498 -0.858 . . . . 0.68999999999999995 112.439 179.485 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.427 ' HG2' ' HB3' ' A' ' 39' ' ' LEU . 4.5 mm100 -89.29 -70.57 0.65 Allowed 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.831 0.348 . . . . 1.97 111.306 -179.88 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 60.24 67.48 1.64 Allowed Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 115.945 -0.57 . . . . 2.6600000000000001 110.488 -179.189 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.529 ' HG3' ' HG3' ' A' ' 36' ' ' MET . 69.3 Cg_endo -72.8 -172.86 1.04 Allowed 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.68 2.253 . . . . 0.51000000000000001 112.466 -179.88 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -93.01 150.35 20.6 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.936 -0.574 . . . . 0.72999999999999998 111.003 179.684 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.482 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 15.6 mt-10 -54.6 -46.13 73.77 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.524 -0.307 . . . . 2.7000000000000002 110.645 179.685 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -55.69 -52.94 62.16 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.302 -0.408 . . . . 0.46000000000000002 111.067 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -54.62 -47.26 73.65 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.182 -0.463 . . . . 2.23 110.893 -179.884 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.478 HD22 HD11 ' A' ' 52' ' ' ILE . 15.3 mt -60.39 -45.29 94.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.323 -0.399 . . . . 1.3600000000000001 110.971 179.746 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.482 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 33.0 mm-40 -63.08 -33.67 75.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.693 0.282 . . . . 1.22 111.145 -179.717 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -72.12 -54.03 10.97 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.214 0.45 . . . . 0.62 112.214 -179.299 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 3.2 pp -69.99 -41.26 74.63 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.127 0.417 . . . . 0.39000000000000001 112.127 -178.768 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.478 HD11 HD22 ' A' ' 48' ' ' LEU . 86.6 mt -65.3 -38.72 83.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-O 120.485 0.183 . . . . 0.5 111.093 -179.654 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.65 -37.91 83.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.89 0.376 . . . . 0.58999999999999997 110.516 179.487 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -64.38 -40.89 96.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.069 -0.514 . . . . 2.54 109.994 179.164 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -80.16 -14.76 58.22 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.968 -0.56 . . . . 0.53000000000000003 111.021 179.241 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -66.57 -49.96 64.69 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.262 -0.426 . . . . 1.95 110.948 -179.885 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 34.9 m-80 -85.88 34.85 0.61 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.151 -0.477 . . . . 2.48 110.806 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -157.41 151.57 24.73 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.165 -0.47 . . . . 2.48 110.757 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 4.1 m120 63.25 10.3 4.57 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.981 -0.554 . . . . 2.0499999999999998 111.404 179.847 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 15.2 m120 62.74 13.33 6.34 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.336 -0.393 . . . . 1.47 111.845 179.702 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 104.67 38.5 2.55 Favored Glycine 0 C--N 1.33 0.247 0 C-N-CA 120.551 -0.833 . . . . 0.42999999999999999 112.763 179.419 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.664 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -142.5 155.61 45.06 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.991 0.424 . . . . 0.38 110.886 179.688 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.505 HD11 ' HA ' ' A' ' 29' ' ' THR . 29.0 mt -127.19 154.22 45.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.233 -0.44 . . . . 1.4299999999999999 110.92 -179.805 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . 0.501 ' OD1' ' HE3' ' A' ' 26' ' ' LYS . 0.3 OUTLIER -114.37 157.33 22.98 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.665 -0.494 . . . . 1.1899999999999999 109.665 179.113 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 90.6 t80 -41.19 -33.88 0.41 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.578 0.228 . . . . 0.40000000000000002 111.361 179.871 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 8.2 m -70.78 -39.84 72.95 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.505 -0.316 . . . . 0.81000000000000005 111.622 -179.766 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.468 ' HG2' HD22 ' A' ' 64' ' ' ASN . 13.6 mm-40 -59.71 -55.75 30.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.126 0.489 . . . . 1.3600000000000001 110.804 179.668 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 25.3 t80 -63.77 -52.26 61.15 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.649 -0.705 . . . . 0.51000000000000001 111.145 -179.646 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.53 ' SG ' HD12 ' A' ' 4' ' ' LEU . 19.4 t -53.87 -40.85 66.92 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-O 121.378 0.609 . . . . 0.75 109.886 179.577 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -53.38 -46.6 64.09 Favored Glycine 0 CA--C 1.503 -0.704 0 CA-C-N 114.909 -1.041 . . . . 0.40999999999999998 111.719 179.523 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.537 ' HA ' ' HG2' ' A' ' 74' ' ' LYS . 44.8 mt -73.42 -45.86 50.89 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.93 0 CA-C-O 120.863 0.364 . . . . 0.51000000000000001 111.44 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . 0.442 ' HB3' ' HE2' ' A' ' 76' ' ' MET . 0.1 OUTLIER -52.18 -33.45 40.73 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.816 -0.629 . . . . 1.01 110.181 179.235 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.91 -51.07 43.88 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.729 -0.669 . . . . 0.69999999999999996 110.874 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.537 ' HG2' ' HA ' ' A' ' 71' ' ' ILE . 63.6 pttt -69.63 -27.27 64.92 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 120.85 0.357 . . . . 1.3799999999999999 111.622 -179.82 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . 0.468 ' NE2' ' HB3' ' A' ' 43' ' ' PRO . 30.8 tt0 -80.63 -55.11 5.07 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.24 -0.436 . . . . 1.98 111.816 -179.141 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . 0.442 ' HE2' ' HB3' ' A' ' 72' ' ' MET . 31.6 mtm -53.94 -47.39 71.32 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.313 -0.403 . . . . 1.2 111.166 -179.514 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 40.8 mmt180 -70.12 -34.17 72.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.535 -0.302 . . . . 4.6900000000000004 110.525 179.704 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.516 ' HG2' HG23 ' A' ' 79' ' ' THR . 41.3 tt0 57.87 -85.79 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.928 -0.578 . . . . 4.0099999999999998 111.254 179.83 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.516 HG23 ' HG2' ' A' ' 78' ' ' GLU . 63.7 p -130.06 130.28 44.69 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.411 -0.359 . . . . 5.2800000000000002 111.052 -179.917 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . 0.41 ' O ' ' HE3' ' A' ' 85' ' ' MET . 0.3 OUTLIER -104.23 22.23 15.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.146 -0.479 . . . . 5.5999999999999996 111.239 -179.975 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.422 ' O ' ' HG3' ' A' ' 85' ' ' MET . 75.4 m 60.03 89.39 0.07 Allowed 'General case' 0 N--CA 1.461 0.105 0 CA-C-N 116.323 -0.398 . . . . 7.29 110.571 -179.717 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.55 ' HA ' ' SD ' ' A' ' 85' ' ' MET . 44.9 mt-10 -79.78 -16.69 55.07 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 112.534 0.568 . . . . 9.7400000000000002 112.534 -178.713 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -69.18 -55.85 9.38 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.697 0.284 . . . . 12.109999999999999 111.638 -179.402 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -63.42 -15.23 56.99 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.922 0.392 . . . . 10.869999999999999 111.061 -179.798 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . 0.657 ' SD ' HG13 ' A' ' 142' ' ' VAL . 19.0 mtt -80.18 -53.81 6.33 Favored 'General case' 0 CA--C 1.514 -0.405 0 CA-C-N 116.087 -0.506 . . . . 11.09 110.224 -179.65 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.449 ' O ' ' HG3' ' A' ' 90' ' ' LYS . 38.4 ttt180 -51.56 -41.04 60.84 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.28 -0.873 . . . . 15.52 110.378 179.362 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -72.15 -35.17 69.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.122 -0.49 . . . . 14.85 110.423 179.274 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -69.17 -28.3 66.29 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.123 -0.49 . . . . 14.109999999999999 111.051 179.713 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 86.3 t80 -73.82 -46.21 46.6 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.322 -0.399 . . . . 15.73 110.445 179.904 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.449 ' HG3' ' O ' ' A' ' 86' ' ' ARG . 90.5 mttt -58.25 -38.14 76.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.015 -0.539 . . . . 17.66 110.309 179.32 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 86.2 mt -75.69 -38.63 38.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.697 -0.683 . . . . 18.149999999999999 111.314 -179.782 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.4 ' O ' ' NE ' ' A' ' 94' ' ' ARG . 0.2 OUTLIER -66.14 -56.85 9.37 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.494 -0.321 . . . . 18.34 111.108 -179.621 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.571 ' HA ' HH21 ' A' ' 94' ' ' ARG . 44.1 t0 -49.11 123.44 7.25 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-O 120.789 0.328 . . . . 19.289999999999999 110.253 -179.884 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.687 ' HE ' ' N ' ' A' ' 94' ' ' ARG . 0.0 OUTLIER -91.84 -7.44 49.41 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.209 -0.45 . . . . 22.25 111.848 -178.513 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -126.55 -176.68 3.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.921 0.391 . . . . 23.34 110.904 179.788 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.45 0.7 55.71 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.916 -0.659 . . . . 22.0 112.229 179.643 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.93 -37.98 89.44 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.758 0.313 . . . . 22.280000000000001 111.239 -179.86 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 95.55 20.53 26.71 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.853 -0.689 . . . . 19.93 112.6 179.899 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . 0.42 ' HA ' ' O ' ' A' ' 136' ' ' ILE . 95.7 m-85 -136.32 151.77 49.96 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.702 0.286 . . . . 20.300000000000001 110.803 179.855 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.497 ' HB ' ' HB ' ' A' ' 136' ' ' ILE . 45.7 mt -114.96 133.04 62.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-O 121.096 0.474 . . . . 19.370000000000001 111.66 -179.606 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 75.7 m -114.57 156.06 45.19 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 115.576 -0.738 . . . . 22.489999999999998 110.119 179.2 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_exo -42.45 -47.53 7.38 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.529 2.153 . . . . 23.0 112.699 -179.454 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -59.61 -42.89 93.66 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.199 0.523 . . . . 24.559999999999999 111.045 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -65.51 -55.13 19.49 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.655 -0.702 . . . . 22.23 109.796 -179.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.449 ' CD2' ' HB ' ' A' ' 121' ' ' ILE . 40.6 tp -49.26 -34.63 15.6 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.002 -0.999 . . . . 20.359999999999999 110.325 179.443 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.405 ' HD3' HH11 ' A' ' 106' ' ' ARG . 2.4 tmm_? -69.86 -35.99 75.15 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.591 -0.732 . . . . 27.190000000000001 110.873 -179.781 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 68.0 t80 -67.0 -48.53 68.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.064 -0.516 . . . . 25.359999999999999 112.213 -179.389 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.446 ' O ' ' HG ' ' A' ' 112' ' ' LEU . 99.3 t -67.92 -48.79 73.65 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 N-CA-C 112.103 0.408 . . . . 21.059999999999999 112.103 -179.045 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 2.2 mmt -45.23 -33.92 2.57 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 120.839 0.352 . . . . 20.93 110.833 179.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 67.2 mt -74.05 -44.38 50.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.105 -0.498 . . . . 25.129999999999999 110.766 179.501 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 81.2 m-20 -59.56 -24.97 64.16 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.947 -0.57 . . . . 23.32 110.699 179.641 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 64.0 mt -75.67 -32.52 60.19 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.94 -0.573 . . . . 21.07 110.626 179.997 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 121.71 -2.77 11.03 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.821 -0.704 . . . . 23.050000000000001 112.847 179.596 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -109.87 122.5 47.67 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.896 0.379 . . . . 22.59 111.379 -179.76 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 63.8 tttm -80.24 142.71 34.37 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.073 -0.512 . . . . 27.960000000000001 110.601 179.65 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . 0.468 ' HB ' HG23 ' A' ' 121' ' ' ILE . 1.9 m -150.09 155.51 7.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 121.074 0.464 . . . . 24.75 111.791 -179.697 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . 0.432 ' O ' HG12 ' A' ' 121' ' ' ILE . 61.5 p -100.03 144.13 29.43 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.706 -0.679 . . . . 27.239999999999998 110.153 179.169 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -51.38 -18.98 1.16 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.265 -0.425 . . . . 26.629999999999999 111.698 -179.449 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -78.23 -54.08 6.63 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.575 -0.284 . . . . 29.140000000000001 111.647 -179.579 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -63.86 -40.34 96.35 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 111.808 0.299 . . . . 24.190000000000001 111.808 -179.146 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.532 HG13 ' N ' ' A' ' 122' ' ' ASP . 11.4 pt -70.64 -41.65 77.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 C-N-CA 121.025 -0.27 . . . . 22.329999999999998 111.588 -179.524 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.532 ' N ' HG13 ' A' ' 121' ' ' ILE . 21.4 t70 -58.7 -37.36 75.92 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.975 0.417 . . . . 24.289999999999999 110.161 179.568 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -65.82 -41.87 91.32 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.973 -0.558 . . . . 24.739999999999998 110.067 179.285 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 67.7 ttp -57.97 -36.56 72.76 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.069 -0.514 . . . . 19.710000000000001 110.057 178.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.457 HG23 HD11 ' A' ' 136' ' ' ILE . 84.1 mt -63.21 -42.64 97.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.799 -0.637 . . . . 19.949999999999999 109.822 179.203 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 1.8 tmm_? -58.06 -52.0 67.35 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.512 -0.767 . . . . 24.949999999999999 110.335 179.406 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -54.59 -23.57 17.5 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.124 -0.944 . . . . 18.690000000000001 111.78 -179.894 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.644 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -107.53 -10.58 15.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.839 0.352 . . . . 16.469999999999999 111.497 -179.776 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 27.6 t0 -98.36 106.14 18.38 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.218 -0.446 . . . . 20.399999999999999 110.932 -179.529 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 34.5 m-85 -85.41 -48.47 8.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.845 -0.616 . . . . 21.43 111.287 -179.59 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -60.14 -21.9 62.17 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.174 -0.466 . . . . 23.370000000000001 111.38 -179.656 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 60.75 77.01 0.2 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.654 -0.784 . . . . 24.32 112.614 179.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 13.1 p-10 -133.82 -15.83 2.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.848 0.356 . . . . 23.879999999999999 110.786 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 93.14 10.43 59.67 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.854 -0.688 . . . . 22.670000000000002 112.391 -179.887 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 38.1 mtp -131.31 154.52 48.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.606 0.241 . . . . 22.91 110.551 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.715 HG23 ' HB2' ' A' ' 140' ' ' GLU . 36.9 mm -114.86 144.23 22.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 121.331 0.586 . . . . 18.41 111.992 -179.256 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . 0.425 ' O ' ' N ' ' A' ' 139' ' ' GLU . 48.9 t30 -114.8 157.06 23.77 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.069 -0.969 . . . . 16.82 108.94 178.364 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 7.9 t80 -41.71 -23.14 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 120.663 0.268 . . . . 14.65 111.524 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.425 ' N ' ' O ' ' A' ' 137' ' ' ASN . 44.5 mt-10 -80.22 -56.01 4.52 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.684 0.278 . . . . 14.82 110.946 -179.806 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.715 ' HB2' HG23 ' A' ' 136' ' ' ILE . 34.1 mt-10 -59.23 -31.39 69.01 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.155 0.502 . . . . 17.460000000000001 110.23 179.629 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.646 ' HA ' ' HE2' ' A' ' 144' ' ' MET . 89.0 t80 -69.34 -55.48 10.29 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.503 -0.771 . . . . 12.93 110.271 179.568 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.657 HG13 ' SD ' ' A' ' 85' ' ' MET . 2.4 t -44.43 -42.38 2.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.569 -0.741 . . . . 10.699999999999999 112.036 179.075 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 143' ' ' TRP . . . . . 0.511 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 92.6 t90 -69.94 -56.09 7.94 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.329 0.492 . . . . 13.66 112.329 -178.849 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . 0.646 ' HE2' ' HA ' ' A' ' 141' ' ' PHE . 20.3 ptt? -61.72 -21.17 64.26 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 113.27 0.841 . . . . 14.5 113.27 -177.723 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . 0.629 ' HA ' ' HB2' ' A' ' 148' ' ' LYS . 38.0 pt -80.79 -43.9 21.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 C-N-CA 120.619 -0.432 . . . . 11.25 111.813 -179.939 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . 0.486 ' N ' HG13 ' A' ' 145' ' ' ILE . 31.2 t -63.07 -14.69 51.33 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.297 0.57 . . . . 8.5399999999999991 109.933 179.602 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 147' ' ' GLN . . . . . 0.511 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 2.4 mm-40 -119.52 2.8 11.25 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.171 -0.922 . . . . 11.869999999999999 110.488 -179.232 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . 0.629 ' HB2' ' HA ' ' A' ' 145' ' ' ILE . 26.3 ttpp . . . . . 0 C--O 1.25 1.084 0 CA-C-O 118.249 -0.882 . . . . 13.68 110.987 -179.793 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 149' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 151' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 53.5 p . . . . . 0 N--CA 1.487 1.397 0 CA-C-O 120.704 0.288 . . . . 4.8899999999999997 110.984 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 55.31 69.22 0.76 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.164 -0.471 . . . . 3.2599999999999998 111.279 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.411 ' HG ' ' HE2' ' A' ' 12' ' ' PHE . 7.9 mp -54.42 93.28 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.942 -0.572 . . . . 1.27 110.896 179.457 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 36.9 p -78.63 -173.39 3.38 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.208 -0.451 . . . . 1.1200000000000001 111.538 -179.77 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -63.68 -42.91 97.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.272 -0.422 . . . . 2.2000000000000002 111.515 -179.664 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.408 ' HG3' ' N ' ' A' ' 8' ' ' GLN . 11.1 pt-20 -69.83 -42.44 73.6 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.082 0.467 . . . . 1.3500000000000001 110.51 -179.615 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.408 ' N ' ' HG3' ' A' ' 7' ' ' GLU . 28.0 mt-30 -63.84 -41.39 97.83 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.564 -0.744 . . . . 2.2200000000000002 110.671 179.825 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.494 ' HA ' ' CZ ' ' A' ' 12' ' ' PHE . 45.8 mt -60.71 -51.95 67.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.034 -0.53 . . . . 0.54000000000000004 110.57 179.592 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.94 -23.19 66.2 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.022 -0.535 . . . . 0.5 111.376 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -69.8 -56.64 6.6 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 111.903 0.334 . . . . 2.27 111.903 -179.224 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.494 ' CZ ' ' HA ' ' A' ' 9' ' ' ILE . 11.0 p90 -78.83 -26.92 44.2 Favored 'General case' 0 C--N 1.332 -0.187 0 C-N-CA 120.491 -0.484 . . . . 0.37 110.879 -179.78 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 19.4 tptm -63.67 -34.68 78.4 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.208 -0.664 . . . . 1.23 109.208 178.701 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.43 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 18.2 t70 -70.23 -53.34 17.4 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.644 -0.707 . . . . 0.44 109.206 178.384 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.0 -14.29 22.03 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.535 -0.757 . . . . 0.28999999999999998 110.749 179.165 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 41.8 t80 -80.34 -52.84 7.21 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.957 -0.565 . . . . 0.47999999999999998 110.961 -179.746 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 23.3 m -66.97 -17.92 23.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.076 -0.511 . . . . 1.1100000000000001 110.787 -179.595 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.43 ' HG2' ' O ' ' A' ' 14' ' ' ASP . 74.0 mm-40 -65.95 -29.52 69.93 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.81 -0.632 . . . . 1.6000000000000001 111.636 179.857 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 36.4 m-85 -101.24 18.34 20.19 Favored 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 111.818 0.303 . . . . 0.64000000000000001 111.818 -179.665 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -115.23 80.37 1.42 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.966 0.413 . . . . 0.44 110.798 179.424 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 14.1 tppt? -87.82 -29.39 20.99 Favored 'General case' 0 N--CA 1.441 -0.918 0 CA-C-N 115.878 -0.601 . . . . 2.1000000000000001 110.66 -179.872 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -68.07 -16.72 64.14 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.116 -0.493 . . . . 1.8 111.404 -179.473 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.39 9.67 86.82 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.731 -0.747 . . . . 0.46000000000000002 112.937 179.703 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 34.6 p -79.65 8.18 7.04 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.619 0.247 . . . . 0.40000000000000002 111.012 179.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 55.43 21.43 27.12 Favored Glycine 0 C--N 1.333 0.379 0 C-N-CA 120.733 -0.746 . . . . 0.33000000000000002 111.707 -179.58 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.688 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 53.9 mtpt -134.88 155.13 51.22 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.577 -0.311 . . . . 1.1000000000000001 110.775 -179.091 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.651 HG13 ' HB2' ' A' ' 63' ' ' LEU . 20.5 pt -115.52 127.7 73.01 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.317 0 CA-C-O 120.921 0.391 . . . . 0.5 111.964 -178.963 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -53.09 139.84 27.32 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.1 -0.5 . . . . 0.29999999999999999 111.427 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.531 ' HA ' HD11 ' A' ' 63' ' ' LEU . 7.3 t -65.72 -20.9 66.45 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.992 -0.549 . . . . 1.03 111.454 -179.749 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.496 ' HD3' ' H ' ' A' ' 30' ' ' ARG . 0.0 OUTLIER -83.6 5.08 25.59 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.881 0.372 . . . . 3.0800000000000001 110.48 179.64 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -120.29 -6.65 9.85 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.845 -0.616 . . . . 2.2599999999999998 111.006 -179.845 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.594 HD13 HD13 ' A' ' 51' ' ' LEU . 10.3 tt -58.46 -51.5 69.57 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 116.482 -0.326 . . . . 1.3700000000000001 110.791 179.751 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.413 ' HA2' HD21 ' A' ' 48' ' ' LEU . . . -52.7 -48.07 57.07 Favored Glycine 0 C--N 1.332 0.331 0 C-N-CA 120.33 -0.938 . . . . 0.32000000000000001 111.335 179.405 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.492 ' HA ' ' HG2' ' A' ' 37' ' ' ARG . 88.6 m -57.94 -36.65 72.81 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.394 0.616 . . . . 0.31 109.54 178.493 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.5 -32.1 73.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.087 -0.961 . . . . 1.24 110.297 179.532 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 23.7 mmt -73.83 -26.72 60.74 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.891 -0.595 . . . . 1.1000000000000001 110.316 179.388 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.492 ' HG2' ' HA ' ' A' ' 34' ' ' THR . 17.9 mmt180 -66.78 -50.86 61.33 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.818 -0.628 . . . . 2.6899999999999999 110.271 179.566 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.437 HG23 ' HG ' ' A' ' 39' ' ' LEU . 7.9 t -65.05 -12.62 52.55 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.772 -0.649 . . . . 1.0600000000000001 111.313 179.833 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.437 ' HG ' HG23 ' A' ' 38' ' ' THR . 64.8 mt -112.77 156.32 23.05 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.205 -0.452 . . . . 1.26 110.614 -179.825 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -67.45 10.68 0.94 Allowed Glycine 0 CA--C 1.521 0.441 0 C-N-CA 121.022 -0.608 . . . . 0.68999999999999995 113.141 -179.74 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.418 ' H ' ' C ' ' A' ' 39' ' ' LEU . 15.8 mm-40 -67.4 -79.03 0.05 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.92 0.39 . . . . 1.97 111.122 179.798 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 56.44 68.7 2.09 Favored Pre-proline 0 C--N 1.331 -0.217 0 CA-C-N 115.923 -0.581 . . . . 2.6600000000000001 111.065 -179.628 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.606 ' HG2' HD23 ' A' ' 48' ' ' LEU . 61.5 Cg_endo -71.9 -171.53 0.69 Allowed 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.687 2.258 . . . . 0.51000000000000001 112.346 179.86 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 38.1 m -94.87 152.42 18.39 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.161 -0.472 . . . . 0.72999999999999998 110.639 179.716 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.415 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 37.4 tt0 -48.85 -53.07 20.91 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.574 -0.285 . . . . 2.7000000000000002 111.28 -179.651 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -46.92 -54.69 9.49 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.298 -0.41 . . . . 0.46000000000000002 111.424 -179.752 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -54.91 -50.29 69.17 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.358 -0.383 . . . . 2.23 110.82 179.876 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.606 HD23 ' HG2' ' A' ' 43' ' ' PRO . 0.1 OUTLIER -55.82 -36.09 67.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.115 -0.493 . . . . 1.3600000000000001 111.032 -179.879 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.415 ' HG2' ' O ' ' A' ' 45' ' ' GLU . 28.5 mm-40 -75.88 -32.16 59.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.256 -0.429 . . . . 1.22 111.247 -179.707 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 64.7 m-20 -70.1 -55.42 9.5 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.464 -0.334 . . . . 0.62 111.09 -179.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.594 HD13 HD13 ' A' ' 32' ' ' LEU . 1.9 pp -59.19 -39.44 82.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.314 -0.403 . . . . 0.39000000000000001 111.116 -179.923 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 35.8 mt -64.52 -40.8 90.31 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-O 120.636 0.255 . . . . 0.5 110.594 179.429 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.89 -30.92 71.2 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.383 -0.371 . . . . 0.58999999999999997 111.003 179.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -80.46 -47.33 14.49 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.105 -0.498 . . . . 2.54 111.394 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -75.49 -14.86 60.45 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.351 0.5 . . . . 0.53000000000000003 112.351 -179.16 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -69.31 -38.71 78.37 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.705 0.288 . . . . 1.95 111.065 -179.486 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 30.6 m-80 -95.25 28.79 2.71 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.346 -0.388 . . . . 2.48 110.563 179.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.622 HD22 ' N ' ' A' ' 59' ' ' ASN . 0.2 OUTLIER -148.92 138.43 21.8 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.109 -0.496 . . . . 2.48 110.542 -179.679 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . 0.622 ' N ' HD22 ' A' ' 58' ' ' ASN . 77.4 m-20 62.68 14.58 7.33 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.181 -0.463 . . . . 2.0499999999999998 111.118 179.909 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 22.3 m-80 58.47 13.62 2.58 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.034 -0.53 . . . . 1.47 111.711 179.469 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 113.78 48.22 0.59 Allowed Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.564 -0.827 . . . . 0.42999999999999999 113.045 179.483 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.688 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -146.22 153.8 41.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.109 0.48 . . . . 0.38 111.198 179.513 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.651 ' HB2' HG13 ' A' ' 27' ' ' ILE . 16.3 mt -126.6 156.71 40.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.631 -0.713 . . . . 1.4299999999999999 110.549 -179.623 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . 0.442 ' OD1' ' HE3' ' A' ' 26' ' ' LYS . 0.1 OUTLIER -112.68 156.6 22.48 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 121.023 -0.271 . . . . 1.1899999999999999 110.447 179.674 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.438 ' O ' ' HB2' ' A' ' 69' ' ' CYS . 83.9 t80 -45.59 -32.51 2.35 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.751 0.31 . . . . 0.40000000000000002 110.998 179.639 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -80.39 -36.86 33.28 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 112.16 0.43 . . . . 0.81000000000000005 112.16 -179.555 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -62.71 -51.54 66.79 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.473 0.654 . . . . 1.3600000000000001 109.802 179.478 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.436 ' O ' ' HG3' ' A' ' 72' ' ' MET . 35.3 t80 -61.66 -48.13 82.23 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.999 -1.0 . . . . 0.51000000000000001 110.578 179.378 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.438 ' HB2' ' O ' ' A' ' 65' ' ' PHE . 7.8 t -57.96 -48.36 80.18 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.156 -0.475 . . . . 0.75 110.528 179.86 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -48.47 -48.6 27.81 Favored Glycine 0 N--CA 1.45 -0.415 0 CA-C-N 115.72 -0.673 . . . . 0.40999999999999998 112.03 179.863 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.573 HG23 ' HE2' ' A' ' 74' ' ' LYS . 15.3 mt -63.49 -43.65 98.46 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.362 0 CA-C-O 121.153 0.502 . . . . 0.51000000000000001 110.504 179.41 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . 0.436 ' HG3' ' O ' ' A' ' 68' ' ' PHE . 49.6 mtp -58.34 -26.67 63.38 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.637 -0.71 . . . . 1.01 110.076 179.535 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -72.55 -43.66 63.18 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.003 -0.544 . . . . 0.69999999999999996 110.704 179.557 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.573 ' HE2' HG23 ' A' ' 71' ' ' ILE . 48.7 pttt -73.9 -30.29 62.52 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.234 -0.439 . . . . 1.3799999999999999 111.125 -179.877 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -80.45 -47.19 14.7 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.112 0.412 . . . . 1.98 112.112 -179.694 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 48.2 mtp -68.83 -29.81 68.22 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 112.065 0.395 . . . . 1.2 112.065 -179.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 28.2 ptt180 -67.51 -14.38 62.88 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.461 0.172 . . . . 4.6900000000000004 111.207 -179.772 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.473 ' HG2' HG23 ' A' ' 79' ' ' THR . 43.1 tt0 -41.03 -77.02 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.228 -0.442 . . . . 4.0099999999999998 111.663 -179.523 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.473 HG23 ' HG2' ' A' ' 78' ' ' GLU . 41.8 p -139.82 142.56 36.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.871 0.367 . . . . 5.2800000000000002 111.442 -179.797 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . 0.442 ' H ' ' H ' ' A' ' 81' ' ' THR . 3.9 p30 -169.08 -8.05 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.986 -0.552 . . . . 5.5999999999999996 110.596 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.442 ' H ' ' H ' ' A' ' 80' ' ' ASP . 5.7 t -102.27 122.74 44.8 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.027 -0.533 . . . . 7.29 111.042 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.407 ' HB2' ' OH ' ' A' ' 138' ' ' TYR . 10.5 pt-20 -55.87 -17.65 6.91 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.917 -0.583 . . . . 9.7400000000000002 112.232 -179.034 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -68.43 -56.37 8.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.917 0.389 . . . . 12.109999999999999 111.264 -179.583 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -72.99 -15.29 61.54 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.114 0.483 . . . . 10.869999999999999 110.379 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . 0.701 ' HB3' HG22 ' A' ' 142' ' ' VAL . 15.0 mtt -76.37 -48.4 20.04 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.83 -0.623 . . . . 11.09 110.393 -179.779 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.428 ' O ' ' HG3' ' A' ' 90' ' ' LYS . 19.9 ttt180 -62.82 -41.95 99.52 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.546 -0.539 . . . . 15.52 109.546 179.354 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -55.16 -43.47 74.29 Favored 'General case' 0 C--O 1.233 0.214 0 N-CA-C 109.402 -0.592 . . . . 14.85 109.402 178.525 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.54 -28.37 67.74 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.541 -0.754 . . . . 14.109999999999999 110.667 179.132 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 82.4 t80 -66.84 -39.12 87.53 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 116.231 -0.44 . . . . 15.73 110.472 179.638 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.428 ' HG3' ' O ' ' A' ' 86' ' ' ARG . 2.7 mtpm? -64.48 -49.14 72.57 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.27 0.557 . . . . 17.66 110.269 179.327 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 60.6 mt -62.96 -45.13 99.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.255 -0.884 . . . . 18.149999999999999 111.479 -179.228 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.514 ' CG ' HG11 ' A' ' 108' ' ' VAL . 0.6 OUTLIER -68.28 -18.65 64.59 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.252 -0.431 . . . . 18.34 111.59 -179.378 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 48.2 t0 -99.01 103.9 15.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.049 0.452 . . . . 19.289999999999999 110.702 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.56 ' NE ' HG22 ' A' ' 108' ' ' VAL . 0.0 OUTLIER -67.68 -11.63 58.72 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.773 -0.649 . . . . 22.25 111.681 -179.461 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.47 ' HB2' ' OD1' ' A' ' 97' ' ' ASP . 28.2 m-20 -116.65 166.98 11.49 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.986 0.422 . . . . 23.34 111.193 -179.789 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.61 5.15 56.81 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.973 -0.632 . . . . 22.0 112.375 179.498 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.47 ' OD1' ' HB2' ' A' ' 95' ' ' ASP . 7.6 p-10 -61.68 -38.13 86.67 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.665 0.269 . . . . 22.280000000000001 111.13 -179.691 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 111.34 18.73 7.93 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.738 -0.744 . . . . 19.93 112.749 179.843 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . 0.441 ' HA ' ' O ' ' A' ' 136' ' ' ILE . 92.3 m-85 -145.35 153.48 41.28 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 120.622 0.249 . . . . 20.300000000000001 110.854 179.803 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.402 HD13 ' HB3' ' A' ' 92' ' ' PHE . 63.9 mt -114.01 139.76 38.09 Favored 'Isoleucine or valine' 0 C--O 1.231 0.107 0 CA-C-O 121.014 0.435 . . . . 19.370000000000001 111.312 -179.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 16.5 m -121.77 156.22 59.25 Favored Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 115.747 -0.66 . . . . 22.489999999999998 110.434 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_exo -43.56 -32.95 4.11 Favored 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.498 2.132 . . . . 23.0 112.508 -179.753 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -62.55 -48.75 78.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.095 0.474 . . . . 24.559999999999999 111.248 179.91 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.661 ' O ' HG23 ' A' ' 108' ' ' VAL . 33.5 mt-10 -73.08 -42.15 63.33 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.652 -0.704 . . . . 22.23 110.193 -179.662 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.466 HD12 ' HB ' ' A' ' 121' ' ' ILE . 1.6 tm? -48.89 -54.33 15.82 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.425 -0.807 . . . . 20.359999999999999 109.624 179.794 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.545 ' HB2' HD13 ' A' ' 121' ' ' ILE . 17.1 ttp180 -58.29 -51.11 71.15 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.19 -0.914 . . . . 27.190000000000001 110.844 179.851 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 50.3 t80 -56.23 -26.35 50.91 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.029 -0.532 . . . . 25.359999999999999 112.012 -179.147 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.661 HG23 ' O ' ' A' ' 104' ' ' GLU . 58.8 t -80.55 -55.38 8.67 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.16 0 N-CA-C 112.549 0.574 . . . . 21.059999999999999 112.549 -179.063 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . 0.591 ' SD ' HG21 ' A' ' 116' ' ' VAL . 0.1 OUTLIER -48.58 -47.42 39.68 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.277 0.561 . . . . 20.93 110.48 -179.347 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.468 HD11 ' HG3' ' A' ' 106' ' ' ARG . 27.7 mt -60.27 -30.79 46.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.257 -0.883 . . . . 25.129999999999999 111.187 -179.806 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . 0.474 HD22 HH21 ' A' ' 94' ' ' ARG . 92.6 m-20 -72.9 -28.99 62.81 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.22 -0.445 . . . . 23.32 110.846 179.29 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.454 ' HG ' ' O ' ' A' ' 108' ' ' VAL . 6.5 mt -76.06 -27.64 57.33 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.159 -0.473 . . . . 21.07 110.695 -179.889 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 121.77 12.1 5.64 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.865 -0.683 . . . . 23.050000000000001 112.441 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -117.51 135.21 54.09 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.86 0.362 . . . . 22.59 111.133 -179.843 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -93.54 134.99 35.25 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.114 -0.494 . . . . 27.960000000000001 110.6 179.783 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . 0.591 HG21 ' SD ' ' A' ' 109' ' ' MET . 8.6 m -144.58 155.44 14.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 121.116 0.484 . . . . 24.75 111.986 -179.562 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 45.1 p -100.9 150.38 22.91 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.486 -0.779 . . . . 27.239999999999998 109.939 178.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -54.65 -19.74 6.72 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.736 0.303 . . . . 26.629999999999999 111.361 -179.66 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -78.73 -54.19 6.35 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.28 -0.418 . . . . 29.140000000000001 111.824 -179.364 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.471 ' OE1' HG12 ' A' ' 116' ' ' VAL . 13.5 pt-20 -61.34 -36.52 80.39 Favored 'General case' 0 C--O 1.233 0.237 0 N-CA-C 111.612 0.227 . . . . 24.190000000000001 111.612 -179.171 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.545 HD13 ' HB2' ' A' ' 106' ' ' ARG . 22.0 pt -73.47 -37.61 51.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 C-N-CA 121.041 -0.264 . . . . 22.329999999999998 111.017 179.86 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.519 ' N ' HG13 ' A' ' 121' ' ' ILE . 17.4 t70 -59.36 -38.36 80.23 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.991 0.425 . . . . 24.289999999999999 110.179 179.27 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -65.35 -49.97 67.36 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.863 -0.608 . . . . 24.739999999999998 110.474 179.542 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.435 ' SD ' ' HE2' ' A' ' 148' ' ' LYS . 56.3 ttp -52.44 -46.01 66.23 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.375 -0.375 . . . . 19.710000000000001 110.717 179.641 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.547 HG23 HD11 ' A' ' 136' ' ' ILE . 79.2 mt -61.6 -33.48 57.43 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 CA-C-N 116.072 -0.513 . . . . 19.949999999999999 110.742 179.476 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 16.7 tpt85 -65.74 -36.14 82.73 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.261 -0.427 . . . . 24.949999999999999 110.994 -179.613 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -62.48 -43.5 98.67 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.939 -0.573 . . . . 18.690000000000001 111.663 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.657 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -87.75 -18.64 28.97 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.303 -0.408 . . . . 16.469999999999999 111.756 -179.301 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . 0.461 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 22.3 t70 -93.75 106.65 18.61 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.027 0.441 . . . . 20.399999999999999 111.124 -179.627 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 79.1 m-85 -91.6 -33.0 15.29 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.824 -0.626 . . . . 21.43 110.669 179.839 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -64.12 -18.74 64.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.12 -0.491 . . . . 23.370000000000001 110.555 179.74 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 64.98 19.1 65.36 Favored Glycine 0 N--CA 1.45 -0.388 0 CA-C-N 115.632 -0.713 . . . . 24.32 112.467 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 7.8 p30 -86.29 3.89 41.35 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.608 0.242 . . . . 23.879999999999999 111.458 -179.749 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 62.09 23.28 63.74 Favored Glycine 0 N--CA 1.453 -0.221 0 C-N-CA 120.653 -0.785 . . . . 22.670000000000002 112.369 -179.854 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 92.8 mmm -130.73 145.54 51.97 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 110.36 -0.237 . . . . 22.91 110.36 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.607 HG23 ' HB2' ' A' ' 140' ' ' GLU . 50.4 mm -115.44 145.36 21.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.325 0.583 . . . . 18.41 112.104 -179.555 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . 0.471 ' O ' ' N ' ' A' ' 139' ' ' GLU . 29.1 p-10 -122.99 158.43 30.51 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.157 -0.929 . . . . 16.82 108.753 178.239 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.419 ' O ' HG23 ' A' ' 142' ' ' VAL . 18.0 t80 -38.5 -23.72 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 112.193 0.442 . . . . 14.65 112.193 -179.746 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.471 ' N ' ' O ' ' A' ' 137' ' ' ASN . 45.0 mt-10 -80.46 -56.14 4.39 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.678 0.275 . . . . 14.82 111.517 -179.454 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.607 ' HB2' HG23 ' A' ' 136' ' ' ILE . 34.3 mt-10 -63.13 -34.94 78.69 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.077 0.465 . . . . 17.460000000000001 110.506 179.944 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.474 ' CZ ' HG21 ' A' ' 145' ' ' ILE . 88.0 t80 -63.74 -55.51 22.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.746 -0.661 . . . . 12.93 110.51 179.725 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.701 HG22 ' HB3' ' A' ' 85' ' ' MET . 4.6 t -48.28 -42.54 11.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.79 -0.641 . . . . 10.699999999999999 111.732 179.353 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 143' ' ' TRP . . . . . 0.474 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 83.4 t90 -61.76 -55.32 31.36 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.53 0.567 . . . . 13.66 112.53 -178.704 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . 0.657 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 11.9 ptt? -64.02 -40.04 95.45 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 112.797 0.666 . . . . 14.5 112.797 -177.653 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . 0.474 HG21 ' CZ ' ' A' ' 141' ' ' PHE . 37.2 pt -65.42 -29.09 46.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 N-CA-C 111.931 0.345 . . . . 11.25 111.931 -179.268 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . 0.457 ' HB3' ' NE2' ' A' ' 147' ' ' GLN . 41.7 t -69.09 -32.98 72.8 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.901 0.381 . . . . 8.5399999999999991 110.459 -179.751 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 147' ' ' GLN . . . . . 0.474 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 8.6 mm-40 -95.98 -16.04 21.94 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.912 -0.585 . . . . 11.869999999999999 111.478 -179.895 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . 0.451 ' HG3' ' O ' ' A' ' 144' ' ' MET . 68.9 mttt . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.293 -0.861 . . . . 13.68 111.183 179.661 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 149' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 151' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 69.6 m . . . . . 0 N--CA 1.486 1.331 0 CA-C-O 120.847 0.356 . . . . 4.8899999999999997 110.851 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -151.97 133.23 14.45 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.079 -0.51 . . . . 3.2599999999999998 110.751 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.439 HD13 ' CZ ' ' A' ' 12' ' ' PHE . 39.3 mt -67.4 91.69 0.27 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.322 -0.399 . . . . 1.27 110.602 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 66.4 p -66.49 -159.94 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.81 -0.632 . . . . 1.1200000000000001 111.651 -179.635 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -76.78 -45.22 29.77 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.345 -0.389 . . . . 2.2000000000000002 110.948 -179.508 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.79 -39.26 70.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.99 -0.55 . . . . 1.3500000000000001 110.687 -179.782 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.434 ' NE2' ' HA ' ' A' ' 4' ' ' LEU . 29.1 mt-30 -60.94 -47.33 86.93 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.961 -0.563 . . . . 2.2200000000000002 110.659 179.696 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.448 ' HA ' ' CZ ' ' A' ' 12' ' ' PHE . 66.8 mt -59.7 -54.3 36.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.087 -0.506 . . . . 0.54000000000000004 110.897 179.712 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.31 -18.7 51.43 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.253 -0.43 . . . . 0.5 111.682 -179.707 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -74.21 -56.87 4.4 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.617 0.246 . . . . 2.27 111.65 -179.491 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.448 ' CZ ' ' HA ' ' A' ' 9' ' ' ILE . 9.5 p90 -79.4 -20.85 46.6 Favored 'General case' 0 C--N 1.332 -0.158 0 C-N-CA 120.598 -0.441 . . . . 0.37 110.747 -179.9 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.424 ' O ' ' HB3' ' A' ' 16' ' ' PHE . 19.7 tptm -70.28 -39.32 74.98 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.204 -0.665 . . . . 1.23 109.204 178.644 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -64.93 -47.53 77.4 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 108.735 -0.839 . . . . 0.44 108.735 177.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.45 -28.88 70.12 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.429 -0.805 . . . . 0.28999999999999998 110.02 178.581 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.424 ' HB3' ' O ' ' A' ' 13' ' ' LYS . 30.1 t80 -67.33 -40.98 85.97 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.546 -0.752 . . . . 0.47999999999999998 110.238 179.364 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -68.83 -28.27 39.11 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.784 0 CA-C-N 115.73 -0.668 . . . . 1.1100000000000001 110.972 -179.82 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 83.7 mm-40 -61.5 -33.11 73.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.597 -0.729 . . . . 1.6000000000000001 111.332 -179.96 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -93.74 -5.83 47.48 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.497 -0.319 . . . . 0.64000000000000001 111.45 -179.617 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -95.14 78.39 3.51 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.901 0.382 . . . . 0.44 110.467 179.301 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 29.7 mmmt -90.94 -33.24 15.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.945 -0.57 . . . . 2.1000000000000001 111.19 -179.636 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -62.43 -23.98 67.16 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.226 -0.443 . . . . 1.8 111.177 -179.782 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 87.09 11.41 69.88 Favored Glycine 0 N--CA 1.453 -0.213 0 C-N-CA 120.758 -0.734 . . . . 0.46000000000000002 112.627 179.774 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 30.3 p -86.1 11.26 12.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.778 0.323 . . . . 0.40000000000000002 111.139 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 55.26 25.11 39.14 Favored Glycine 0 C--N 1.332 0.327 0 C-N-CA 120.813 -0.708 . . . . 0.33000000000000002 112.227 -179.824 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.651 ' HE2' ' HB3' ' A' ' 62' ' ' GLN . 42.5 mtpt -134.09 155.8 49.4 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.788 0.327 . . . . 1.1000000000000001 111.032 -179.58 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.52 HG13 ' HB2' ' A' ' 63' ' ' LEU . 30.8 pt -114.96 136.18 52.47 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.325 0 N-CA-C 112.27 0.47 . . . . 0.5 112.27 -178.825 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -58.92 135.35 57.55 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.262 -0.426 . . . . 0.29999999999999999 111.343 179.734 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.575 ' HA ' HD11 ' A' ' 63' ' ' LEU . 9.9 t -65.75 -23.35 66.72 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.996 -0.547 . . . . 1.03 111.179 -179.894 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 29.9 mtp180 -77.79 -2.57 37.02 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.069 -0.514 . . . . 3.0800000000000001 110.372 179.556 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -111.79 -6.18 14.33 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.759 -0.655 . . . . 2.2599999999999998 110.872 179.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -51.78 -50.94 59.73 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.944 -0.571 . . . . 1.3700000000000001 110.46 179.675 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -58.78 -43.02 96.73 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.63 -0.795 . . . . 0.32000000000000001 111.828 179.515 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 31.1 m -59.15 -32.24 69.7 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.989 0.424 . . . . 0.31 110.516 179.428 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.3 mt -67.51 -41.23 84.76 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 115.851 -0.613 . . . . 1.24 110.643 179.771 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.569 ' HG3' ' HG3' ' A' ' 43' ' ' PRO . 14.6 mmt -66.91 -25.66 66.48 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.013 -0.539 . . . . 1.1000000000000001 110.741 179.894 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -74.85 -47.82 28.27 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.855 -0.611 . . . . 2.6899999999999999 110.954 179.453 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.519 HG23 ' HG ' ' A' ' 39' ' ' LEU . 9.9 t -70.52 -13.69 62.21 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.98 0.419 . . . . 1.0600000000000001 111.033 179.758 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.519 ' HG ' HG23 ' A' ' 38' ' ' THR . 57.4 mt -113.85 156.65 23.53 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.92 -0.582 . . . . 1.26 110.626 -179.798 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -52.92 -11.44 1.36 Allowed Glycine 0 CA--C 1.521 0.45 0 C-N-CA 121.178 -0.534 . . . . 0.68999999999999995 113.269 -179.764 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -58.63 166.03 1.99 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.931 0.396 . . . . 1.97 111.181 179.673 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 46.3 t30 -172.55 73.72 0.44 Allowed Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 115.884 -0.598 . . . . 2.6600000000000001 110.513 179.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.569 ' HG3' ' HG3' ' A' ' 36' ' ' MET . 83.1 Cg_endo -80.18 158.34 23.33 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.741 2.294 . . . . 0.51000000000000001 112.712 -179.779 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.0 p -67.83 146.32 53.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.98 -0.555 . . . . 0.72999999999999998 110.932 179.55 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.1 tt0 -48.38 -49.23 35.51 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.86 0.362 . . . . 2.7000000000000002 110.791 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.22 -44.81 88.37 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.998 -0.546 . . . . 0.46000000000000002 111.127 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -54.28 -46.42 72.7 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.248 -0.433 . . . . 2.23 110.935 -179.939 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 37.8 mt -60.84 -45.16 95.59 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.337 -0.392 . . . . 1.3600000000000001 110.826 179.702 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 81.7 mm-40 -64.67 -27.51 68.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.455 -0.339 . . . . 1.22 111.161 -179.674 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 43.5 m-20 -74.8 -55.07 6.21 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.477 -0.328 . . . . 0.62 111.633 -179.652 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 2.4 pp -67.38 -41.12 85.55 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.468 -0.333 . . . . 0.39000000000000001 111.701 -179.316 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 76.9 mt -62.77 -45.88 97.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 120.637 0.256 . . . . 0.5 110.853 -179.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.89 -33.68 75.19 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.886 0.374 . . . . 0.58999999999999997 110.516 179.53 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -63.6 -44.31 94.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.985 -0.552 . . . . 2.54 110.004 179.302 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.416 ' HA ' HD22 ' A' ' 59' ' ' ASN . . . -79.7 -16.89 54.85 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.915 -0.584 . . . . 0.53000000000000003 110.871 179.253 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -73.55 -43.0 60.95 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.122 -0.49 . . . . 1.95 111.035 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -102.87 47.83 0.88 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.143 -0.48 . . . . 2.48 111.118 -179.826 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -167.55 -55.17 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.2 -0.454 . . . . 2.48 110.927 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . 0.416 HD22 ' HA ' ' A' ' 55' ' ' ALA . 38.2 m-80 -97.4 24.85 6.12 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.171 -0.468 . . . . 2.0499999999999998 110.751 179.846 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 8.0 m120 64.81 -80.08 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.134 0 CA-C-N 115.89 -0.595 . . . . 1.47 111.239 179.904 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -165.88 18.97 0.1 OUTLIER Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.804 -0.712 . . . . 0.42999999999999999 112.418 179.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.651 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -128.31 155.49 44.55 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.96 0.409 . . . . 0.38 111.373 -179.837 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.575 HD11 ' HA ' ' A' ' 29' ' ' THR . 14.8 mt -126.09 155.46 41.56 Favored 'General case' 0 C--O 1.222 -0.361 0 CA-C-N 115.834 -0.621 . . . . 1.4299999999999999 110.7 -179.631 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . 0.477 ' HB2' ' HG3' ' A' ' 67' ' ' GLU . 1.4 m-20 -111.68 156.51 21.75 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.652 -0.249 . . . . 1.1899999999999999 110.552 -179.607 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 90.0 t80 -43.86 -39.53 3.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.427 -0.351 . . . . 0.40000000000000002 111.399 -179.524 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -70.48 -39.07 74.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.528 -0.306 . . . . 0.81000000000000005 111.67 -179.878 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.477 ' HG3' ' HB2' ' A' ' 64' ' ' ASN . 14.0 mt-10 -62.06 -53.64 52.66 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.426 0.631 . . . . 1.3600000000000001 109.695 179.523 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.444 ' O ' ' HG2' ' A' ' 72' ' ' MET . 31.3 t80 -59.69 -54.98 40.05 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.934 -1.03 . . . . 0.51000000000000001 110.497 179.309 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 36.2 t -51.02 -53.97 28.81 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-N 116.169 -0.469 . . . . 0.75 110.458 179.506 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -41.82 -54.71 4.22 Favored Glycine 0 N--CA 1.451 -0.305 0 CA-C-N 115.281 -0.872 . . . . 0.40999999999999998 112.462 179.702 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.737 HG23 ' HE2' ' A' ' 74' ' ' LYS . 14.0 mt -64.84 -48.91 82.41 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.26 0 CA-C-O 121.037 0.446 . . . . 0.51000000000000001 110.946 179.692 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' MET . . . . . 0.444 ' HG2' ' O ' ' A' ' 68' ' ' PHE . 81.2 mmm -47.79 -36.82 12.32 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.833 -0.622 . . . . 1.01 110.042 179.289 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.517 ' O ' ' HG3' ' A' ' 77' ' ' ARG . . . -63.73 -55.34 23.99 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.415 -0.812 . . . . 0.69999999999999996 110.974 179.407 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.737 ' HE2' HG23 ' A' ' 71' ' ' ILE . 61.1 pttt -60.17 -33.32 72.03 Favored 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 112.017 0.377 . . . . 1.3799999999999999 112.017 -179.199 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 65.1 mt-30 -78.82 -51.96 9.0 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 111.77 0.285 . . . . 1.98 111.77 -179.873 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 2.2 mmm -56.7 -19.07 14.71 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 116.336 -0.393 . . . . 1.2 111.68 -179.431 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.517 ' HG3' ' O ' ' A' ' 73' ' ' ALA . 67.1 mtm180 -45.22 -34.54 2.85 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 120.762 0.315 . . . . 4.6900000000000004 110.792 179.054 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -71.32 82.67 0.76 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.127 -0.488 . . . . 4.0099999999999998 110.562 179.482 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 13.5 t -157.29 -8.93 0.09 Allowed 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.971 0.415 . . . . 5.2800000000000002 110.943 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -107.3 139.46 41.73 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.835 -0.62 . . . . 5.5999999999999996 110.9 179.631 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.624 ' O ' ' HG3' ' A' ' 85' ' ' MET . 13.5 m -141.64 79.69 1.69 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.985 -0.552 . . . . 7.29 110.692 179.209 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.447 ' CD ' ' H ' ' A' ' 82' ' ' GLU . 1.9 mp0 -39.54 -49.51 2.14 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 115.381 -0.827 . . . . 9.7400000000000002 112.973 -178.589 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -56.7 -43.62 80.71 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.86 0.362 . . . . 12.109999999999999 111.199 -179.463 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -75.25 -14.53 60.53 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.058 -0.519 . . . . 10.869999999999999 111.248 -179.596 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . 0.624 ' HG3' ' O ' ' A' ' 81' ' ' THR . 4.5 mtt -80.55 -30.69 37.06 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 121.181 0.515 . . . . 11.09 110.081 -179.889 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 20.9 ttt180 -78.81 -45.44 20.91 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.383 -0.826 . . . . 15.52 110.6 -179.697 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -66.14 -42.58 88.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.125 -0.489 . . . . 14.85 110.872 179.63 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.1 -39.26 86.7 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.24 -0.436 . . . . 14.109999999999999 111.257 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -59.2 -42.24 90.44 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.043 0.449 . . . . 15.73 110.61 179.86 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 5.5 mtpm? -63.32 -43.15 98.62 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.707 -0.679 . . . . 17.66 111.274 179.798 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 83.4 mt -62.67 -50.58 79.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.188 -0.46 . . . . 18.149999999999999 111.624 -179.531 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -64.67 -38.74 92.03 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.559 -0.291 . . . . 18.34 111.332 -179.504 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 29.3 t0 -66.27 91.97 0.18 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.046 0.45 . . . . 19.289999999999999 110.27 179.597 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 2.7 mmp_? -62.05 -2.31 0.89 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.692 -0.686 . . . . 22.25 112.156 -179.316 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 40.8 m-20 -124.78 177.95 5.73 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.942 0.401 . . . . 23.34 110.968 179.66 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -100.55 -4.41 54.81 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.947 -0.644 . . . . 22.0 111.947 179.29 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.88 -39.25 87.44 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.76 0.314 . . . . 22.280000000000001 111.324 -179.919 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 104.2 40.72 2.21 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.741 -0.742 . . . . 19.93 112.312 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . 0.449 ' HA ' ' O ' ' A' ' 136' ' ' ILE . 95.6 m-85 -143.62 142.04 30.87 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.675 0.274 . . . . 20.300000000000001 110.86 -179.96 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.509 ' HB ' ' HB ' ' A' ' 136' ' ' ILE . 56.6 mt -114.22 120.94 65.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.196 0 CA-C-O 121.069 0.462 . . . . 19.370000000000001 111.1 -179.937 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 31.8 p -114.38 156.18 44.81 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 115.799 -0.637 . . . . 22.489999999999998 110.564 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_exo -40.58 -36.06 1.69 Allowed 'Trans proline' 0 C--N 1.349 0.589 0 C-N-CA 122.592 2.195 . . . . 23.0 112.66 -179.6 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.458 ' O ' ' HG3' ' A' ' 106' ' ' ARG . . . -68.04 -55.41 12.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.078 0.466 . . . . 24.559999999999999 111.172 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -62.49 -31.1 71.79 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.924 -0.58 . . . . 22.23 110.956 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.619 HD23 ' HB ' ' A' ' 121' ' ' ILE . 37.2 tp -68.42 -55.28 12.44 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.715 -0.675 . . . . 20.359999999999999 112.004 -178.45 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.459 ' HB3' HD13 ' A' ' 121' ' ' ILE . 0.3 OUTLIER -57.07 -40.22 76.46 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.758 0.313 . . . . 27.190000000000001 111.485 -179.003 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 21.1 t80 -58.02 -54.17 49.93 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.361 -0.381 . . . . 25.359999999999999 111.255 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.412 ' O ' HD12 ' A' ' 112' ' ' LEU . 48.3 t -67.9 -40.73 83.98 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.197 0 CA-C-N 116.725 -0.216 . . . . 21.059999999999999 111.332 -179.764 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -50.8 -38.6 49.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.846 0.355 . . . . 20.93 110.791 179.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.685 ' HA ' ' HA ' ' A' ' 114' ' ' GLU . 88.0 mt -67.27 -24.12 31.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.044 -0.525 . . . . 25.129999999999999 111.244 179.648 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -72.56 -21.27 61.18 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.069 -0.514 . . . . 23.32 110.354 179.167 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.412 HD12 ' O ' ' A' ' 108' ' ' VAL . 6.2 mp -93.76 -84.8 0.3 Allowed 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.168 -0.469 . . . . 21.07 111.415 -179.966 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . 0.484 ' O ' ' HG2' ' A' ' 114' ' ' GLU . . . -117.49 -1.64 17.88 Favored Glycine 0 C--N 1.334 0.435 0 C-N-CA 120.702 -0.761 . . . . 23.050000000000001 112.696 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.685 ' HA ' ' HA ' ' A' ' 110' ' ' ILE . 9.1 pt-20 42.62 -170.12 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 114.284 1.216 . . . . 22.59 114.284 179.137 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.609 ' HG2' ' HG3' ' A' ' 114' ' ' GLU . 3.4 mmmp? 66.11 54.64 0.96 Allowed 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 114.535 -1.212 . . . . 27.960000000000001 111.548 -179.81 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . 0.543 ' HB ' HG23 ' A' ' 121' ' ' ILE . 1.5 m -130.11 115.38 32.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.998 -0.546 . . . . 24.75 110.991 178.837 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 72.9 p -69.32 146.69 51.99 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.186 -0.461 . . . . 27.239999999999998 110.257 179.713 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . 0.478 ' HA ' HD11 ' A' ' 121' ' ' ILE . 9.2 m-20 -53.63 -17.46 2.19 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.244 -0.434 . . . . 26.629999999999999 111.102 -179.897 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.402 ' O ' ' HG2' ' A' ' 123' ' ' GLU . 46.9 mt-10 -79.77 -55.48 4.97 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.299 -0.41 . . . . 29.140000000000001 111.81 -179.559 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.472 ' OE1' HG12 ' A' ' 116' ' ' VAL . 13.5 pt-20 -58.07 -43.69 87.1 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 120.551 0.215 . . . . 24.190000000000001 111.395 -179.311 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.619 ' HB ' HD23 ' A' ' 105' ' ' LEU . 1.8 pt -68.68 -40.17 81.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 C-N-CA 121.037 -0.265 . . . . 22.329999999999998 111.127 179.795 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -61.41 -42.05 98.12 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.753 0.311 . . . . 24.289999999999999 110.5 179.583 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.402 ' HG2' ' O ' ' A' ' 119' ' ' GLU . 20.3 mm-40 -57.71 -45.09 86.19 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.24 -0.436 . . . . 24.739999999999998 110.264 179.419 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 58.6 ttp -57.57 -37.15 72.66 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.068 -0.515 . . . . 19.710000000000001 110.292 179.1 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.544 HG23 HD11 ' A' ' 136' ' ' ILE . 64.4 mt -66.66 -42.3 89.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 115.858 -0.61 . . . . 19.949999999999999 110.414 179.386 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 66.0 ttt180 -59.6 -37.29 78.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.794 -0.639 . . . . 24.949999999999999 110.931 179.739 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -63.99 -33.16 75.11 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.054 -0.521 . . . . 18.690000000000001 111.344 -179.762 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.681 ' HB2' ' HB3' ' A' ' 144' ' ' MET . . . -95.86 -17.55 21.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.474 -0.33 . . . . 16.469999999999999 111.305 -179.824 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . 0.427 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 14.4 t0 -94.31 100.51 12.54 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.211 -0.449 . . . . 20.399999999999999 110.761 -179.852 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 88.1 m-85 -85.34 -43.07 14.01 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.899 -0.591 . . . . 21.43 111.462 -179.446 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -60.05 -24.19 64.35 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.413 -0.358 . . . . 23.370000000000001 110.798 -179.714 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 66.17 78.02 0.25 Allowed Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.91 -0.662 . . . . 24.32 112.855 179.655 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -135.29 -27.1 1.23 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.769 0.318 . . . . 23.879999999999999 110.935 179.715 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 102.9 13.47 29.37 Favored Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.82 -0.705 . . . . 22.670000000000002 112.681 179.875 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' MET . . . . . . . . . . . . . 70.2 mtp -133.05 153.63 51.32 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.677 0.275 . . . . 22.91 110.586 179.805 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.59 HG23 ' HB2' ' A' ' 140' ' ' GLU . 42.3 mm -114.95 145.65 20.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 121.282 0.563 . . . . 18.41 111.987 -179.579 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' ASN . . . . . 0.43 ' OD1' ' HB2' ' A' ' 139' ' ' GLU . 1.0 OUTLIER -119.93 157.19 29.29 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.171 -0.922 . . . . 16.82 108.965 178.136 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 79.9 t80 -39.99 -23.96 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 112.06 0.393 . . . . 14.65 112.06 -179.6 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.43 ' HB2' ' OD1' ' A' ' 137' ' ' ASN . 38.5 mt-10 -80.76 -56.13 4.35 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 120.697 0.284 . . . . 14.82 111.18 -179.223 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.59 ' HB2' HG23 ' A' ' 136' ' ' ILE . 59.8 mt-10 -60.46 -34.8 74.53 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.341 -0.391 . . . . 17.460000000000001 110.353 -179.927 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.451 ' CZ ' HG21 ' A' ' 145' ' ' ILE . 85.3 t80 -63.96 -55.0 25.67 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.0 -0.545 . . . . 12.93 110.125 179.174 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 142' ' ' VAL . . . . . 0.582 HG13 ' SD ' ' A' ' 85' ' ' MET . 2.6 t -47.91 -36.82 5.89 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 CA-C-N 115.464 -0.789 . . . . 10.699999999999999 111.79 179.306 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 143' ' ' TRP . . . . . 0.546 ' O ' ' HG2' ' A' ' 147' ' ' GLN . 91.5 t90 -69.79 -55.96 8.43 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.824 0.675 . . . . 13.66 112.824 -178.737 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 144' ' ' MET . . . . . 0.681 ' HB3' ' HB2' ' A' ' 128' ' ' ALA . 18.7 ptt? -63.91 -23.57 67.4 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 113.175 0.805 . . . . 14.5 113.175 -177.521 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 145' ' ' ILE . . . . . 0.537 HG13 ' N ' ' A' ' 146' ' ' SER . 49.2 pt -80.49 -40.7 19.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 N-CA-C 112.399 0.518 . . . . 11.25 112.399 -179.28 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 146' ' ' SER . . . . . 0.537 ' N ' HG13 ' A' ' 145' ' ' ILE . 78.7 p -61.21 -13.79 20.88 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.181 0.515 . . . . 8.5399999999999991 110.55 -179.71 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 147' ' ' GLN . . . . . 0.546 ' HG2' ' O ' ' A' ' 143' ' ' TRP . 6.3 mm-40 -98.49 -19.11 17.84 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.377 -0.828 . . . . 11.869999999999999 111.289 -179.16 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 148' ' ' LYS . . . . . 0.406 ' HG3' ' O ' ' A' ' 144' ' ' MET . 99.1 mttt . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.234 -0.889 . . . . 13.68 110.959 179.749 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 149' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 150' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 151' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_