data_2h8b_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 2h8b _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 ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 . . . . . 0 N--CA 1.45 -0.453 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 65.5 mttm -72.97 97.15 2.24 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.643 0.735 . . . . 0.0 109.324 179.261 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . 0.748 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 61.1 mt -79.1 56.22 1.97 Allowed 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 114.85 -1.068 . . . . 0.0 113.295 -177.407 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 10' ' ' CYS . . . . . 0.501 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 88.8 m -74.06 125.09 27.54 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.266 178.42 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 61.05 -126.47 40.65 Favored Glycine 0 N--CA 1.452 -0.296 0 CA-C-N 116.075 -0.511 . . . . 0.0 113.697 179.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 12' ' ' HIS . . . . . 0.578 ' O ' ' HG2' ' B' ' 16' ' ' ARG . 16.0 t-160 -55.01 -25.73 32.22 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -179.117 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 13' ' ' HIS . . . . . 0.568 ' HB3' ' HA ' ' B' ' 9' ' ' LEU . 51.6 m170 -56.12 -42.16 76.43 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.908 -0.317 . . . . 0.0 111.03 -179.255 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 14' ' ' PHE . . . . . 0.583 ' HA ' ' HB3' ' B' ' 9' ' ' LEU . 36.0 t80 -60.18 -45.83 91.79 Favored 'General case' 0 C--N 1.328 -0.34 0 O-C-N 123.43 0.456 . . . . 0.0 110.235 178.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . 0.448 ' O ' HG22 ' B' ' 19' ' ' VAL . 93.1 t -59.12 -56.89 14.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.496 -0.774 . . . . 0.0 112.228 -179.777 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . 0.578 ' HG2' ' O ' ' B' ' 12' ' ' HIS . 1.9 ptm180 -60.0 -38.56 82.97 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 120.736 0.303 . . . . 0.0 111.603 -179.727 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . 0.771 ' HA ' ' HE ' ' B' ' 20' ' ' ARG . . . -66.43 -41.57 88.99 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.823 0.344 . . . . 0.0 110.381 179.31 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 18' ' ' LEU . . . . . 0.6 HD12 ' SG ' ' B' ' 22' ' ' CYS . 53.0 tp -58.02 -45.44 86.89 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.727 179.056 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 19' ' ' VAL . . . . . 0.448 HG22 ' O ' ' B' ' 15' ' ' VAL . 40.6 t -62.39 -44.77 99.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.609 178.885 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . 0.771 ' HE ' ' HA ' ' B' ' 17' ' ' ALA . 81.5 mtm180 -57.0 -50.18 73.5 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.67 -0.696 . . . . 0.0 112.801 -179.309 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 21' ' ' VAL . . . . . 0.847 HG23 HD12 ' A' ' 20' ' ' LEU . 74.2 t -76.84 -53.19 15.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 N-CA-C 113.888 1.07 . . . . 0.0 113.888 -177.131 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 22' ' ' CYS . . . . . 0.6 ' SG ' HD12 ' B' ' 18' ' ' LEU . 81.9 m . . . . . 0 C--N 1.327 -0.398 0 N-CA-C 111.94 0.348 . . . . 0.0 111.94 -178.103 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo . . . . . 0 CA--C 1.528 0.181 0 N-CA-C 113.473 0.528 . . . . 0.0 113.473 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -59.3 -42.78 92.13 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.309 0.576 . . . . 0.0 110.456 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 5.7 tpt85 -67.89 -45.8 73.43 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.973 179.273 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 32.0 t80 -57.39 -47.46 81.62 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 114.78 -1.1 . . . . 0.0 110.78 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.748 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 89.3 m -65.45 -30.8 71.63 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.139 179.813 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.501 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 26.7 t -75.87 -57.18 4.03 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.583 0.706 . . . . 0.0 110.706 179.63 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.423 HD22 ' HA ' ' A' ' 12' ' ' LEU . 92.8 mt -59.91 -55.93 28.01 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 114.932 -1.031 . . . . 0.0 112.1 -179.3 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.2 m -92.02 -63.65 1.21 Allowed 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.194 -179.373 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.579 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 133.85 158.07 8.48 Favored Glycine 0 N--CA 1.451 -0.345 0 N-CA-C 110.686 -0.966 . . . . 0.0 110.686 -179.521 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 93.2 m -140.33 145.16 36.84 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 117.43 0.615 . . . . 0.0 111.79 -179.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 63.5 p -100.89 -168.64 1.59 Allowed 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.544 179.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.589 ' HG3' HG22 ' B' ' 21' ' ' VAL . 49.8 tt0 -69.78 -41.4 75.18 Favored 'General case' 0 CA--C 1.512 -0.487 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 177.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 66.7 tp60 -62.96 -45.92 90.15 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.801 179.197 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 63.1 m-20 -57.04 -46.72 82.2 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.326 -0.852 . . . . 0.0 109.9 179.177 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.847 HD12 HG23 ' B' ' 21' ' ' VAL . 54.7 mt -69.11 -39.81 78.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.925 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 30.3 tp -58.42 -39.45 79.8 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.99 0.424 . . . . 0.0 110.539 -179.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.6 m -63.99 -21.38 66.47 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.062 179.408 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -97.69 -4.43 37.31 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.685 179.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 93.1 m . . . . . 0 C--N 1.33 -0.251 0 CA-C-O 121.075 0.465 . . . . 0.0 110.831 -179.991 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 . . . . . 0 N--CA 1.449 -0.5 0 N-CA-C 109.287 -0.635 . . . . 0.0 109.287 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . 0.444 ' HA ' ' O ' ' A' ' 10' ' ' CYS . 65.6 mttm -73.98 94.82 2.4 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 178.818 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . 0.708 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 28.7 mt -76.18 55.33 0.94 Allowed 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 114.794 -1.093 . . . . 0.0 113.93 -176.643 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 10' ' ' CYS . . . . . 0.45 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 75.1 m -74.87 117.69 17.0 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 177.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 61.18 -121.64 27.02 Favored Glycine 0 CA--C 1.521 0.411 0 C-N-CA 121.09 -0.576 . . . . 0.0 113.695 179.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 14.8 t-160 -53.47 -28.67 31.79 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -178.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 13' ' ' HIS . . . . . 0.592 ' CB ' ' HA ' ' B' ' 9' ' ' LEU . 49.6 m170 -58.37 -40.71 83.04 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.766 -0.373 . . . . 0.0 110.707 -179.288 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 14' ' ' PHE . . . . . 0.629 ' HA ' ' HB3' ' B' ' 9' ' ' LEU . 21.4 t80 -58.55 -45.79 88.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.347 0.594 . . . . 0.0 109.8 178.897 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . 0.536 ' O ' HG23 ' B' ' 19' ' ' VAL . 94.6 t -63.04 -53.76 42.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.892 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . 0.601 ' O ' ' HG3' ' B' ' 20' ' ' ARG . 0.0 OUTLIER -61.27 -40.35 93.76 Favored 'General case' 0 N--CA 1.462 0.154 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 -179.038 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.41 -41.05 89.85 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 121.027 -0.269 . . . . 0.0 110.436 179.41 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 10.7 mt -56.45 -49.81 73.53 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.342 178.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 19' ' ' VAL . . . . . 0.536 HG23 ' O ' ' B' ' 15' ' ' VAL . 11.5 t -64.95 -38.07 81.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.748 179.691 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . 0.601 ' HG3' ' O ' ' B' ' 16' ' ' ARG . 33.4 mtm105 -62.07 -51.99 65.73 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 21' ' ' VAL . . . . . 0.472 HG21 ' HA ' ' A' ' 17' ' ' GLN . 49.1 t -73.46 -53.95 16.72 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 -177.295 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 60.3 m . . . . . 0 C--N 1.326 -0.419 0 C-N-CA 121.182 -0.207 . . . . 0.0 110.918 -178.605 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo . . . . . 0 C--O 1.226 -0.116 0 N-CA-C 113.262 0.447 . . . . 0.0 113.262 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -58.07 -40.98 82.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.169 0.509 . . . . 0.0 110.116 179.491 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.428 ' HG2' HD13 ' A' ' 12' ' ' LEU . 43.6 ttt85 -64.61 -54.69 27.93 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.134 178.911 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 26.7 t80 -56.04 -48.44 75.99 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 114.162 -1.381 . . . . 0.0 111.284 -179.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.708 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 91.0 m -64.6 -30.03 71.05 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.551 -179.834 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.45 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 35.5 t -77.83 -57.87 3.57 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.336 0.588 . . . . 0.0 110.641 179.708 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.428 HD13 ' HG2' ' A' ' 8' ' ' ARG . 88.6 mt -57.13 -58.69 7.09 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 114.94 -1.027 . . . . 0.0 111.976 -179.117 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 34.6 t -92.56 -63.21 1.26 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 120.927 0.394 . . . . 0.0 110.672 -179.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.638 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 132.01 155.73 8.1 Favored Glycine 0 N--CA 1.446 -0.691 0 N-CA-C 110.56 -1.016 . . . . 0.0 110.56 -179.454 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 90.8 m -131.85 135.48 46.74 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 117.191 0.495 . . . . 0.0 111.097 -179.186 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 31.4 p -80.6 170.07 16.81 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.054 179.372 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.472 ' HA ' HG21 ' B' ' 21' ' ' VAL . 23.2 mt-30 -66.62 -40.49 88.83 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 178.243 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 77.6 mm-40 -63.16 -43.53 98.05 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 178.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -58.82 -43.5 90.63 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.947 178.826 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.61 HD12 HD12 ' B' ' 9' ' ' LEU . 96.9 mt -69.41 -41.75 75.98 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.275 179.464 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 40.8 tp -57.55 -44.04 84.88 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.216 0.531 . . . . 0.0 110.55 -179.727 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.1 m -64.49 -16.63 62.83 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.219 179.615 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 23.8 tp -113.61 16.61 18.64 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.321 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 43.5 m . . . . . 0 C--N 1.332 -0.191 0 C-N-CA 120.208 -0.597 . . . . 0.0 111.015 179.375 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . 0.412 ' HG2' ' N ' ' B' ' 8' ' ' LYS . 26.3 tt0 . . . . . 0 C--O 1.238 0.494 0 CA-C-O 121.037 0.446 . . . . 0.0 111.028 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . 0.412 ' N ' ' HG2' ' B' ' 7' ' ' GLU . 47.3 mttm -79.48 98.22 6.73 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 177.572 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . 0.905 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 38.6 mt -78.89 57.45 2.14 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 112.805 0.669 . . . . 0.0 112.805 -177.889 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 10' ' ' CYS . . . . . 0.44 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 80.1 m -72.66 124.22 24.85 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.03 178.638 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 61.28 -124.3 34.66 Favored Glycine 0 CA--C 1.52 0.382 0 C-N-CA 121.334 -0.46 . . . . 0.0 114.077 179.272 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 23.5 t-160 -51.99 -31.2 28.33 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 123.233 0.613 . . . . 0.0 112.634 -178.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 13' ' ' HIS . . . . . 0.577 ' HB3' ' HA ' ' B' ' 9' ' ' LEU . 43.2 m170 -57.09 -42.64 81.09 Favored 'General case' 0 C--N 1.32 -0.712 0 C-N-CA 120.714 -0.395 . . . . 0.0 110.793 -179.339 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 14' ' ' PHE . . . . . 0.551 ' CA ' ' HB3' ' B' ' 9' ' ' LEU . 54.7 t80 -61.39 -46.26 90.9 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.183 0.516 . . . . 0.0 109.866 178.61 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . 0.485 ' O ' HG23 ' B' ' 19' ' ' VAL . 40.5 t -59.82 -52.35 62.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.276 -0.874 . . . . 0.0 111.674 -179.754 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . 0.677 ' HG3' ' N ' ' B' ' 17' ' ' ALA . 0.1 OUTLIER -58.65 -45.29 89.65 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.084 -178.936 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . 0.677 ' N ' ' HG3' ' B' ' 16' ' ' ARG . . . -68.41 -42.94 78.25 Favored 'General case' 0 C--O 1.218 -0.589 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.445 -179.453 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 50.2 tp -55.09 -51.1 67.45 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.731 0.301 . . . . 0.0 110.455 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 19' ' ' VAL . . . . . 0.485 HG23 ' O ' ' B' ' 15' ' ' VAL . 59.2 t -60.75 -44.82 98.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.048 179.337 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 65.7 mtp85 -66.33 -47.93 71.92 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 -179.344 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 21' ' ' VAL . . . . . 0.567 HG23 ' O ' ' B' ' 17' ' ' ALA . 95.5 t -62.01 -61.13 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 -178.882 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 68.2 m . . . . . 0 C--N 1.326 -0.436 0 CA-C-O 121.153 0.501 . . . . 0.0 111.424 -178.974 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_exo . . . . . 0 CA--C 1.528 0.203 0 N-CA-C 113.666 0.602 . . . . 0.0 113.666 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -59.27 -42.77 91.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.401 0.619 . . . . 0.0 110.303 179.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 25.0 ttt85 -65.74 -49.08 69.7 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.188 -0.915 . . . . 0.0 109.944 179.178 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 13.6 t80 -55.85 -48.17 75.99 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.833 -1.076 . . . . 0.0 110.889 179.534 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.905 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 69.0 m -63.69 -27.73 69.41 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.789 -0.641 . . . . 0.0 112.083 -179.748 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.44 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 52.7 t -86.56 -59.71 2.2 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.311 0.577 . . . . 0.0 110.792 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.461 ' HA ' HD21 ' A' ' 12' ' ' LEU . 53.2 mt -54.66 -51.6 64.96 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.158 -0.928 . . . . 0.0 111.785 -179.64 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 9.7 m -99.68 -63.07 1.16 Allowed 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 120.989 0.423 . . . . 0.0 110.546 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.638 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 127.67 149.62 7.17 Favored Glycine 0 N--CA 1.448 -0.503 0 N-CA-C 110.216 -1.154 . . . . 0.0 110.216 -179.403 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.668 ' HB2' ' CB ' ' A' ' 19' ' ' ASP . 28.3 p -144.07 -157.93 0.83 Allowed 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 117.485 0.642 . . . . 0.0 110.292 -179.01 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.589 ' H ' ' HB2' ' A' ' 19' ' ' ASP . 14.3 t -171.32 -162.77 0.25 Allowed 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 110.321 -0.251 . . . . 0.0 110.321 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.499 ' CD ' HG21 ' B' ' 21' ' ' VAL . 53.2 mm-40 -57.55 -50.29 73.57 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.674 -179.25 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 11.4 mm100 -62.02 -43.65 98.39 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.853 0.359 . . . . 0.0 110.852 -179.523 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.668 ' CB ' ' HB2' ' A' ' 15' ' ' CYS . 2.9 m-20 -58.16 -41.6 84.16 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.459 179.443 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.442 HD12 ' HB3' ' B' ' 17' ' ' ALA . 69.0 mt -78.78 -40.36 33.36 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 -179.376 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 21.2 tp -56.59 -44.29 80.94 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.561 -179.456 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 19.1 m -60.34 -22.93 63.81 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.597 179.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 94.2 mt -80.6 -26.79 37.63 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.157 179.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 97.9 m . . . . . 0 C--N 1.327 -0.397 0 CA-C-O 121.082 0.468 . . . . 0.0 111.159 -179.62 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 78.5 tt0 . . . . . 0 N--CA 1.45 -0.448 0 CA-C-O 121.304 0.573 . . . . 0.0 110.75 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 21.8 mmmt -78.48 91.95 4.59 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 177.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . 0.994 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 16.5 mt -75.56 57.74 0.98 Allowed 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 113.722 1.008 . . . . 0.0 113.722 -176.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 10' ' ' CYS . . . . . 0.421 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 87.8 m -77.18 123.11 25.96 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 178.028 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 64.11 -125.26 31.82 Favored Glycine 0 CA--C 1.521 0.451 0 C-N-CA 121.204 -0.522 . . . . 0.0 113.865 179.629 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 22.7 t-160 -52.24 -32.03 35.03 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 112.779 0.659 . . . . 0.0 112.779 -178.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 13' ' ' HIS . . . . . 0.586 ' HB3' ' HA ' ' B' ' 9' ' ' LEU . 41.0 m170 -56.41 -43.06 78.98 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 120.766 -0.374 . . . . 0.0 110.996 -179.312 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 14' ' ' PHE . . . . . 0.582 ' HA ' HD13 ' B' ' 9' ' ' LEU . 35.4 t80 -61.21 -45.73 93.38 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.176 0.513 . . . . 0.0 109.987 178.867 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 43.4 t -59.87 -51.52 71.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 115.292 -0.867 . . . . 0.0 111.866 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . 0.578 ' HG3' ' N ' ' B' ' 17' ' ' ALA . 10.7 ptt180 -62.22 -45.19 94.46 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.303 0.483 . . . . 0.0 112.303 -178.361 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . 0.578 ' N ' ' HG3' ' B' ' 16' ' ' ARG . . . -67.95 -48.27 66.34 Favored 'General case' 0 C--O 1.223 -0.324 0 N-CA-C 111.749 0.277 . . . . 0.0 111.749 -178.838 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 18' ' ' LEU . . . . . 0.546 HD11 ' SG ' ' A' ' 24' ' ' CYS . 39.0 tp -57.01 -50.83 71.53 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.078 0.466 . . . . 0.0 110.898 -179.939 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 46.5 t -60.56 -48.29 89.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.698 -0.683 . . . . 0.0 112.635 -179.565 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . 0.489 ' HA ' ' CZ ' ' B' ' 20' ' ' ARG . 0.1 OUTLIER -75.0 -39.3 61.31 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 113.956 1.095 . . . . 0.0 113.956 -178.145 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 70.0 t -71.12 -46.04 68.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -178.436 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 91.9 m . . . . . 0 C--N 1.33 -0.248 0 C-N-CA 120.332 -0.547 . . . . 0.0 111.519 -179.041 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_exo . . . . . 0 C--O 1.229 0.058 0 N-CA-C 113.693 0.613 . . . . 0.0 113.693 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.45 -45.22 85.0 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.225 0.536 . . . . 0.0 110.733 -179.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.42 ' HD2' ' HA ' ' A' ' 8' ' ' ARG . 10.3 tpt85 -70.01 -48.38 58.3 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.333 179.541 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 19.7 t80 -54.86 -52.53 62.49 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.945 -1.025 . . . . 0.0 111.52 -179.481 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.994 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 33.5 m -63.47 -32.47 73.93 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.049 -0.523 . . . . 0.0 112.198 -179.497 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.421 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 37.4 t -77.14 -57.06 4.05 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.453 0.644 . . . . 0.0 111.015 179.867 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.435 ' HA ' HD12 ' A' ' 12' ' ' LEU . 14.0 tp -62.48 -60.9 2.89 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 114.938 -1.028 . . . . 0.0 112.139 -178.905 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 9.2 m -86.02 -50.52 6.99 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.851 -178.495 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.599 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 111.16 155.41 13.63 Favored Glycine 0 N--CA 1.451 -0.35 0 N-CA-C 110.036 -1.226 . . . . 0.0 110.036 -178.543 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.68 ' HB2' ' HB3' ' A' ' 19' ' ' ASP . 18.3 p -146.0 153.92 41.31 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 118.255 1.027 . . . . 0.0 112.859 -178.806 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.544 ' O ' HD21 ' A' ' 20' ' ' LEU . 59.7 p -95.97 -179.46 4.7 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.693 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 19.8 pt20 -61.59 -44.91 96.14 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 120.679 0.276 . . . . 0.0 110.983 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 55.6 mt-30 -63.06 -36.87 85.01 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.475 0.655 . . . . 0.0 109.697 179.072 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.68 ' HB3' ' HB2' ' A' ' 15' ' ' CYS . 5.5 t0 -61.6 -42.48 98.93 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.809 -1.087 . . . . 0.0 109.481 179.416 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.678 HD23 HD12 ' B' ' 9' ' ' LEU . 1.6 mm? -67.67 -46.26 72.88 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 121.055 0.455 . . . . 0.0 110.513 177.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 26.3 tp -55.39 -47.4 75.91 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.406 -178.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.8 p -65.01 -9.95 25.76 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 -179.755 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.517 ' HG ' ' O ' ' A' ' 19' ' ' ASP . 95.7 mt -85.32 -24.76 27.52 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.79 0.329 . . . . 0.0 110.459 179.164 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.546 ' SG ' HD11 ' B' ' 18' ' ' LEU . 51.4 m . . . . . 0 C--N 1.328 -0.355 0 CA-C-O 120.874 0.369 . . . . 0.0 111.475 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . 0.417 ' CD ' HH21 ' B' ' 16' ' ' ARG . 40.0 tt0 . . . . . 0 CA--C 1.508 -0.643 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -74.93 93.25 2.65 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 178.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . 0.89 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 2.5 mp -75.41 53.55 0.68 Allowed 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.627 -0.715 . . . . 0.0 112.906 -177.683 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 80.6 m -75.31 124.6 27.37 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.007 178.472 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 60.08 -120.87 24.66 Favored Glycine 0 CA--C 1.52 0.404 0 C-N-CA 121.301 -0.476 . . . . 0.0 114.089 179.167 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 22.4 t-160 -51.41 -35.22 38.15 Favored 'General case' 0 N--CA 1.467 0.376 0 N-CA-C 113.18 0.808 . . . . 0.0 113.18 -178.422 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 13' ' ' HIS . . . . . 0.656 ' C ' ' HG ' ' B' ' 9' ' ' LEU . 36.6 m170 -56.32 -43.01 78.57 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 120.435 -0.506 . . . . 0.0 110.581 -179.092 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 14' ' ' PHE . . . . . 0.567 ' HA ' ' CD2' ' B' ' 9' ' ' LEU . 27.8 t80 -61.27 -47.47 85.85 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 178.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 20.5 t -58.21 -52.24 61.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.93 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . 0.53 ' HG3' ' N ' ' B' ' 17' ' ' ALA . 15.6 ptt180 -61.84 -46.21 90.45 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -178.206 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . 0.53 ' N ' ' HG3' ' B' ' 16' ' ' ARG . . . -68.56 -44.29 74.77 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 111.788 0.292 . . . . 0.0 111.788 -179.027 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 18' ' ' LEU . . . . . 0.608 HD11 HD13 ' A' ' 20' ' ' LEU . 20.0 tp -59.77 -51.88 67.86 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.087 -179.452 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 84.6 t -63.3 -41.19 91.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 120.662 0.268 . . . . 0.0 111.606 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . 0.912 ' HA ' ' HE ' ' B' ' 20' ' ' ARG . 0.4 OUTLIER -70.87 -48.17 55.27 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -179.071 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 87.3 t -66.3 -41.05 88.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 120.538 0.208 . . . . 0.0 111.247 -179.363 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 79.2 m . . . . . 0 C--N 1.328 -0.342 0 CA-C-O 121.158 0.504 . . . . 0.0 111.567 179.767 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_exo . . . . . 0 N--CA 1.464 -0.218 0 N-CA-C 113.416 0.506 . . . . 0.0 113.416 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.76 -43.95 85.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.136 0.493 . . . . 0.0 110.581 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.422 ' HD2' ' HA ' ' A' ' 8' ' ' ARG . 14.4 tpt180 -68.24 -51.27 47.15 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.283 179.52 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 47.0 t80 -55.57 -51.64 66.42 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 114.757 -1.11 . . . . 0.0 111.282 -179.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.89 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 14.1 m -62.48 -35.3 78.92 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.96 -179.725 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 38.2 t -72.43 -59.41 2.74 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.239 0.542 . . . . 0.0 111.562 -179.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.465 HD13 ' HA ' ' A' ' 12' ' ' LEU . 4.0 mm? -68.84 -56.6 7.46 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 113.005 0.743 . . . . 0.0 113.005 -178.416 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 13.9 m -81.74 -43.21 18.71 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 111.777 0.288 . . . . 0.0 111.777 -178.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.579 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 99.8 148.36 22.67 Favored Glycine 0 N--CA 1.45 -0.404 0 N-CA-C 110.875 -0.89 . . . . 0.0 110.875 -178.977 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.589 ' HB2' ' CB ' ' A' ' 19' ' ' ASP . 24.3 p -142.63 163.45 32.8 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 117.018 0.409 . . . . 0.0 111.897 -178.361 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.567 ' O ' HD23 ' A' ' 20' ' ' LEU . 63.3 p -114.89 -172.88 2.21 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.812 -179.389 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 24.3 pt20 -57.64 -42.5 83.56 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 120.611 0.244 . . . . 0.0 111.01 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -60.8 -41.67 96.09 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.181 0.515 . . . . 0.0 110.213 179.287 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.589 ' CB ' ' HB2' ' A' ' 15' ' ' CYS . 0.5 OUTLIER -61.99 -39.76 93.34 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.92 179.696 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.608 HD13 HD11 ' B' ' 18' ' ' LEU . 3.4 mm? -71.67 -39.34 70.35 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.751 -0.462 . . . . 0.0 109.751 178.057 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.488 HD22 ' HA ' ' A' ' 21' ' ' LEU . 2.2 tm? -57.7 -41.36 81.55 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.879 -179.898 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 30.9 p -65.83 -5.39 8.86 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 71.6 mt -105.7 -10.5 16.74 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.009 0.433 . . . . 0.0 110.303 179.581 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 62.9 m . . . . . 0 C--N 1.326 -0.429 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.754 -179.368 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 . . . . . 0 N--CA 1.453 -0.304 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . 0.507 ' HA ' ' O ' ' A' ' 10' ' ' CYS . 65.7 mttm -77.55 95.01 4.43 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.579 0.704 . . . . 0.0 110.285 -179.643 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . 1.116 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 7.9 mp -75.02 52.02 0.54 Allowed 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 114.961 -1.018 . . . . 0.0 112.369 -179.106 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 67.5 m -73.08 123.13 22.96 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.222 -0.444 . . . . 0.0 109.94 178.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 59.24 -118.36 14.01 Favored Glycine 0 CA--C 1.52 0.383 0 C-N-CA 121.259 -0.496 . . . . 0.0 113.826 179.359 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 11.1 t-160 -54.14 -32.11 54.35 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 -178.661 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 13' ' ' HIS . . . . . 0.648 ' CB ' ' HA ' ' B' ' 9' ' ' LEU . 30.3 m170 -60.75 -36.94 80.17 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 120.109 -0.637 . . . . 0.0 110.815 -178.751 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 14' ' ' PHE . . . . . 0.856 ' HA ' HD21 ' B' ' 9' ' ' LEU . 15.9 t80 -62.13 -45.36 93.81 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 178.524 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 47.9 t -63.72 -52.94 50.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.087 -0.96 . . . . 0.0 111.9 179.699 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . 0.531 ' HG3' ' O ' ' B' ' 13' ' ' HIS . 3.7 ppt_? -59.68 -44.4 93.63 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.896 -0.593 . . . . 0.0 112.066 -178.442 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . 0.561 ' HB1' HD12 ' A' ' 20' ' ' LEU . . . -69.62 -41.8 75.18 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 121.146 -0.222 . . . . 0.0 111.115 -179.373 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 18' ' ' LEU . . . . . 0.444 ' O ' ' HB2' ' B' ' 22' ' ' CYS . 7.2 mt -56.85 -55.61 32.24 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.836 0.35 . . . . 0.0 111.259 179.502 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 41.7 t -64.26 -38.44 82.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.995 -0.548 . . . . 0.0 112.315 -178.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . 0.754 ' NE ' ' HA ' ' B' ' 20' ' ' ARG . 0.1 OUTLIER -77.06 -54.5 6.46 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.125 -0.63 . . . . 0.0 112.592 -178.563 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 21' ' ' VAL . . . . . 0.632 HG11 ' HG3' ' A' ' 17' ' ' GLN . 78.3 t -63.46 -45.73 97.11 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 CA-C-N 115.734 -0.666 . . . . 0.0 112.164 -178.502 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 22' ' ' CYS . . . . . 0.444 ' HB2' ' O ' ' B' ' 18' ' ' LEU . 88.1 m . . . . . 0 C--N 1.322 -0.607 0 CA-C-O 121.337 0.589 . . . . 0.0 112.043 -179.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_exo . . . . . 0 N--CA 1.465 -0.182 0 N-CA-C 113.431 0.512 . . . . 0.0 113.431 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.6 -44.32 81.0 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.313 0.578 . . . . 0.0 110.587 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 17.3 mmm180 -67.62 -50.24 59.09 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.073 179.296 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -57.34 -49.09 77.24 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.794 179.629 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 1.116 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 65.0 m -61.88 -38.67 89.2 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.723 -0.672 . . . . 0.0 112.074 -179.66 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 47.7 t -74.46 -59.66 2.63 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.245 0.545 . . . . 0.0 111.664 -179.398 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.458 HD13 ' HA ' ' A' ' 12' ' ' LEU . 4.5 mm? -61.99 -56.56 17.89 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.541 -0.754 . . . . 0.0 112.629 -178.518 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 12.5 m -91.22 -59.26 2.2 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.932 0.396 . . . . 0.0 111.144 -179.234 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.594 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 123.57 144.46 6.55 Favored Glycine 0 N--CA 1.446 -0.675 0 N-CA-C 110.894 -0.883 . . . . 0.0 110.894 -179.513 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.593 ' SG ' HD22 ' B' ' 9' ' ' LEU . 20.8 p -130.3 153.51 48.57 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 117.162 0.481 . . . . 0.0 110.789 -179.783 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.579 HG21 ' H ' ' A' ' 19' ' ' ASP . 10.1 t -107.02 -176.86 3.2 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.638 -178.75 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.632 ' HG3' HG11 ' B' ' 21' ' ' VAL . 34.1 tt0 -59.0 -53.08 62.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.68 -179.737 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 8.8 mm100 -60.69 -38.43 84.93 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.392 0.615 . . . . 0.0 110.432 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.579 ' H ' HG21 ' A' ' 16' ' ' THR . 3.0 t0 -62.12 -41.64 98.44 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.176 -0.92 . . . . 0.0 109.818 179.362 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.561 HD12 ' HB1' ' B' ' 17' ' ' ALA . 77.8 mt -72.81 -41.36 65.01 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.014 179.131 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 45.8 tp -56.35 -45.88 80.21 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.88 -179.486 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 11.0 p -64.27 -9.98 20.87 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 179.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 98.4 mt -96.59 -20.77 18.08 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.032 179.422 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 76.5 m . . . . . 0 C--N 1.327 -0.381 0 CA-C-O 121.181 0.515 . . . . 0.0 111.872 -179.026 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . 0.619 ' HG3' HD12 ' B' ' 9' ' ' LEU . 8.8 tp10 . . . . . 0 N--CA 1.445 -0.685 0 CA-C-O 121.468 0.652 . . . . 0.0 109.475 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 6.0 mtmm -83.06 86.51 6.99 Favored 'General case' 0 C--N 1.308 -1.2 0 CA-C-N 115.331 -0.85 . . . . 0.0 109.555 -179.225 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . 0.619 HD12 ' HG3' ' B' ' 7' ' ' GLU . 1.6 mm? -74.73 54.44 0.62 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.653 -0.703 . . . . 0.0 112.878 -178.653 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 10' ' ' CYS . . . . . 0.493 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 81.2 m -71.28 119.66 15.74 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.608 178.78 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 53.47 -116.57 5.98 Favored Glycine 0 C--N 1.331 0.29 0 CA-C-N 116.161 -0.472 . . . . 0.0 113.583 179.213 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 22.6 t-160 -51.28 -34.04 31.19 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 122.978 0.511 . . . . 0.0 111.909 -179.634 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 13' ' ' HIS . . . . . 0.553 ' C ' HD13 ' B' ' 9' ' ' LEU . 46.7 m170 -55.16 -44.57 75.29 Favored 'General case' 0 C--N 1.32 -0.696 0 C-N-CA 120.495 -0.482 . . . . 0.0 110.48 -179.362 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 14' ' ' PHE . . . . . 0.456 ' CA ' ' HB3' ' B' ' 9' ' ' LEU . 25.7 t80 -62.64 -48.0 81.24 Favored 'General case' 0 C--N 1.329 -0.318 0 O-C-N 123.382 0.426 . . . . 0.0 110.229 178.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 13.0 t -56.43 -50.58 71.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.753 179.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.96 -45.08 96.17 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.016 -0.993 . . . . 0.0 112.061 -179.359 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.17 -44.56 83.7 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.769 0.319 . . . . 0.0 111.524 -179.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 29.4 tp -61.05 -51.53 68.79 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.607 -179.346 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 21.1 m -64.36 -33.89 65.69 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 -179.448 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . 0.534 ' HA ' ' NE ' ' B' ' 20' ' ' ARG . 13.9 mmp_? -77.38 -52.33 9.33 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 112.395 0.517 . . . . 0.0 112.395 -179.376 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 91.1 t -71.13 -52.75 24.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -178.545 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 83.6 m . . . . . 0 C--N 1.324 -0.542 0 CA-C-O 120.772 0.32 . . . . 0.0 111.282 -179.309 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo . . . . . 0 N--CA 1.466 -0.098 0 N-CA-C 113.416 0.506 . . . . 0.0 113.416 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -58.66 -43.35 89.83 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.024 0.44 . . . . 0.0 110.925 -179.747 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.401 ' HA ' ' HD3' ' A' ' 8' ' ' ARG . 3.0 mmt85 -73.25 -43.87 60.36 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.498 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 32.3 t80 -62.7 -51.42 67.27 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.115 -179.714 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.674 ' O ' ' HA2' ' A' ' 14' ' ' GLY . 86.6 m -67.32 -17.54 64.8 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.883 -179.577 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.493 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 28.8 t -82.95 -57.28 3.36 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.298 0.571 . . . . 0.0 110.341 178.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 97.2 mt -69.49 -57.85 4.71 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.885 -1.052 . . . . 0.0 112.555 -178.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 14.1 m -84.36 -29.68 26.07 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.085 0.469 . . . . 0.0 111.446 -178.787 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.674 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 83.62 151.31 11.41 Favored Glycine 0 N--CA 1.446 -0.672 0 C-N-CA 120.779 -0.724 . . . . 0.0 111.493 -178.861 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 82.9 m -134.79 143.79 47.29 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.933 0.396 . . . . 0.0 111.046 -179.162 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 39.7 p -80.64 167.34 20.15 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 178.559 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 4.6 pp0? -61.73 -37.64 84.97 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 179.373 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 66.9 tp60 -63.63 -43.42 96.87 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.199 178.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -59.7 -44.18 93.78 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.464 179.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 81.2 mt -65.23 -46.32 81.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.344 178.723 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 30.9 tp -57.31 -41.11 79.27 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.808 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 21.2 m -62.62 -24.16 67.44 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.36 179.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 96.6 mt -77.65 -23.19 49.74 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.487 179.244 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 43.2 m . . . . . 0 C--N 1.325 -0.458 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.251 -179.541 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 . . . . . 0 N--CA 1.451 -0.381 0 CA-C-O 120.661 0.267 . . . . 0.0 110.817 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 25.0 mtpp -71.8 98.04 1.9 Allowed 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 107.555 -1.276 . . . . 0.0 107.555 177.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . 0.786 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 32.5 mt -77.97 59.21 2.1 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 113.974 1.102 . . . . 0.0 113.974 -176.485 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 10' ' ' CYS . . . . . 0.435 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 93.2 m -80.99 122.83 27.78 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 177.759 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 63.08 -123.28 29.64 Favored Glycine 0 CA--C 1.52 0.35 0 C-N-CA 121.107 -0.568 . . . . 0.0 113.569 179.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 23.6 t-160 -53.41 -31.03 43.24 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 112.707 0.632 . . . . 0.0 112.707 -178.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 13' ' ' HIS . . . . . 0.625 ' CB ' ' HA ' ' B' ' 9' ' ' LEU . 51.4 m170 -56.5 -43.44 79.74 Favored 'General case' 0 C--N 1.321 -0.668 0 C-N-CA 120.665 -0.414 . . . . 0.0 111.26 -179.035 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 14' ' ' PHE . . . . . 0.731 ' HA ' HD11 ' B' ' 9' ' ' LEU . 45.8 t80 -61.44 -45.64 93.43 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.257 0.551 . . . . 0.0 109.666 178.691 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . 0.445 HG11 HG22 ' B' ' 19' ' ' VAL . 23.7 t -60.45 -49.4 84.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.023 -0.989 . . . . 0.0 111.588 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . 0.617 ' HG3' ' N ' ' B' ' 17' ' ' ALA . 12.5 ptt85 -61.03 -43.22 99.21 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.706 -0.224 . . . . 0.0 111.549 -178.587 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . 0.617 ' N ' ' HG3' ' B' ' 16' ' ' ARG . . . -66.41 -51.25 58.93 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.805 0.336 . . . . 0.0 111.43 -179.176 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 29.9 tp -60.37 -54.59 43.79 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.714 -179.394 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 19' ' ' VAL . . . . . 0.445 HG22 HG11 ' B' ' 15' ' ' VAL . 77.8 t -59.9 -45.36 95.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -178.698 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . 0.504 ' HA ' ' HD2' ' B' ' 20' ' ' ARG . 23.6 tpt85 -71.71 -56.18 6.28 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -178.107 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 21' ' ' VAL . . . . . 0.522 HG21 ' HB3' ' A' ' 17' ' ' GLN . 89.2 t -61.83 -45.97 97.52 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.844 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 -176.965 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 74.4 m . . . . . 0 C--N 1.326 -0.425 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 -178.89 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_exo . . . . . 0 N--CA 1.466 -0.137 0 N-CA-C 113.093 0.382 . . . . 0.0 113.093 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.86 -41.88 78.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.271 0.557 . . . . 0.0 110.666 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.446 ' HD3' ' HA ' ' A' ' 8' ' ' ARG . 30.4 mmt-85 -70.35 -49.38 49.82 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.56 -0.746 . . . . 0.0 111.184 179.335 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 28.0 t80 -59.03 -49.12 79.12 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.657 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.786 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 95.0 m -63.31 -30.48 71.61 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.65 -179.416 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.435 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 36.0 t -77.04 -56.0 4.96 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.207 0.527 . . . . 0.0 110.063 178.97 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 85.5 mt -55.23 -55.08 35.33 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.078 -0.964 . . . . 0.0 110.723 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 15.2 m -95.14 -92.88 0.19 Allowed 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.925 -0.579 . . . . 0.0 109.775 178.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 165.65 149.97 6.08 Favored Glycine 0 N--CA 1.448 -0.515 0 N-CA-C 111.221 -0.751 . . . . 0.0 111.221 179.649 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 73.9 m -134.99 134.41 40.46 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 117.191 0.495 . . . . 0.0 111.027 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.722 HG22 ' HB2' ' A' ' 19' ' ' ASP . 6.4 t -81.52 160.89 23.8 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 179.212 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.522 ' HB3' HG21 ' B' ' 21' ' ' VAL . 68.2 mm-40 -56.96 -40.09 75.83 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.234 0.54 . . . . 0.0 109.753 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 38.4 tt0 -62.59 -38.92 92.04 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.46 -0.791 . . . . 0.0 109.83 178.113 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.722 ' HB2' HG22 ' A' ' 16' ' ' THR . 11.3 t0 -57.33 -47.49 81.42 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.006 -0.997 . . . . 0.0 109.183 178.848 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.537 ' N ' HD21 ' A' ' 20' ' ' LEU . 4.4 mm? -62.18 -43.19 99.39 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.303 178.605 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 39.4 tp -54.71 -51.47 65.47 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.663 179.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 6.8 p -62.83 -16.02 56.68 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.535 ' HG ' ' O ' ' A' ' 19' ' ' ASP . 89.2 mt -80.26 -27.43 38.63 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.948 0.404 . . . . 0.0 110.235 179.08 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 88.6 m . . . . . 0 C--N 1.327 -0.387 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.187 179.941 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 62.2 tt0 . . . . . 0 C--O 1.237 0.414 0 CA-C-O 121.087 0.47 . . . . 0.0 111.123 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 10.1 mmtp -81.61 96.17 7.4 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 177.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . 0.965 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 21.5 mt -76.41 56.42 1.08 Allowed 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 112.848 0.684 . . . . 0.0 112.848 -178.079 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 99.4 m -75.94 121.45 22.7 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.164 -0.471 . . . . 0.0 109.807 178.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 62.35 -123.64 31.48 Favored Glycine 0 CA--C 1.521 0.462 0 C-N-CA 121.262 -0.494 . . . . 0.0 114.015 179.382 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 12' ' ' HIS . . . . . 0.477 ' O ' ' HG2' ' B' ' 16' ' ' ARG . 20.7 t-160 -51.44 -32.37 26.56 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 112.894 0.701 . . . . 0.0 112.894 -178.526 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 13' ' ' HIS . . . . . 0.588 ' HB3' ' HA ' ' B' ' 9' ' ' LEU . 28.7 m170 -57.75 -42.9 84.89 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 120.905 -0.318 . . . . 0.0 110.799 -179.433 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 14' ' ' PHE . . . . . 0.769 ' HA ' HD12 ' B' ' 9' ' ' LEU . 43.3 t80 -61.42 -45.9 92.39 Favored 'General case' 0 C--N 1.327 -0.396 0 O-C-N 123.418 0.449 . . . . 0.0 110.0 178.995 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . 0.451 ' O ' HG22 ' B' ' 19' ' ' VAL . 59.3 t -55.7 -56.61 11.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.568 -0.742 . . . . 0.0 112.108 -179.62 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . 0.477 ' HG2' ' O ' ' B' ' 12' ' ' HIS . 2.5 ptm180 -59.91 -47.71 84.68 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -179.147 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . 0.708 ' HB2' HD12 ' A' ' 20' ' ' LEU . . . -66.79 -43.76 83.06 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.146 0.425 . . . . 0.0 112.146 -178.818 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 18' ' ' LEU . . . . . 0.48 HD12 ' SG ' ' B' ' 22' ' ' CYS . 36.9 tp -59.34 -48.76 80.42 Favored 'General case' 0 C--N 1.327 -0.406 0 O-C-N 123.156 0.285 . . . . 0.0 110.698 -179.873 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 19' ' ' VAL . . . . . 0.451 HG22 ' O ' ' B' ' 15' ' ' VAL . 72.7 t -61.31 -44.16 97.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.744 179.728 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.5 -47.07 86.94 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.595 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 21' ' ' VAL . . . . . 0.616 HG23 ' HA ' ' A' ' 17' ' ' GLN . 69.1 t -76.08 -45.95 35.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 N-CA-C 113.013 0.746 . . . . 0.0 113.013 -177.815 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 22' ' ' CYS . . . . . 0.48 ' SG ' HD12 ' B' ' 18' ' ' LEU . 95.6 m . . . . . 0 C--N 1.324 -0.51 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 -178.464 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo . . . . . 0 N--CA 1.47 0.125 0 N-CA-C 113.448 0.519 . . . . 0.0 113.448 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.53 -39.42 87.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.499 0.666 . . . . 0.0 110.35 179.637 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.44 ' NE ' ' HA ' ' A' ' 8' ' ' ARG . 0.4 OUTLIER -67.93 -49.92 59.01 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.262 -0.881 . . . . 0.0 109.809 179.317 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 17.0 t80 -56.34 -51.59 67.7 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.031 -0.986 . . . . 0.0 111.1 179.684 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.965 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 57.6 m -61.92 -28.56 69.61 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.124 -179.588 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 42.3 t -82.52 -55.3 4.56 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.375 0.607 . . . . 0.0 111.124 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.433 HD12 ' HG3' ' A' ' 8' ' ' ARG . 91.6 mt -64.22 -58.73 5.74 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.157 -0.929 . . . . 0.0 112.417 -178.917 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 8.9 m -89.98 -43.75 10.34 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.999 0.428 . . . . 0.0 111.194 -179.17 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.691 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 103.81 149.46 20.47 Favored Glycine 0 N--CA 1.446 -0.635 0 N-CA-C 110.86 -0.896 . . . . 0.0 110.86 -178.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.574 ' SG ' HD13 ' B' ' 9' ' ' LEU . 28.2 p -139.95 -161.44 1.2 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 117.443 0.622 . . . . 0.0 110.944 -179.513 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.644 ' H ' ' HB2' ' A' ' 19' ' ' ASP . 6.9 t -160.1 -166.47 1.71 Allowed 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 -179.757 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.616 ' HA ' HG23 ' B' ' 21' ' ' VAL . 36.4 tt0 -59.0 -53.8 54.35 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.176 0.435 . . . . 0.0 112.176 -179.008 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -57.34 -45.85 83.87 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.819 0.343 . . . . 0.0 110.591 179.549 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.644 ' HB2' ' H ' ' A' ' 16' ' ' THR . 1.1 m-20 -56.53 -43.39 79.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.312 179.122 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.708 HD12 ' HB2' ' B' ' 17' ' ' ALA . 84.2 mt -72.04 -37.54 69.69 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.1 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 6.1 tt -57.13 -46.08 82.98 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.951 -179.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.5 p -64.98 -13.8 58.53 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.95 0.405 . . . . 0.0 111.73 179.076 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 19' ' ' ASP . 90.5 mt -94.19 -18.24 21.92 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.822 179.435 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 69.9 m . . . . . 0 C--N 1.333 -0.149 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.886 -179.538 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 69.1 tt0 . . . . . 0 N--CA 1.447 -0.612 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 11.5 mmmm -76.23 93.01 3.33 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 178.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . 0.942 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 34.1 mt -78.2 57.47 1.86 Allowed 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 113.057 0.762 . . . . 0.0 113.057 -177.714 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 10' ' ' CYS . . . . . 0.409 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 87.4 m -73.43 121.6 20.78 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.192 178.413 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 58.65 -119.75 19.07 Favored Glycine 0 CA--C 1.52 0.391 0 N-CA-C 114.38 0.512 . . . . 0.0 114.38 179.22 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 12' ' ' HIS . . . . . 0.507 ' O ' ' HG3' ' B' ' 16' ' ' ARG . 16.5 t-160 -50.06 -32.46 15.6 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 -178.33 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 13' ' ' HIS . . . . . 0.614 ' HB3' ' HA ' ' B' ' 9' ' ' LEU . 23.6 m170 -59.36 -41.38 89.12 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 120.875 -0.33 . . . . 0.0 111.026 -179.267 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 14' ' ' PHE . . . . . . . . . . . . . 22.7 t80 -60.91 -44.42 97.19 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.171 0.51 . . . . 0.0 109.688 178.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 60.0 t -58.55 -58.65 5.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.162 -0.926 . . . . 0.0 112.508 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . 0.618 ' HD3' ' N ' ' B' ' 17' ' ' ALA . 0.0 OUTLIER -62.5 -31.92 72.75 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 120.732 -0.387 . . . . 0.0 111.916 -179.123 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . 0.618 ' N ' ' HD3' ' B' ' 16' ' ' ARG . . . -65.77 -47.56 74.79 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.545 179.329 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 18' ' ' LEU . . . . . 0.41 ' O ' ' HB2' ' B' ' 22' ' ' CYS . 57.9 mt -61.19 -49.6 76.52 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.838 179.302 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 87.1 t -57.33 -40.98 77.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.789 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . 0.602 ' HA ' ' NE ' ' B' ' 20' ' ' ARG . 4.5 tpm_? -80.55 -59.78 2.56 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 -178.737 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 92.2 t -61.14 -44.22 97.88 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 CA-C-N 115.085 -0.962 . . . . 0.0 113.295 -177.132 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 22' ' ' CYS . . . . . 0.41 ' HB2' ' O ' ' B' ' 18' ' ' LEU . 75.9 m . . . . . 0 C--N 1.324 -0.509 0 CA-C-O 121.83 0.824 . . . . 0.0 111.684 -179.07 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_exo . . . . . 0 N--CA 1.466 -0.135 0 N-CA-C 113.265 0.448 . . . . 0.0 113.265 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.59 -44.25 85.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.104 0.478 . . . . 0.0 110.424 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 35.6 ttp180 -63.31 -52.2 62.91 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.431 -0.804 . . . . 0.0 109.807 179.085 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 60.8 t80 -55.22 -49.56 71.67 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.369 -1.287 . . . . 0.0 111.27 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.942 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 72.4 m -64.64 -31.95 73.4 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.986 -0.552 . . . . 0.0 112.173 -179.323 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.409 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 42.6 t -76.89 -54.17 6.93 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.301 0.572 . . . . 0.0 110.952 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 11.0 mp -69.84 -59.61 2.83 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.296 -0.866 . . . . 0.0 112.547 -178.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.2 m -86.06 -45.6 11.27 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.767 0.318 . . . . 0.0 111.827 -178.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.609 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 104.72 149.71 19.69 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.841 -0.695 . . . . 0.0 111.421 -179.349 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.499 ' SG ' HD23 ' A' ' 20' ' ' LEU . 27.0 p -143.29 145.07 32.4 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.137 0.494 . . . . 0.0 111.509 -179.044 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.484 HG23 ' H ' ' A' ' 19' ' ' ASP . 8.8 t -94.95 168.57 10.7 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.43 -179.261 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 5.6 mp0 -49.61 -45.31 48.02 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 122.772 0.429 . . . . 0.0 111.464 -179.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 4.2 tp60 -61.14 -40.01 92.2 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.254 0.55 . . . . 0.0 110.14 179.508 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.484 ' H ' HG23 ' A' ' 16' ' ' THR . 1.7 t70 -60.3 -43.95 95.85 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.584 179.286 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.598 HD21 HD12 ' B' ' 9' ' ' LEU . 1.8 mm? -67.49 -44.32 78.8 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.685 178.731 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 31.1 tp -55.87 -44.57 78.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.61 -179.327 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 21.7 m -60.55 -24.07 65.11 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.489 179.535 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 97.3 mt -85.14 -22.51 28.8 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.304 179.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 89.2 m . . . . . 0 C--N 1.326 -0.426 0 CA-C-O 121.112 0.482 . . . . 0.0 111.738 -179.419 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . 0.403 ' HG2' ' N ' ' B' ' 8' ' ' LYS . 55.2 tt0 . . . . . 0 N--CA 1.45 -0.45 0 CA-C-O 121.106 0.479 . . . . 0.0 110.792 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . 0.403 ' N ' ' HG2' ' B' ' 7' ' ' GLU . 41.3 mttm -87.63 96.47 10.43 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 108.031 -1.1 . . . . 0.0 108.031 177.528 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . 0.609 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 3.1 mm? -75.31 55.21 0.76 Allowed 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 -177.975 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 10' ' ' CYS . . . . . 0.435 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 73.4 m -76.24 121.8 23.44 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.697 179.018 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 55.26 -116.96 7.54 Favored Glycine 0 CA--C 1.52 0.4 0 CA-C-N 116.074 -0.512 . . . . 0.0 114.321 178.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 19.5 t-160 -50.89 -32.62 21.08 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 112.794 0.665 . . . . 0.0 112.794 -178.627 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 13' ' ' HIS . . . . . 0.589 ' HB3' ' HA ' ' B' ' 9' ' ' LEU . 20.7 m170 -59.48 -46.25 89.33 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.892 -179.273 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 14' ' ' PHE . . . . . . . . . . . . . 44.8 t80 -59.97 -40.88 90.59 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.076 0.465 . . . . 0.0 109.948 179.135 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 46.3 t -59.09 -55.35 24.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.46 -0.791 . . . . 0.0 111.439 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . 0.415 ' HG3' ' O ' ' B' ' 13' ' ' HIS . 2.8 ptm180 -63.18 -38.04 89.59 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.533 -179.484 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . 0.521 ' HB3' ' HG ' ' A' ' 20' ' ' LEU . . . -64.24 -47.46 79.54 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.714 0.293 . . . . 0.0 110.929 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 1.5 tt -60.46 -51.43 69.51 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.688 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 67.8 t -59.85 -38.19 75.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -179.511 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . 0.769 ' NE ' ' HA ' ' B' ' 20' ' ' ARG . 0.3 OUTLIER -83.24 -54.83 4.71 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -178.326 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 60.9 t -64.14 -50.72 75.66 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.554 -178.458 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 60.8 m . . . . . 0 C--O 1.217 -0.616 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 178.541 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_exo . . . . . 0 CA--C 1.526 0.077 0 N-CA-C 113.203 0.424 . . . . 0.0 113.203 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.3 -44.45 95.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.395 0.617 . . . . 0.0 110.142 179.642 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 17.8 tpt180 -66.5 -48.86 68.48 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.617 179.091 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 23.6 t80 -55.52 -50.97 68.57 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 114.203 -1.362 . . . . 0.0 111.354 -179.695 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.701 ' O ' ' HA2' ' A' ' 14' ' ' GLY . 41.6 m -69.8 -16.04 63.22 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.796 179.99 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.435 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 24.0 t -85.3 -53.81 4.99 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.764 0.792 . . . . 0.0 109.605 178.821 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 98.6 mt -66.88 -60.38 2.71 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 114.635 -1.166 . . . . 0.0 111.642 -179.608 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 24.8 m -82.08 -42.42 19.23 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.425 -179.679 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.701 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 91.72 142.89 11.14 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.762 -0.732 . . . . 0.0 111.421 -178.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.634 ' SG ' HD21 ' A' ' 20' ' ' LEU . 29.9 p -141.06 151.5 44.08 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.579 0.228 . . . . 0.0 110.438 -179.117 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.507 ' O ' HD23 ' A' ' 20' ' ' LEU . 27.8 p -76.63 170.59 16.14 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.607 -179.278 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 84.9 mm-40 -62.15 -38.0 87.34 Favored 'General case' 0 C--O 1.234 0.245 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 178.509 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 90.7 mm-40 -62.78 -37.5 86.9 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 115.397 -0.82 . . . . 0.0 109.147 177.429 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.618 ' CB ' ' HB2' ' A' ' 15' ' ' CYS . 91.8 m-20 -59.67 -43.41 94.0 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.342 -0.844 . . . . 0.0 109.022 178.355 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.634 HD21 ' SG ' ' A' ' 15' ' ' CYS . 1.8 mm? -61.25 -42.13 98.1 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 177.299 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.558 ' HA ' ' SG ' ' A' ' 24' ' ' CYS . 32.1 tp -57.98 -40.46 80.73 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.54 179.76 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 3.9 m -63.12 -22.17 66.68 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.27 0.557 . . . . 0.0 110.823 179.233 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.423 ' HA ' HD21 ' A' ' 23' ' ' LEU . 93.4 mt -82.64 -21.4 35.06 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.45 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.558 ' SG ' ' HA ' ' A' ' 21' ' ' LEU . 3.1 m . . . . . 0 CA--C 1.53 0.18 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . 0.521 ' OE2' ' HG2' ' B' ' 8' ' ' LYS . 4.7 tp10 . . . . . 0 N--CA 1.44 -0.929 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . 0.521 ' HG2' ' OE2' ' B' ' 7' ' ' GLU . 11.7 mmtm -82.72 97.8 8.75 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-O 121.372 0.605 . . . . 0.0 110.811 -177.713 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . 0.723 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 3.3 mm? -83.37 58.29 4.43 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.573 179.545 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 10' ' ' CYS . . . . . 0.523 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 71.9 m -65.07 130.95 45.24 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.857 -0.611 . . . . 0.0 112.041 -179.701 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 53.94 -122.23 22.13 Favored Glycine 0 C--N 1.332 0.325 0 CA-C-N 115.772 -0.649 . . . . 0.0 114.461 178.178 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 17.2 t-160 -52.55 -29.28 24.68 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 123.005 0.522 . . . . 0.0 112.17 -178.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 13' ' ' HIS . . . . . 0.559 ' O ' ' HG3' ' B' ' 16' ' ' ARG . 29.4 m170 -59.58 -41.86 91.19 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.736 -0.211 . . . . 0.0 110.49 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 14' ' ' PHE . . . . . 0.48 ' CZ ' ' HB2' ' A' ' 6' ' ' PRO . 8.1 t80 -62.31 -47.51 83.94 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.091 0.472 . . . . 0.0 109.931 178.387 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 56.0 t -55.58 -53.31 37.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.634 -179.645 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . 0.559 ' HG3' ' O ' ' B' ' 13' ' ' HIS . 0.0 OUTLIER -63.48 -39.03 93.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.422 -179.525 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.66 -52.91 47.97 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.557 0.218 . . . . 0.0 111.517 -179.681 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 18' ' ' LEU . . . . . 0.665 HD12 ' SG ' ' A' ' 24' ' ' CYS . 38.0 tp -57.78 -53.75 54.67 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.825 -179.329 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 85.0 t -60.35 -42.85 92.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 -178.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . 0.692 ' HA ' HH11 ' B' ' 20' ' ' ARG . 2.4 mmt-85 -72.0 -47.98 48.12 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 113.159 0.8 . . . . 0.0 113.159 -178.921 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 76.6 t -64.74 -46.81 91.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 N-CA-C 112.197 0.443 . . . . 0.0 112.197 -178.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 89.5 m . . . . . 0 C--N 1.328 -0.351 0 C-N-CA 120.941 -0.304 . . . . 0.0 111.555 -179.379 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.48 ' HB2' ' CZ ' ' B' ' 14' ' ' PHE . 23.4 Cg_exo . . . . . 0 N--CA 1.462 -0.356 0 N-CA-C 112.646 0.21 . . . . 0.0 112.646 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.19 -43.92 83.12 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.972 0.415 . . . . 0.0 110.75 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -67.87 -48.93 64.7 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.095 179.505 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 33.2 t80 -56.52 -52.99 62.68 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 114.936 -1.029 . . . . 0.0 111.306 -179.702 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.723 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 22.5 m -65.46 -23.9 67.03 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.036 -0.529 . . . . 0.0 112.32 -179.73 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.523 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 53.7 t -82.12 -52.89 6.55 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.413 0.625 . . . . 0.0 110.598 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 15.3 tp -69.71 -63.39 1.08 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.041 -0.982 . . . . 0.0 112.182 -178.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 36.3 t -81.3 -33.97 32.27 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.395 -178.682 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.69 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 88.6 158.47 33.82 Favored Glycine 0 N--CA 1.443 -0.887 0 C-N-CA 120.57 -0.824 . . . . 0.0 111.156 -178.541 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.618 ' SG ' HD23 ' A' ' 20' ' ' LEU . 26.5 p -151.04 166.8 29.61 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.818 0.309 . . . . 0.0 110.795 -179.204 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.603 ' O ' HD22 ' A' ' 20' ' ' LEU . 0.2 OUTLIER -121.95 -169.97 1.97 Allowed 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 116.444 -0.343 . . . . 0.0 111.323 -179.17 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 23.8 pt20 -58.4 -51.71 68.67 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -178.399 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 95.4 mm-40 -63.18 -35.96 82.04 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 43.7 m-20 -58.68 -47.0 86.01 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.033 178.461 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.618 HD23 ' SG ' ' A' ' 15' ' ' CYS . 1.4 mm? -66.19 -44.68 83.28 Favored 'General case' 0 CA--C 1.522 -0.112 0 CA-C-O 120.878 0.37 . . . . 0.0 110.488 178.86 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 31.0 tp -55.36 -53.36 57.2 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.044 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 35.4 p -64.64 -12.05 41.84 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.093 -0.503 . . . . 0.0 112.24 179.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.661 HD21 HD13 ' B' ' 18' ' ' LEU . 24.6 tp -78.66 -28.74 45.44 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 179.688 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.665 ' SG ' HD12 ' B' ' 18' ' ' LEU . 93.2 m . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.672 179.563 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 77.4 tt0 . . . . . 0 C--O 1.238 0.48 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . 0.444 ' HA ' ' O ' ' A' ' 10' ' ' CYS . 24.5 mmtp -82.47 104.68 12.93 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 179.383 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . 0.766 ' HB2' ' SG ' ' A' ' 10' ' ' CYS . 6.5 mp -81.12 52.04 1.71 Allowed 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 -179.158 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 71.0 m -72.56 121.32 19.5 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.172 178.856 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 61.08 -120.94 24.89 Favored Glycine 0 CA--C 1.522 0.47 0 N-CA-C 114.417 0.527 . . . . 0.0 114.417 179.168 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 13.5 t-80 -50.18 -33.36 18.95 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 113.589 0.959 . . . . 0.0 113.589 -178.082 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 13' ' ' HIS . . . . . 0.576 ' CB ' ' HA ' ' B' ' 9' ' ' LEU . 24.3 m170 -58.34 -41.43 84.62 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.914 -0.315 . . . . 0.0 111.024 -179.117 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 14' ' ' PHE . . . . . 0.668 ' HA ' HD23 ' B' ' 9' ' ' LEU . 22.5 t80 -62.63 -45.09 94.44 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.014 0.435 . . . . 0.0 110.127 179.321 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 51.4 t -59.02 -58.78 5.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.407 -0.815 . . . . 0.0 112.119 -179.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . 0.402 ' NH2' HD11 ' B' ' 9' ' ' LEU . 0.0 OUTLIER -59.53 -39.79 85.08 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.872 -179.104 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . 0.498 ' HB3' ' CD1' ' A' ' 20' ' ' LEU . . . -66.01 -43.27 88.17 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.967 -0.293 . . . . 0.0 111.069 -179.933 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 9.7 mt -60.01 -56.3 23.43 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.826 179.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 7.8 t -65.93 -29.04 45.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -178.569 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . 0.571 ' HA ' ' NE ' ' B' ' 20' ' ' ARG . 3.3 tpm_? -80.12 -59.79 2.58 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 119.906 -0.718 . . . . 0.0 111.512 -179.828 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 60.2 t -65.19 -50.28 74.68 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 CA-C-N 115.209 -0.905 . . . . 0.0 111.739 -178.434 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 56.4 m . . . . . 0 C--N 1.322 -0.61 0 CA-C-O 120.926 0.393 . . . . 0.0 110.635 -179.669 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo . . . . . 0 C--O 1.232 0.201 0 N-CA-C 113.631 0.589 . . . . 0.0 113.631 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.14 -43.32 95.8 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.347 0.594 . . . . 0.0 110.204 179.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.629 ' HA ' ' HE ' ' A' ' 8' ' ' ARG . 1.1 mmp_? -67.72 -47.59 68.92 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.956 179.147 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 9.7 t80 -58.04 -53.4 58.72 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.891 -179.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.766 ' SG ' ' HB2' ' B' ' 9' ' ' LEU . 9.3 t -69.42 -18.4 63.74 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 112.08 0.4 . . . . 0.0 112.08 -178.41 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 26.9 t -85.51 -51.28 6.62 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.798 0.808 . . . . 0.0 109.879 178.817 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.417 ' HA ' HD13 ' A' ' 12' ' ' LEU . 14.9 tp -66.06 -62.5 1.45 Allowed 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 114.559 -1.2 . . . . 0.0 111.284 -179.798 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 6.8 m -85.07 -45.3 12.23 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.39 -179.165 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.731 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 99.93 144.19 15.7 Favored Glycine 0 N--CA 1.452 -0.264 0 N-CA-C 111.2 -0.76 . . . . 0.0 111.2 -179.077 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.551 ' HB2' ' HB3' ' A' ' 19' ' ' ASP . 24.0 p -134.69 -151.03 0.41 Allowed 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 120.749 -0.38 . . . . 0.0 111.303 -178.475 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.575 HG21 ' H ' ' A' ' 19' ' ' ASP . 13.1 t -158.9 176.99 11.63 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -179.099 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 5.7 mp0 -56.62 -45.01 81.76 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 123.289 0.368 . . . . 0.0 110.823 -179.546 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -64.23 -41.61 96.93 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.965 0.412 . . . . 0.0 109.956 179.621 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.575 ' H ' HG21 ' A' ' 16' ' ' THR . 0.1 OUTLIER -58.73 -38.83 79.21 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.278 -0.873 . . . . 0.0 110.154 178.959 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.498 ' CD1' ' HB3' ' B' ' 17' ' ' ALA . 77.5 mt -75.7 -47.26 26.93 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.911 179.292 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 36.3 tp -52.08 -51.96 54.28 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.734 -0.666 . . . . 0.0 112.158 -178.581 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 15.3 t -63.48 -13.03 36.46 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 112.245 0.461 . . . . 0.0 112.245 -179.445 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 39.8 tp -102.73 -16.83 15.87 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.035 -179.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 87.4 m . . . . . 0 C--N 1.328 -0.346 0 CA-C-O 120.939 0.399 . . . . 0.0 112.046 -179.092 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 74.2 tt0 . . . . . 0 N--CA 1.444 -0.738 0 N-CA-C 108.374 -0.973 . . . . 0.0 108.374 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 18.0 mmtp -76.06 101.54 5.33 Favored 'General case' 0 C--N 1.315 -0.923 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 179.469 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . 0.994 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 8.4 mp -80.91 51.9 1.64 Allowed 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 112.57 0.581 . . . . 0.0 112.57 -178.772 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 73.5 m -70.67 120.21 15.95 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.061 178.645 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 61.65 -120.24 21.55 Favored Glycine 0 CA--C 1.523 0.545 0 N-CA-C 114.542 0.577 . . . . 0.0 114.542 179.207 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 13.3 t-80 -49.56 -33.99 16.39 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 113.751 1.019 . . . . 0.0 113.751 -177.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 13' ' ' HIS . . . . . 0.631 ' CB ' ' HA ' ' B' ' 9' ' ' LEU . 25.7 m170 -58.28 -41.27 84.02 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.795 -0.362 . . . . 0.0 110.949 -179.252 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 14' ' ' PHE . . . . . 0.562 ' HA ' ' CD2' ' B' ' 9' ' ' LEU . 31.7 t80 -62.51 -46.39 88.65 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.898 0.38 . . . . 0.0 110.074 178.866 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 62.1 t -55.5 -57.73 6.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.571 -0.741 . . . . 0.0 112.05 -179.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.08 -40.18 92.71 Favored 'General case' 0 N--CA 1.464 0.226 0 N-CA-C 112.342 0.497 . . . . 0.0 112.342 -178.93 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . 0.437 ' HB1' ' HG ' ' A' ' 20' ' ' LEU . . . -70.05 -46.82 64.19 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.612 -179.601 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 57.7 tp -56.76 -52.17 66.05 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.836 -179.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 89.7 t -62.47 -48.14 89.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.824 -0.625 . . . . 0.0 112.252 -179.659 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . 0.881 ' HA ' ' HE ' ' B' ' 20' ' ' ARG . 0.0 OUTLIER -70.52 -40.85 73.25 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 114.031 1.123 . . . . 0.0 114.031 -178.322 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 21' ' ' VAL . . . . . 0.454 HG22 ' HG3' ' A' ' 17' ' ' GLN . 71.3 t -73.11 -46.77 50.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -178.233 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 80.6 m . . . . . 0 C--N 1.327 -0.403 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 -178.225 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.408 ' HB2' ' CZ ' ' B' ' 14' ' ' PHE . 16.9 Cg_exo . . . . . 0 N--CA 1.465 -0.161 0 N-CA-C 113.179 0.415 . . . . 0.0 113.179 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.71 -42.07 78.51 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.051 0.453 . . . . 0.0 110.527 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 13.9 ttm180 -61.7 -54.45 42.41 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.012 179.367 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 35.3 t80 -57.57 -49.16 77.3 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.627 -1.17 . . . . 0.0 111.295 -179.705 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.994 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 54.3 m -65.23 -27.39 68.63 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.966 -0.561 . . . . 0.0 112.243 -179.365 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 52.2 t -80.83 -52.7 7.2 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.556 0.693 . . . . 0.0 110.23 179.516 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 90.8 mt -64.25 -57.9 8.1 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 114.891 -1.05 . . . . 0.0 112.44 -179.175 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 35.5 t -93.3 -44.35 8.35 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 111.725 0.269 . . . . 0.0 111.725 -179.006 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.659 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 105.26 157.82 22.94 Favored Glycine 0 N--CA 1.452 -0.26 0 N-CA-C 110.924 -0.87 . . . . 0.0 110.924 -178.814 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.513 ' HB2' ' CB ' ' A' ' 19' ' ' ASP . 25.7 p -151.28 159.75 44.18 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 117.343 0.571 . . . . 0.0 112.513 -178.295 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.508 ' O ' HD23 ' A' ' 20' ' ' LEU . 48.2 p -106.73 -174.41 2.53 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.242 179.583 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.454 ' HG3' HG22 ' B' ' 21' ' ' VAL . 54.9 tt0 -57.42 -48.97 77.73 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 111.933 0.346 . . . . 0.0 111.933 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 60.9 tp60 -59.55 -41.96 91.29 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.109 0.481 . . . . 0.0 109.884 179.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.627 ' O ' ' HG ' ' A' ' 23' ' ' LEU . 34.2 m-20 -57.14 -44.94 83.88 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.274 -0.875 . . . . 0.0 109.629 179.061 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.508 HD23 ' O ' ' A' ' 16' ' ' THR . 3.6 mm? -59.65 -48.37 81.93 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-O 120.768 0.318 . . . . 0.0 110.527 178.228 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 8.9 tt -55.62 -47.46 76.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.68 179.472 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 8.3 m -60.59 -25.21 66.05 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.331 -0.85 . . . . 0.0 111.816 179.605 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.627 ' HG ' ' O ' ' A' ' 19' ' ' ASP . 96.6 mt -73.09 -30.6 63.79 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.272 179.324 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 7.4 m . . . . . 0 C--N 1.326 -0.419 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.034 178.766 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.446 -0.635 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -80.31 86.4 5.68 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 179.365 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . 0.967 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 14.6 mt -74.11 55.1 0.56 Allowed 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 -176.891 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 10' ' ' CYS . . . . . 0.412 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 73.8 m -74.24 117.36 15.96 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 177.878 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 63.46 -121.76 24.92 Favored Glycine 0 CA--C 1.521 0.459 0 C-N-CA 121.157 -0.544 . . . . 0.0 113.78 179.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 23.6 t-160 -51.79 -32.08 29.71 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 112.825 0.676 . . . . 0.0 112.825 -178.706 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 13' ' ' HIS . . . . . 0.683 ' CB ' ' HA ' ' B' ' 9' ' ' LEU . 52.0 m170 -57.57 -39.76 77.43 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 120.437 -0.505 . . . . 0.0 110.74 -179.387 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 14' ' ' PHE . . . . . 0.576 ' CA ' ' HB3' ' B' ' 9' ' ' LEU . 34.4 t80 -62.01 -44.34 96.92 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.331 0.586 . . . . 0.0 109.823 178.766 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 55.1 t -62.02 -49.23 84.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.121 -0.945 . . . . 0.0 111.76 179.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . 0.643 ' HG2' ' HA ' ' B' ' 13' ' ' HIS . 19.2 ptt180 -62.51 -44.99 95.02 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.731 -178.885 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . 0.511 ' N ' ' HG3' ' B' ' 16' ' ' ARG . . . -65.54 -41.28 93.2 Favored 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 120.925 -0.31 . . . . 0.0 111.021 -179.854 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 63.6 tp -59.35 -54.72 43.51 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.175 179.89 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 19' ' ' VAL . . . . . 0.4 HG23 ' O ' ' B' ' 16' ' ' ARG . 22.3 m -64.67 -28.11 44.08 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.187 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -179.387 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . 0.765 ' NE ' ' HA ' ' B' ' 20' ' ' ARG . 3.5 mmp_? -84.49 -48.93 9.09 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -179.41 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 21' ' ' VAL . . . . . 0.424 HG12 ' HG3' ' A' ' 17' ' ' GLN . 58.4 t -63.54 -47.21 92.56 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.781 -179.245 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 79.3 m . . . . . 0 C--N 1.325 -0.478 0 C-N-CA 120.412 -0.515 . . . . 0.0 111.753 -179.272 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo . . . . . 0 N--CA 1.473 0.301 0 N-CA-C 114.156 0.791 . . . . 0.0 114.156 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -58.83 -41.64 87.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.404 0.621 . . . . 0.0 110.401 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.412 HH11 HD11 ' A' ' 12' ' ' LEU . 13.4 mmt180 -66.21 -44.45 83.84 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.722 179.051 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 7.1 t80 -58.58 -46.77 86.24 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.093 0.473 . . . . 0.0 110.188 178.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.967 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 55.3 m -61.17 -29.42 69.79 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.446 -0.797 . . . . 0.0 112.134 -179.913 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.412 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 44.0 t -86.96 -53.59 4.81 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.552 0.692 . . . . 0.0 111.06 -179.945 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.412 HD11 HH11 ' A' ' 8' ' ' ARG . 9.0 mp -62.79 -40.64 97.97 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.857 -1.065 . . . . 0.0 113.433 -178.673 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 19.6 m -113.71 -42.01 3.5 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 121.074 0.464 . . . . 0.0 111.131 -178.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.613 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 105.99 144.13 12.04 Favored Glycine 0 N--CA 1.442 -0.929 0 C-N-CA 120.869 -0.681 . . . . 0.0 111.512 -179.073 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.677 ' HB2' ' CB ' ' A' ' 19' ' ' ASP . 31.0 p -139.04 149.58 44.79 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 -179.453 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.623 HG22 ' OD1' ' A' ' 19' ' ' ASP . 6.2 t -111.78 -167.37 1.17 Allowed 'General case' 0 C--N 1.327 -0.384 0 O-C-N 122.256 -0.277 . . . . 0.0 110.702 -179.037 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.424 ' HG3' HG12 ' B' ' 21' ' ' VAL . 53.7 tt0 -53.28 -46.28 69.24 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.199 -0.455 . . . . 0.0 112.067 -179.186 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -60.23 -44.33 95.3 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.691 -0.231 . . . . 0.0 110.819 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.677 ' CB ' ' HB2' ' A' ' 15' ' ' CYS . 1.6 m-20 -58.65 -44.62 90.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.237 -0.438 . . . . 0.0 109.918 179.276 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.518 HD23 ' O ' ' A' ' 16' ' ' THR . 3.9 mm? -66.95 -44.82 79.57 Favored 'General case' 0 CA--C 1.52 -0.2 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.787 179.376 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 19.6 tp -56.86 -48.53 77.89 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.912 -179.232 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 18.2 p -63.6 -15.96 59.56 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 179.786 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 45.3 tp -87.01 -24.76 24.55 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.572 179.611 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 79.9 m . . . . . 0 C--N 1.327 -0.381 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.257 -179.539 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 . . . . . 0 N--CA 1.45 -0.466 0 CA-C-O 121.074 0.464 . . . . 0.0 109.77 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . 0.437 ' HA ' ' O ' ' A' ' 10' ' ' CYS . 1.5 mppt? -78.85 97.71 6.07 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.546 179.622 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . 0.872 HD11 HD23 ' A' ' 20' ' ' LEU . 15.1 mt -76.25 52.48 0.75 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.417 -0.81 . . . . 0.0 112.49 -178.517 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 69.4 m -72.72 120.2 18.01 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 178.649 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 61.06 -118.07 13.79 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 121.244 -0.503 . . . . 0.0 113.891 179.599 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 18.1 t-160 -54.07 -31.68 52.47 Favored 'General case' 0 N--CA 1.465 0.306 0 N-CA-C 113.06 0.763 . . . . 0.0 113.06 -178.471 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 13' ' ' HIS . . . . . 0.621 ' CB ' ' HA ' ' B' ' 9' ' ' LEU . 26.8 m170 -61.22 -38.76 87.76 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 120.164 -0.614 . . . . 0.0 111.187 -178.668 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 14' ' ' PHE . . . . . 0.609 ' CA ' ' HB3' ' B' ' 9' ' ' LEU . 33.0 t80 -61.19 -45.0 96.4 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 178.567 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 56.4 t -62.01 -50.92 78.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 114.972 -1.013 . . . . 0.0 111.753 179.776 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . 0.604 ' HG3' ' O ' ' B' ' 13' ' ' HIS . 4.4 ppt_? -61.88 -42.83 99.53 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 112.258 0.466 . . . . 0.0 112.258 -178.414 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -70.33 -45.85 65.35 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 121.01 -0.276 . . . . 0.0 111.406 -179.446 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 18' ' ' LEU . . . . . 0.53 ' HB2' ' O ' ' B' ' 14' ' ' PHE . 0.4 OUTLIER -56.63 -54.41 46.41 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.647 -179.869 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 90.8 t -62.26 -48.25 89.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -178.819 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . 0.412 ' HD2' ' HA ' ' B' ' 20' ' ' ARG . 24.6 mmm-85 -67.63 -45.06 76.47 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 114.245 1.202 . . . . 0.0 114.245 -178.23 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 99.4 t -76.2 -42.95 37.68 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 N-CA-C 113.01 0.745 . . . . 0.0 113.01 -177.671 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 99.0 m . . . . . 0 C--N 1.324 -0.531 0 N-CA-C 113.347 0.869 . . . . 0.0 113.347 -177.987 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_exo . . . . . 0 N--CA 1.469 0.061 0 N-CA-C 113.351 0.481 . . . . 0.0 113.351 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -58.8 -42.56 89.4 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.303 0.573 . . . . 0.0 110.296 179.822 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.439 ' HD3' ' HA ' ' A' ' 8' ' ' ARG . 14.4 tpp180 -64.96 -50.06 67.87 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.36 -0.836 . . . . 0.0 109.742 179.026 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 31.8 t80 -55.86 -49.58 72.96 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.573 -1.194 . . . . 0.0 111.214 179.806 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.846 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 56.5 m -68.11 -29.14 68.0 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.0 -0.545 . . . . 0.0 112.398 -179.323 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 44.7 t -79.16 -55.05 5.39 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.369 0.604 . . . . 0.0 110.902 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.483 ' N ' HD13 ' A' ' 12' ' ' LEU . 11.2 mp -67.14 -47.34 71.36 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.266 -0.879 . . . . 0.0 112.562 -179.024 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.5 m -100.98 -52.67 3.23 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.931 0.396 . . . . 0.0 111.323 -179.223 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.626 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 115.29 161.67 13.23 Favored Glycine 0 N--CA 1.445 -0.754 0 C-N-CA 120.36 -0.924 . . . . 0.0 112.295 -179.898 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.413 ' HB2' ' HB2' ' A' ' 19' ' ' ASP . 21.4 p -155.1 153.58 31.07 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.899 0.38 . . . . 0.0 110.206 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.431 ' O ' HD21 ' A' ' 20' ' ' LEU . 72.0 p -103.08 179.9 4.14 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.319 -179.373 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 5.9 mp0 -58.04 -39.76 79.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.245 179.295 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 10.8 mm100 -63.5 -40.88 98.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.3 179.215 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.413 ' HB2' ' HB2' ' A' ' 15' ' ' CYS . 51.4 m-20 -61.23 -42.79 99.23 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.457 178.934 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.872 HD23 HD11 ' B' ' 9' ' ' LEU . 3.6 mm? -66.11 -45.6 80.56 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.365 178.541 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 25.7 tp -56.84 -42.38 79.54 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.848 -179.619 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 19.7 m -65.65 -21.07 66.53 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.345 0.593 . . . . 0.0 111.327 179.676 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 33.8 tp -86.33 -1.28 57.38 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.946 179.852 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 74.3 m . . . . . 0 C--N 1.324 -0.513 0 CA-C-O 120.947 0.403 . . . . 0.0 111.451 -179.582 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . 0.665 ' HG3' HD23 ' B' ' 9' ' ' LEU . 11.8 tp10 . . . . . 0 N--CA 1.447 -0.614 0 CA-C-O 121.46 0.648 . . . . 0.0 110.309 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . 0.456 ' HD3' ' N ' ' B' ' 8' ' ' LYS . 0.7 OUTLIER -82.87 95.33 7.91 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 179.876 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . 0.665 HD23 ' HG3' ' B' ' 7' ' ' GLU . 18.8 mt -77.45 54.47 1.16 Allowed 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 -177.561 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 10' ' ' CYS . . . . . 0.418 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 74.4 m -72.51 121.06 19.02 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.039 178.307 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 57.97 -120.21 20.57 Favored Glycine 0 CA--C 1.52 0.392 0 C-N-CA 121.34 -0.457 . . . . 0.0 113.892 179.323 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 23.6 t-160 -52.77 -30.71 34.42 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -178.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 13' ' ' HIS . . . . . 0.613 ' HA ' ' HG2' ' B' ' 16' ' ' ARG . 46.9 m170 -58.46 -41.84 86.08 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 120.438 -0.505 . . . . 0.0 110.682 -179.456 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 14' ' ' PHE . . . . . 0.639 ' HA ' HD12 ' B' ' 9' ' ' LEU . 34.3 t80 -60.88 -44.39 97.14 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.217 0.532 . . . . 0.0 109.753 178.766 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 46.9 t -61.15 -50.59 79.87 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.254 -0.885 . . . . 0.0 111.751 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . 0.613 ' HG2' ' HA ' ' B' ' 13' ' ' HIS . 18.5 ptt180 -62.05 -45.31 94.1 Favored 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -178.723 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . 0.531 ' N ' ' HG3' ' B' ' 16' ' ' ARG . . . -67.53 -43.43 80.8 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 111.76 0.281 . . . . 0.0 111.76 -179.216 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 18' ' ' LEU . . . . . 0.576 ' O ' ' HB2' ' B' ' 22' ' ' CYS . 3.7 tt -60.61 -55.38 34.04 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 110.118 -0.327 . . . . 0.0 110.118 -179.799 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 83.5 t -57.28 -41.43 78.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.166 -0.47 . . . . 0.0 112.217 -179.605 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . 0.616 ' NE ' ' HA ' ' B' ' 20' ' ' ARG . 4.0 tpm_? -78.95 -60.87 2.21 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 113.32 0.859 . . . . 0.0 113.32 -178.517 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 63.0 t -65.44 -45.68 92.22 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.85 0 N-CA-C 114.004 1.113 . . . . 0.0 114.004 -176.489 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 22' ' ' CYS . . . . . 0.576 ' HB2' ' O ' ' B' ' 18' ' ' LEU . 73.0 m . . . . . 0 C--N 1.327 -0.408 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -178.271 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo . . . . . 0 N--CA 1.472 0.216 0 N-CA-C 114.091 0.766 . . . . 0.0 114.091 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.86 -43.25 98.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.4 0.619 . . . . 0.0 110.169 179.79 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 26.1 ttm180 -66.28 -49.07 68.34 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.258 -0.883 . . . . 0.0 109.885 179.212 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 16.2 t80 -54.93 -50.76 68.05 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 114.452 -1.249 . . . . 0.0 111.33 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.648 ' SG ' ' HG ' ' B' ' 9' ' ' LEU . 35.5 t -73.01 -12.67 61.01 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.798 0.332 . . . . 0.0 111.713 -179.15 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.418 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 16.0 t -83.99 -53.55 5.48 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 121.723 0.773 . . . . 0.0 109.075 178.36 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.9 mp -69.81 -45.21 68.41 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.376 -1.283 . . . . 0.0 112.67 -179.73 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 8.3 m -98.36 -34.78 10.54 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 112.174 0.435 . . . . 0.0 112.174 -178.218 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.605 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 87.76 150.52 19.73 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.642 -0.79 . . . . 0.0 112.105 -179.026 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.609 ' HB2' ' CB ' ' A' ' 19' ' ' ASP . 32.1 p -148.28 148.73 30.77 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.845 0.355 . . . . 0.0 110.152 -179.216 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.546 ' O ' HD23 ' A' ' 20' ' ' LEU . 65.1 p -94.13 -176.63 4.05 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.95 0.405 . . . . 0.0 111.448 -178.545 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.0 pm0 -60.78 -40.2 91.71 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 115.956 -0.566 . . . . 0.0 109.785 178.321 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 37.2 tt0 -60.29 -45.04 94.72 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.25 -0.886 . . . . 0.0 109.531 178.498 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.609 ' CB ' ' HB2' ' A' ' 15' ' ' CYS . 12.3 m-20 -56.26 -45.84 79.9 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 114.997 -1.001 . . . . 0.0 109.762 178.897 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.555 HD21 ' SG ' ' A' ' 15' ' ' CYS . 3.2 mm? -63.96 -44.7 91.99 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.543 178.491 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 32.0 tp -56.7 -45.85 81.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.413 -179.284 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.0 p -66.19 -10.75 44.47 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -179.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -109.39 12.42 24.66 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.601 -0.272 . . . . 0.0 111.26 179.57 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 96.1 m . . . . . 0 C--N 1.328 -0.339 0 CA-C-O 121.192 0.52 . . . . 0.0 111.491 179.709 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.237 0.417 0 N-CA-C 109.533 -0.544 . . . . 0.0 109.533 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . 0.773 ' HZ2' ' HB2' ' B' ' 8' ' ' LYS . 4.8 mtmp? -73.17 96.29 2.21 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.293 179.943 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . 0.685 ' HB2' ' SG ' ' A' ' 10' ' ' CYS . 96.6 mt -88.01 58.9 5.05 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.4 0.619 . . . . 0.0 111.307 -179.723 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 10' ' ' CYS . . . . . 0.462 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 99.5 m -64.45 136.86 57.5 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.611 -0.722 . . . . 0.0 112.001 179.827 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 57.42 -125.05 37.96 Favored Glycine 0 CA--C 1.518 0.266 0 CA-C-N 115.644 -0.707 . . . . 0.0 114.809 177.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 15.4 t-160 -50.69 -31.45 16.46 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 123.325 0.65 . . . . 0.0 112.736 -178.228 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 13' ' ' HIS . . . . . 0.445 ' HB3' HD21 ' B' ' 9' ' ' LEU . 22.6 m170 -59.51 -43.68 93.31 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 121.216 -0.194 . . . . 0.0 111.134 -179.42 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 14' ' ' PHE . . . . . . . . . . . . . 34.6 t80 -64.05 -42.3 97.09 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.168 0.509 . . . . 0.0 109.86 178.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . 0.562 ' O ' HG22 ' B' ' 19' ' ' VAL . 39.3 t -58.84 -56.67 15.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.379 -179.935 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . 0.531 ' HD3' ' N ' ' B' ' 17' ' ' ALA . 0.0 OUTLIER -61.07 -35.06 75.95 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-O 120.754 0.311 . . . . 0.0 110.971 -179.676 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . 0.531 ' N ' ' HD3' ' B' ' 16' ' ' ARG . . . -64.15 -46.76 82.61 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.48 179.109 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 21.2 mt -60.51 -45.92 92.03 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.433 179.452 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 19' ' ' VAL . . . . . 0.562 HG22 ' O ' ' B' ' 15' ' ' VAL . 14.7 t -60.62 -39.55 81.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-O 120.939 0.4 . . . . 0.0 110.8 -179.737 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 31.4 tpt85 -74.27 -57.67 3.8 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.286 0.565 . . . . 0.0 112.081 -179.657 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 21' ' ' VAL . . . . . 0.534 HG23 ' HA ' ' A' ' 17' ' ' GLN . 65.2 t -65.9 -57.36 10.95 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.892 0 CA-C-N 114.706 -1.134 . . . . 0.0 113.502 -177.019 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 56.8 m . . . . . 0 C--N 1.324 -0.542 0 CA-C-O 120.883 0.373 . . . . 0.0 111.527 -178.219 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo . . . . . 0 C--O 1.235 0.338 0 N-CA-C 113.446 0.518 . . . . 0.0 113.446 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.31 -46.35 90.19 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.202 0.525 . . . . 0.0 110.64 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.426 ' HD3' ' HA ' ' A' ' 8' ' ' ARG . 3.6 mmt180 -68.8 -39.35 80.16 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.121 179.484 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 31.3 t80 -57.93 -53.43 58.34 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.081 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.685 ' SG ' ' HB2' ' B' ' 9' ' ' LEU . 49.0 t -69.46 -18.35 63.71 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.018 0.437 . . . . 0.0 111.487 -179.64 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.462 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 16.2 t -81.09 -53.02 6.76 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.474 0.654 . . . . 0.0 110.47 179.401 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 94.2 mt -75.37 -57.88 3.62 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.044 -0.98 . . . . 0.0 112.51 -179.131 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 14.2 m -81.98 -29.4 32.15 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.823 0.344 . . . . 0.0 111.72 -178.783 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.587 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 86.13 147.66 10.71 Favored Glycine 0 N--CA 1.447 -0.59 0 C-N-CA 120.533 -0.841 . . . . 0.0 111.648 -178.914 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.404 ' SG ' HD13 ' B' ' 9' ' ' LEU . 18.1 p -139.84 -160.03 1.02 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.885 0.342 . . . . 0.0 110.529 -179.885 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.699 HG22 ' HB2' ' A' ' 19' ' ' ASP . 2.8 t -160.19 -178.65 7.12 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 -179.086 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.534 ' HA ' HG23 ' B' ' 21' ' ' VAL . 38.1 tt0 -62.7 -54.5 38.33 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -179.341 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -63.11 -34.17 77.02 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 179.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.699 ' HB2' HG22 ' A' ' 16' ' ' THR . 13.7 t70 -61.95 -45.77 92.2 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.949 179.076 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.497 ' HA ' HD21 ' A' ' 20' ' ' LEU . 53.2 mt -69.15 -42.72 75.57 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.523 179.498 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 32.4 tp -55.84 -52.48 63.88 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.349 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 16.1 p -65.37 -11.5 42.86 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.971 179.364 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 48.8 tp -93.6 -26.8 16.94 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.188 -0.46 . . . . 0.0 109.965 179.108 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 80.5 m . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.874 -179.868 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 . . . . . 0 N--CA 1.45 -0.461 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . 0.443 ' HE2' ' HB2' ' B' ' 8' ' ' LYS . 25.3 mtmm -67.91 97.44 0.66 Allowed 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.957 -178.981 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . 0.636 ' HB2' ' SG ' ' A' ' 10' ' ' CYS . 84.1 mt -88.9 53.24 2.63 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.275 0.559 . . . . 0.0 110.752 179.581 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 10' ' ' CYS . . . . . 0.413 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 96.6 m -60.18 138.72 57.86 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.788 -179.931 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 66.95 -133.88 31.73 Favored Glycine 0 N--CA 1.451 -0.327 0 CA-C-N 115.668 -0.696 . . . . 0.0 114.824 178.334 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 17.5 t-160 -52.47 -29.25 23.85 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 -178.077 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 13' ' ' HIS . . . . . 0.57 ' O ' ' HG3' ' B' ' 16' ' ' ARG . 22.7 m170 -58.6 -46.11 87.71 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.471 0.177 . . . . 0.0 111.286 -179.147 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 14' ' ' PHE . . . . . 0.566 ' CZ ' ' HB2' ' A' ' 6' ' ' PRO . 54.0 t80 -63.22 -45.19 92.82 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 178.509 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 40.6 t -54.2 -54.56 20.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.473 -179.608 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . 0.57 ' HG3' ' O ' ' B' ' 13' ' ' HIS . 0.0 OUTLIER -61.75 -42.74 99.36 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.852 -0.339 . . . . 0.0 111.598 -179.481 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . 0.476 ' N ' ' HE ' ' B' ' 16' ' ' ARG . . . -63.68 -52.39 60.88 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 -179.953 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 18' ' ' LEU . . . . . 0.492 HD12 ' SG ' ' B' ' 22' ' ' CYS . 16.2 tp -64.57 -53.84 41.59 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.264 -179.044 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 83.1 t -58.31 -40.31 77.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -178.295 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . 0.993 ' HA ' ' HE ' ' B' ' 20' ' ' ARG . 1.0 OUTLIER -82.29 -46.53 13.53 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 114.183 1.179 . . . . 0.0 114.183 -178.658 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 21' ' ' VAL . . . . . 0.442 HG21 ' HB3' ' A' ' 17' ' ' GLN . 72.8 t -73.83 -45.49 49.53 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 N-CA-C 113.447 0.906 . . . . 0.0 113.447 -177.778 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 22' ' ' CYS . . . . . 0.492 ' SG ' HD12 ' B' ' 18' ' ' LEU . 63.6 m . . . . . 0 C--N 1.328 -0.355 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 -178.4 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.566 ' HB2' ' CZ ' ' B' ' 14' ' ' PHE . 24.0 Cg_exo . . . . . 0 N--CA 1.463 -0.266 0 N-CA-C 112.853 0.29 . . . . 0.0 112.853 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.94 -47.12 83.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.212 0.529 . . . . 0.0 110.527 179.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.402 ' HA ' ' HD2' ' A' ' 8' ' ' ARG . 14.0 tpt85 -66.73 -48.07 70.33 Favored 'General case' 0 CA--C 1.511 -0.532 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.698 179.222 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 10.5 t80 -52.23 -57.07 10.8 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 114.33 -1.305 . . . . 0.0 112.0 -179.518 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.654 ' O ' ' HA2' ' A' ' 14' ' ' GLY . 18.1 t -66.25 -19.83 65.94 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -178.535 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.413 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 14.4 t -84.89 -53.08 5.55 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.641 0.734 . . . . 0.0 110.427 179.453 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 15.0 tp -72.28 -62.52 1.41 Allowed 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 114.89 -1.05 . . . . 0.0 111.923 -179.138 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 14.7 m -79.86 -28.25 40.02 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.339 -178.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.654 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 85.7 152.52 19.28 Favored Glycine 0 N--CA 1.445 -0.714 0 C-N-CA 120.669 -0.777 . . . . 0.0 111.84 -179.267 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 9.1 p -151.57 -163.05 1.66 Allowed 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 179.451 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.652 HG23 ' HB2' ' A' ' 19' ' ' ASP . 13.4 t -153.33 168.52 25.78 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 108.37 -0.974 . . . . 0.0 108.37 179.493 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.442 ' HB3' HG21 ' B' ' 21' ' ' VAL . 0.0 OUTLIER -55.25 -48.27 74.21 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.616 0.246 . . . . 0.0 111.39 -178.858 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 8.7 mp0 -62.78 -38.07 89.15 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.475 179.712 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.652 ' HB2' HG23 ' A' ' 16' ' ' THR . 30.3 t70 -61.5 -44.03 97.8 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.782 179.371 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.401 ' HA ' HD23 ' A' ' 20' ' ' LEU . 67.9 mt -68.1 -39.91 82.72 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.258 178.687 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 49.9 tp -57.93 -43.55 86.35 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.704 179.469 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 36.3 p -69.61 0.77 4.9 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 120.964 0.411 . . . . 0.0 111.865 179.762 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 89.1 mt -117.01 9.92 13.82 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.007 179.241 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 75.4 m . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.331 -179.221 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 22.3 tt0 . . . . . 0 N--CA 1.448 -0.565 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . 0.439 ' HA ' ' O ' ' A' ' 10' ' ' CYS . 55.2 mttm -86.8 95.52 9.87 Favored 'General case' 0 C--N 1.312 -1.065 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 178.447 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . 0.715 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 2.8 mm? -76.65 57.08 1.21 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.81 -0.632 . . . . 0.0 112.249 -178.472 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 10' ' ' CYS . . . . . 0.448 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 93.7 m -74.26 124.91 27.3 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.158 179.313 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 52.25 -115.04 3.77 Favored Glycine 0 CA--C 1.519 0.304 0 CA-C-N 115.897 -0.592 . . . . 0.0 114.326 178.617 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 12' ' ' HIS . . . . . 0.411 ' O ' ' HG3' ' B' ' 16' ' ' ARG . 15.6 t-160 -51.29 -31.69 22.27 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 123.131 0.573 . . . . 0.0 112.396 -178.97 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 13' ' ' HIS . . . . . 0.625 ' HB3' ' HA ' ' B' ' 9' ' ' LEU . 27.0 m170 -62.39 -42.82 99.72 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 120.695 -0.402 . . . . 0.0 110.589 -179.67 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 14' ' ' PHE . . . . . . . . . . . . . 19.3 t80 -60.49 -38.85 85.61 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 178.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 65.1 t -60.97 -57.5 11.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.386 -0.825 . . . . 0.0 111.4 179.497 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . 0.491 ' HD3' ' N ' ' B' ' 17' ' ' ALA . 0.0 OUTLIER -63.85 -28.54 69.92 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 120.964 -0.295 . . . . 0.0 111.322 179.93 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . 0.491 ' N ' ' HD3' ' B' ' 16' ' ' ARG . . . -63.75 -53.08 56.65 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.29 179.188 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 100.0 mt -60.77 -46.79 89.09 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.732 179.285 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 19' ' ' VAL . . . . . 0.403 ' O ' HG11 ' B' ' 19' ' ' VAL . 71.8 t -58.43 -38.51 70.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.621 -0.718 . . . . 0.0 112.825 -179.35 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . 0.599 ' NE ' ' HA ' ' B' ' 20' ' ' ARG . 0.0 OUTLIER -93.27 -43.75 8.65 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 -178.171 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 94.7 t -70.7 -40.82 77.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -178.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 52.5 m . . . . . 0 C--N 1.323 -0.558 0 C-N-CA 120.907 -0.317 . . . . 0.0 111.538 -179.126 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_exo . . . . . 0 CA--C 1.527 0.136 0 N-CA-C 113.487 0.533 . . . . 0.0 113.487 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -58.73 -44.86 90.57 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.402 0.62 . . . . 0.0 110.408 179.781 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.442 ' HD3' ' HA ' ' A' ' 8' ' ' ARG . 12.0 mmt85 -67.47 -45.48 75.81 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.698 178.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 26.9 t80 -58.44 -48.73 79.76 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.088 179.784 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.715 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 61.9 m -65.9 -23.42 66.63 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.968 -179.811 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.448 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 37.6 t -88.2 -59.58 2.2 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.433 0.635 . . . . 0.0 110.475 179.531 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 13.0 tp -55.3 -54.2 46.5 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.848 -1.069 . . . . 0.0 111.083 -179.629 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 14.3 m -96.48 -59.52 1.81 Allowed 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.977 -179.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.699 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 121.48 156.14 9.67 Favored Glycine 0 N--CA 1.452 -0.29 0 N-CA-C 110.82 -0.912 . . . . 0.0 110.82 -179.692 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.693 ' SG ' HD21 ' B' ' 9' ' ' LEU . 31.3 p -150.56 155.75 40.05 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 117.546 0.673 . . . . 0.0 111.574 -178.985 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 72.8 p -91.01 -173.28 3.61 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.017 -179.495 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 -69.14 -40.13 78.43 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 177.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 62.6 mt-30 -65.79 -39.55 91.07 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.535 178.674 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.575 ' CB ' ' HB2' ' A' ' 15' ' ' CYS . 38.5 m-20 -59.51 -47.19 86.48 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 178.212 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.422 HD21 ' SG ' ' A' ' 15' ' ' CYS . 30.6 mt -63.8 -45.99 87.19 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.804 179.026 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.45 HD23 ' HA ' ' A' ' 21' ' ' LEU . 2.3 tm? -55.04 -45.14 75.19 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.237 -179.869 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 23.9 m -60.93 -25.04 66.49 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.557 179.658 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.447 ' HG ' ' O ' ' A' ' 19' ' ' ASP . 85.2 mt -79.48 -24.64 42.22 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.593 179.301 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 56.5 m . . . . . 0 C--N 1.325 -0.481 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.126 -179.623 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 1' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo . . . . . 0 N--CA 1.478 0.612 0 N-CA-C 110.435 -0.64 . . . . 0.0 110.435 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 2' ' ' THR . . . . . 0.651 ' O ' ' HG2' ' B' ' 4' ' ' GLU . 0.2 OUTLIER -152.55 176.12 2.57 Favored Pre-proline 0 C--N 1.32 -0.702 0 CA-C-N 115.171 -0.922 . . . . 0.0 108.958 -178.761 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . 0.545 ' HD2' ' HB ' ' B' ' 2' ' ' THR . 57.0 Cg_endo -69.91 53.34 1.13 Allowed 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 122.645 2.23 . . . . 0.0 111.69 179.214 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . 0.74 ' HG3' HG21 ' A' ' 16' ' ' THR . 5.9 pt-20 -79.22 142.27 36.39 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 114.175 -1.375 . . . . 0.0 111.817 -178.824 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 5' ' ' MET . . . . . . . . . . . . . 59.5 ttp -84.8 129.45 34.82 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.683 179.234 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 6' ' ' ARG . . . . . 0.496 ' HA ' HG23 ' A' ' 16' ' ' THR . 52.5 mtt180 -64.15 122.6 16.99 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.186 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 -88.46 133.07 34.23 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 179.384 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 65.5 mttm -72.97 97.15 2.24 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.643 0.735 . . . . 0.0 109.324 179.261 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . 0.748 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 61.1 mt -79.1 56.22 1.97 Allowed 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 114.85 -1.068 . . . . 0.0 113.295 -177.407 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 10' ' ' CYS . . . . . 0.501 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 88.8 m -74.06 125.09 27.54 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.266 178.42 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 61.05 -126.47 40.65 Favored Glycine 0 N--CA 1.452 -0.296 0 CA-C-N 116.075 -0.511 . . . . 0.0 113.697 179.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 12' ' ' HIS . . . . . 0.578 ' O ' ' HG2' ' B' ' 16' ' ' ARG . 16.0 t-160 -55.01 -25.73 32.22 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -179.117 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 13' ' ' HIS . . . . . 0.568 ' HB3' ' HA ' ' B' ' 9' ' ' LEU . 51.6 m170 -56.12 -42.16 76.43 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.908 -0.317 . . . . 0.0 111.03 -179.255 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 14' ' ' PHE . . . . . 0.583 ' HA ' ' HB3' ' B' ' 9' ' ' LEU . 36.0 t80 -60.18 -45.83 91.79 Favored 'General case' 0 C--N 1.328 -0.34 0 O-C-N 123.43 0.456 . . . . 0.0 110.235 178.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . 0.448 ' O ' HG22 ' B' ' 19' ' ' VAL . 93.1 t -59.12 -56.89 14.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.496 -0.774 . . . . 0.0 112.228 -179.777 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . 0.578 ' HG2' ' O ' ' B' ' 12' ' ' HIS . 1.9 ptm180 -60.0 -38.56 82.97 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 120.736 0.303 . . . . 0.0 111.603 -179.727 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . 0.771 ' HA ' ' HE ' ' B' ' 20' ' ' ARG . . . -66.43 -41.57 88.99 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.823 0.344 . . . . 0.0 110.381 179.31 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 18' ' ' LEU . . . . . 0.877 ' HG ' ' HE1' ' B' ' 27' ' ' TRP . 53.0 tp -58.02 -45.44 86.89 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.727 179.056 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 19' ' ' VAL . . . . . 0.448 HG22 ' O ' ' B' ' 15' ' ' VAL . 40.6 t -62.39 -44.77 99.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.609 178.885 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . 0.771 ' HE ' ' HA ' ' B' ' 17' ' ' ALA . 81.5 mtm180 -57.0 -50.18 73.5 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.67 -0.696 . . . . 0.0 112.801 -179.309 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 21' ' ' VAL . . . . . 0.847 HG23 HD12 ' A' ' 20' ' ' LEU . 74.2 t -76.84 -53.19 15.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 N-CA-C 113.888 1.07 . . . . 0.0 113.888 -177.131 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 22' ' ' CYS . . . . . 0.6 ' SG ' HD12 ' B' ' 18' ' ' LEU . 81.9 m -65.61 -43.53 89.36 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 111.94 0.348 . . . . 0.0 111.94 -178.103 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 144.97 125.4 1.8 Allowed Glycine 0 N--CA 1.446 -0.668 0 C-N-CA 120.177 -1.011 . . . . 0.0 112.755 179.755 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -63.86 -58.92 9.46 Favored Glycine 0 CA--C 1.522 0.492 0 C-N-CA 121.128 -0.558 . . . . 0.0 112.668 179.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_exo -72.04 57.57 2.68 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 123.052 2.501 . . . . 0.0 112.799 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -166.26 -34.06 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.339 179.582 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 27' ' ' TRP . . . . . 0.877 ' HE1' ' HG ' ' B' ' 18' ' ' LEU . 0.1 OUTLIER -75.41 58.67 1.01 Allowed 'General case' 0 CA--C 1.507 -0.688 0 CA-C-O 122.837 1.303 . . . . 0.0 111.032 -179.701 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 23.0 t -93.66 23.99 4.36 Favored 'General case' 0 C--N 1.3 -1.555 0 CA-C-N 112.622 -2.081 . . . . 0.0 110.636 -179.371 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 29' ' ' THR . . . . . 0.492 HG22 ' N ' ' B' ' 30' ' ' GLU . 11.4 t -178.55 -33.0 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.08 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 30' ' ' GLU . . . . . 0.492 ' N ' HG22 ' B' ' 29' ' ' THR . 3.8 mp0 -86.46 32.04 0.65 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.71 -178.852 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 31' ' ' ALA . . . . . 0.41 ' HB2' ' CD1' ' B' ' 27' ' ' TRP . . . . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.578 -0.725 . . . . 0.0 109.863 -179.623 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.138 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -69.36 148.6 49.45 Favored 'General case' 0 C--N 1.328 -0.343 0 O-C-N 123.171 0.294 . . . . 0.0 110.607 179.423 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -168.24 122.31 0.92 Allowed 'General case' 0 N--CA 1.45 -0.425 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.6 m -75.29 54.72 0.73 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.859 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -173.73 116.11 0.35 Allowed Pre-proline 0 C--N 1.325 -0.467 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 -179.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -57.08 -48.36 18.52 Favored 'Trans proline' 0 CA--C 1.528 0.181 0 C-N-CA 123.132 2.555 . . . . 0.0 113.473 -178.509 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -59.3 -42.78 92.13 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.309 0.576 . . . . 0.0 110.456 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 5.7 tpt85 -67.89 -45.8 73.43 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.973 179.273 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 32.0 t80 -57.39 -47.46 81.62 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 114.78 -1.1 . . . . 0.0 110.78 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.748 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 89.3 m -65.45 -30.8 71.63 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.139 179.813 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.501 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 26.7 t -75.87 -57.18 4.03 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.583 0.706 . . . . 0.0 110.706 179.63 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.423 HD22 ' HA ' ' A' ' 12' ' ' LEU . 92.8 mt -59.91 -55.93 28.01 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 114.932 -1.031 . . . . 0.0 112.1 -179.3 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.2 m -92.02 -63.65 1.21 Allowed 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.194 -179.373 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.579 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 133.85 158.07 8.48 Favored Glycine 0 N--CA 1.451 -0.345 0 N-CA-C 110.686 -0.966 . . . . 0.0 110.686 -179.521 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 93.2 m -140.33 145.16 36.84 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 117.43 0.615 . . . . 0.0 111.79 -179.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.74 HG21 ' HG3' ' B' ' 4' ' ' GLU . 63.5 p -100.89 -168.64 1.59 Allowed 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.544 179.702 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.589 ' HG3' HG22 ' B' ' 21' ' ' VAL . 49.8 tt0 -69.78 -41.4 75.18 Favored 'General case' 0 CA--C 1.512 -0.487 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 177.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 66.7 tp60 -62.96 -45.92 90.15 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.801 179.197 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 63.1 m-20 -57.04 -46.72 82.2 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.326 -0.852 . . . . 0.0 109.9 179.177 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.847 HD12 HG23 ' B' ' 21' ' ' VAL . 54.7 mt -69.11 -39.81 78.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.925 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 30.3 tp -58.42 -39.45 79.8 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.99 0.424 . . . . 0.0 110.539 -179.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.6 m -63.99 -21.38 66.47 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.062 179.408 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -97.69 -4.43 37.31 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.685 179.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.42 ' HA ' ' HD3' ' A' ' 25' ' ' PRO . 93.1 m -72.51 132.77 83.38 Favored Pre-proline 0 C--N 1.33 -0.251 0 CA-C-O 121.075 0.465 . . . . 0.0 110.831 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.42 ' HD3' ' HA ' ' A' ' 24' ' ' CYS . 73.0 Cg_endo -93.72 -160.72 0.08 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.136 0 C-N-CA 123.474 2.783 . . . . 0.0 112.28 179.777 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 3.2 p90 . . . . . 0 C--O 1.247 0.95 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.995 178.844 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 1' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo . . . . . 0 N--CA 1.483 0.866 0 N-CA-C 110.699 -0.539 . . . . 0.0 110.699 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 2' ' ' THR . . . . . 0.487 HG21 ' HD2' ' B' ' 3' ' ' PRO . 11.1 m -90.4 134.82 30.41 Favored Pre-proline 0 C--N 1.318 -0.764 0 CA-C-N 115.3 -0.864 . . . . 0.0 110.144 179.832 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . 0.487 ' HD2' HG21 ' B' ' 2' ' ' THR . 32.8 Cg_exo -58.64 115.2 2.38 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.646 2.231 . . . . 0.0 111.922 -179.633 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . 0.749 ' HG2' ' H ' ' B' ' 5' ' ' MET . 35.1 tt0 -176.28 -169.04 0.28 Allowed 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 -179.281 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 5' ' ' MET . . . . . 0.749 ' H ' ' HG2' ' B' ' 4' ' ' GLU . 26.4 ttt -82.98 112.92 20.19 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 178.661 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 6' ' ' ARG . . . . . 1.041 ' HG2' HG23 ' A' ' 16' ' ' THR . 40.2 mtp85 -86.81 111.16 20.48 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.951 -0.388 . . . . 0.0 109.951 179.863 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -88.32 129.73 35.31 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.287 -0.635 . . . . 0.0 109.287 179.326 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . 0.444 ' HA ' ' O ' ' A' ' 10' ' ' CYS . 65.6 mttm -73.98 94.82 2.4 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 178.818 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . 0.708 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 28.7 mt -76.18 55.33 0.94 Allowed 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 114.794 -1.093 . . . . 0.0 113.93 -176.643 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 10' ' ' CYS . . . . . 0.45 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 75.1 m -74.87 117.69 17.0 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 177.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 61.18 -121.64 27.02 Favored Glycine 0 CA--C 1.521 0.411 0 C-N-CA 121.09 -0.576 . . . . 0.0 113.695 179.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 14.8 t-160 -53.47 -28.67 31.79 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -178.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 13' ' ' HIS . . . . . 0.592 ' CB ' ' HA ' ' B' ' 9' ' ' LEU . 49.6 m170 -58.37 -40.71 83.04 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.766 -0.373 . . . . 0.0 110.707 -179.288 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 14' ' ' PHE . . . . . 0.629 ' HA ' ' HB3' ' B' ' 9' ' ' LEU . 21.4 t80 -58.55 -45.79 88.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.347 0.594 . . . . 0.0 109.8 178.897 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . 0.536 ' O ' HG23 ' B' ' 19' ' ' VAL . 94.6 t -63.04 -53.76 42.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.892 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . 0.601 ' O ' ' HG3' ' B' ' 20' ' ' ARG . 0.0 OUTLIER -61.27 -40.35 93.76 Favored 'General case' 0 N--CA 1.462 0.154 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 -179.038 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.41 -41.05 89.85 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 121.027 -0.269 . . . . 0.0 110.436 179.41 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 10.7 mt -56.45 -49.81 73.53 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.342 178.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 19' ' ' VAL . . . . . 0.536 HG23 ' O ' ' B' ' 15' ' ' VAL . 11.5 t -64.95 -38.07 81.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.748 179.691 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . 0.601 ' HG3' ' O ' ' B' ' 16' ' ' ARG . 33.4 mtm105 -62.07 -51.99 65.73 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 21' ' ' VAL . . . . . 0.472 HG21 ' HA ' ' A' ' 17' ' ' GLN . 49.1 t -73.46 -53.95 16.72 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 -177.295 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 60.3 m -63.63 -52.34 61.26 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 121.182 -0.207 . . . . 0.0 110.918 -178.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 49.46 -132.55 25.95 Favored Glycine 0 C--N 1.333 0.411 0 CA-C-N 116.137 -0.483 . . . . 0.0 113.714 178.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 64.87 -150.91 51.47 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 121.618 -0.325 . . . . 0.0 112.716 179.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -76.76 -31.8 3.86 Favored 'Trans proline' 0 N--CA 1.464 -0.241 0 C-N-CA 122.652 2.234 . . . . 0.0 111.886 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . 0.453 ' HB2' ' C ' ' B' ' 31' ' ' ALA . 7.5 ptm180 -171.93 178.51 2.97 Favored 'General case' 0 N--CA 1.443 -0.807 0 N-CA-C 107.842 -1.169 . . . . 0.0 107.842 179.778 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 27' ' ' TRP . . . . . 0.622 ' HD1' ' HD2' ' A' ' 25' ' ' PRO . 0.0 OUTLIER -154.28 -18.93 0.13 Allowed 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 -178.142 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 84.2 p -157.58 -146.2 0.16 Allowed 'General case' 0 C--N 1.318 -0.786 0 C-N-CA 119.304 -0.958 . . . . 0.0 113.308 -177.398 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 29' ' ' THR . . . . . 0.408 ' H ' HG22 ' B' ' 29' ' ' THR . 0.1 OUTLIER -83.42 -33.66 25.66 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 114.879 -1.055 . . . . 0.0 109.501 -179.878 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 6.6 mp0 -67.84 -29.54 68.71 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 114.623 -1.172 . . . . 0.0 109.519 179.352 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 31' ' ' ALA . . . . . 0.453 ' C ' ' HB2' ' B' ' 26' ' ' ARG . . . . . . . . 0 C--O 1.25 1.082 0 CA-C-N 114.694 -1.139 . . . . 0.0 108.917 179.486 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.057 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -159.53 135.17 8.5 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 123.365 0.416 . . . . 0.0 110.268 -179.723 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -161.17 55.21 0.29 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.243 0.545 . . . . 0.0 110.13 -179.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.5 m -73.83 60.64 0.73 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.307 -0.86 . . . . 0.0 111.185 -179.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -170.09 116.05 0.5 Allowed Pre-proline 0 C--N 1.323 -0.55 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 -179.68 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -57.12 -47.86 20.76 Favored 'Trans proline' 0 C--O 1.226 -0.116 0 C-N-CA 123.205 2.603 . . . . 0.0 113.262 -178.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -58.07 -40.98 82.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.169 0.509 . . . . 0.0 110.116 179.491 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.428 ' HG2' HD13 ' A' ' 12' ' ' LEU . 43.6 ttt85 -64.61 -54.69 27.93 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.134 178.911 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 26.7 t80 -56.04 -48.44 75.99 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 114.162 -1.381 . . . . 0.0 111.284 -179.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.708 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 91.0 m -64.6 -30.03 71.05 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.551 -179.834 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.45 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 35.5 t -77.83 -57.87 3.57 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.336 0.588 . . . . 0.0 110.641 179.708 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.428 HD13 ' HG2' ' A' ' 8' ' ' ARG . 88.6 mt -57.13 -58.69 7.09 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 114.94 -1.027 . . . . 0.0 111.976 -179.117 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 34.6 t -92.56 -63.21 1.26 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 120.927 0.394 . . . . 0.0 110.672 -179.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.638 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 132.01 155.73 8.1 Favored Glycine 0 N--CA 1.446 -0.691 0 N-CA-C 110.56 -1.016 . . . . 0.0 110.56 -179.454 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 90.8 m -131.85 135.48 46.74 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 117.191 0.495 . . . . 0.0 111.097 -179.186 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 1.041 HG23 ' HG2' ' B' ' 6' ' ' ARG . 31.4 p -80.6 170.07 16.81 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.054 179.372 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.472 ' HA ' HG21 ' B' ' 21' ' ' VAL . 23.2 mt-30 -66.62 -40.49 88.83 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 178.243 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.457 ' HG2' ' OE1' ' B' ' 4' ' ' GLU . 77.6 mm-40 -63.16 -43.53 98.05 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 178.593 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -58.82 -43.5 90.63 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.947 178.826 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.61 HD12 HD12 ' B' ' 9' ' ' LEU . 96.9 mt -69.41 -41.75 75.98 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.275 179.464 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 40.8 tp -57.55 -44.04 84.88 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.216 0.531 . . . . 0.0 110.55 -179.727 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.1 m -64.49 -16.63 62.83 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.219 179.615 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 23.8 tp -113.61 16.61 18.64 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.321 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.46 ' HA ' ' HD3' ' A' ' 25' ' ' PRO . 43.5 m -76.34 129.02 81.21 Favored Pre-proline 0 C--N 1.332 -0.191 0 C-N-CA 120.208 -0.597 . . . . 0.0 111.015 179.375 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.622 ' HD2' ' HD1' ' B' ' 27' ' ' TRP . 55.6 Cg_endo -90.29 -157.43 0.06 OUTLIER 'Trans proline' 0 N--CA 1.451 -1.029 0 C-N-CA 123.798 2.999 . . . . 0.0 111.402 178.806 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 5.1 t80 . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.167 -0.92 . . . . 0.0 109.672 179.09 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 1' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo . . . . . 0 N--CA 1.484 0.928 0 N-CA-C 110.394 -0.656 . . . . 0.0 110.394 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -149.69 153.68 36.79 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.483 -179.166 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -71.71 55.13 2.12 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.849 2.366 . . . . 0.0 113.665 -179.004 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -91.96 138.27 31.68 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.9 179.148 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 5' ' ' MET . . . . . . . . . . . . . 70.1 mtm -82.37 -169.51 2.47 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.055 0.455 . . . . 0.0 110.957 -179.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 6' ' ' ARG . . . . . 0.584 ' HA ' ' HB ' ' A' ' 16' ' ' THR . 0.2 OUTLIER -70.11 135.17 48.93 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.108 179.327 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . 0.412 ' HG2' ' N ' ' B' ' 8' ' ' LYS . 26.3 tt0 -148.99 150.92 33.65 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.037 0.446 . . . . 0.0 111.028 -178.699 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . 0.412 ' N ' ' HG2' ' B' ' 7' ' ' GLU . 47.3 mttm -79.48 98.22 6.73 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 177.572 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . 0.905 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 38.6 mt -78.89 57.45 2.14 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 112.805 0.669 . . . . 0.0 112.805 -177.889 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 10' ' ' CYS . . . . . 0.44 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 80.1 m -72.66 124.22 24.85 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.03 178.638 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 61.28 -124.3 34.66 Favored Glycine 0 CA--C 1.52 0.382 0 C-N-CA 121.334 -0.46 . . . . 0.0 114.077 179.272 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 23.5 t-160 -51.99 -31.2 28.33 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 123.233 0.613 . . . . 0.0 112.634 -178.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 13' ' ' HIS . . . . . 0.577 ' HB3' ' HA ' ' B' ' 9' ' ' LEU . 43.2 m170 -57.09 -42.64 81.09 Favored 'General case' 0 C--N 1.32 -0.712 0 C-N-CA 120.714 -0.395 . . . . 0.0 110.793 -179.339 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 14' ' ' PHE . . . . . 0.551 ' CA ' ' HB3' ' B' ' 9' ' ' LEU . 54.7 t80 -61.39 -46.26 90.9 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.183 0.516 . . . . 0.0 109.866 178.61 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . 0.485 ' O ' HG23 ' B' ' 19' ' ' VAL . 40.5 t -59.82 -52.35 62.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.276 -0.874 . . . . 0.0 111.674 -179.754 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . 0.677 ' HG3' ' N ' ' B' ' 17' ' ' ALA . 0.1 OUTLIER -58.65 -45.29 89.65 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.084 -178.936 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . 0.677 ' N ' ' HG3' ' B' ' 16' ' ' ARG . . . -68.41 -42.94 78.25 Favored 'General case' 0 C--O 1.218 -0.589 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.445 -179.453 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 50.2 tp -55.09 -51.1 67.45 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.731 0.301 . . . . 0.0 110.455 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 19' ' ' VAL . . . . . 0.485 HG23 ' O ' ' B' ' 15' ' ' VAL . 59.2 t -60.75 -44.82 98.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.048 179.337 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 65.7 mtp85 -66.33 -47.93 71.92 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 -179.344 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 21' ' ' VAL . . . . . 0.567 HG23 ' O ' ' B' ' 17' ' ' ALA . 95.5 t -62.01 -61.13 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 -178.882 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 68.2 m -90.4 41.16 1.04 Allowed 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.153 0.501 . . . . 0.0 111.424 -178.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 169.62 -122.22 0.98 Allowed Glycine 0 N--CA 1.443 -0.872 0 C-N-CA 120.889 -0.672 . . . . 0.0 112.039 179.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . 0.402 ' C ' ' H ' ' B' ' 26' ' ' ARG . . . 178.04 -117.41 0.58 Allowed Glycine 0 N--CA 1.446 -0.645 0 N-CA-C 110.965 -0.854 . . . . 0.0 110.965 179.813 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -79.5 17.81 1.19 Allowed 'Trans proline' 0 CA--C 1.528 0.188 0 C-N-CA 122.651 2.234 . . . . 0.0 111.796 178.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' B' ' 26' ' ' ARG . 8.8 mmm180 -155.49 140.43 17.28 Favored 'General case' 0 CA--C 1.499 -0.983 0 CA-C-N 115.156 -0.929 . . . . 0.0 109.992 179.829 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 27' ' ' TRP . . . . . 0.681 ' HA ' ' HE3' ' B' ' 27' ' ' TRP . 0.0 OUTLIER -98.03 49.92 1.02 Allowed 'General case' 0 C--N 1.305 -1.329 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 177.596 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 1.9 p -63.56 62.97 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 114.929 -1.032 . . . . 0.0 113.284 -178.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 48.5 m -169.84 -37.61 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.71 0 C-N-CA 124.034 0.934 . . . . 0.0 108.585 179.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 30' ' ' GLU . . . . . 0.492 ' HB3' ' NE1' ' B' ' 27' ' ' TRP . 35.9 tt0 -127.77 -31.09 2.46 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 114.975 -1.011 . . . . 0.0 111.315 -178.534 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.182 0 CA-C-O 118.727 -0.654 . . . . 0.0 111.268 -179.064 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.095 0 N-CA-C 110.381 -0.229 . . . . 0.0 110.381 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -72.13 143.37 49.0 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.318 179.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.591 ' HB1' ' HD3' ' A' ' 8' ' ' ARG . . . -168.62 122.75 0.88 Allowed 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 120.824 0.345 . . . . 0.0 110.216 -179.812 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.7 m -74.23 60.66 0.83 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.649 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -169.14 117.14 0.57 Allowed Pre-proline 0 C--N 1.324 -0.54 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 -179.174 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_exo -55.3 -49.14 17.25 Favored 'Trans proline' 0 CA--C 1.528 0.203 0 C-N-CA 123.37 2.713 . . . . 0.0 113.666 -178.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -59.27 -42.77 91.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.401 0.619 . . . . 0.0 110.303 179.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.591 ' HD3' ' HB1' ' A' ' 3' ' ' ALA . 25.0 ttt85 -65.74 -49.08 69.7 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.188 -0.915 . . . . 0.0 109.944 179.178 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 13.6 t80 -55.85 -48.17 75.99 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.833 -1.076 . . . . 0.0 110.889 179.534 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.905 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 69.0 m -63.69 -27.73 69.41 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.789 -0.641 . . . . 0.0 112.083 -179.748 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.44 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 52.7 t -86.56 -59.71 2.2 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.311 0.577 . . . . 0.0 110.792 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.461 ' HA ' HD21 ' A' ' 12' ' ' LEU . 53.2 mt -54.66 -51.6 64.96 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.158 -0.928 . . . . 0.0 111.785 -179.64 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 9.7 m -99.68 -63.07 1.16 Allowed 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 120.989 0.423 . . . . 0.0 110.546 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.638 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 127.67 149.62 7.17 Favored Glycine 0 N--CA 1.448 -0.503 0 N-CA-C 110.216 -1.154 . . . . 0.0 110.216 -179.403 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.668 ' HB2' ' CB ' ' A' ' 19' ' ' ASP . 28.3 p -144.07 -157.93 0.83 Allowed 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 117.485 0.642 . . . . 0.0 110.292 -179.01 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.589 ' H ' ' HB2' ' A' ' 19' ' ' ASP . 14.3 t -171.32 -162.77 0.25 Allowed 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 110.321 -0.251 . . . . 0.0 110.321 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.499 ' CD ' HG21 ' B' ' 21' ' ' VAL . 53.2 mm-40 -57.55 -50.29 73.57 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.674 -179.25 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 11.4 mm100 -62.02 -43.65 98.39 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.853 0.359 . . . . 0.0 110.852 -179.523 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.668 ' CB ' ' HB2' ' A' ' 15' ' ' CYS . 2.9 m-20 -58.16 -41.6 84.16 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.459 179.443 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.442 HD12 ' HB3' ' B' ' 17' ' ' ALA . 69.0 mt -78.78 -40.36 33.36 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 -179.376 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 21.2 tp -56.59 -44.29 80.94 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.561 -179.456 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 19.1 m -60.34 -22.93 63.81 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.597 179.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 94.2 mt -80.6 -26.79 37.63 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.157 179.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.43 ' HA ' ' HD3' ' A' ' 25' ' ' PRO . 97.9 m -86.96 139.5 32.72 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-O 121.082 0.468 . . . . 0.0 111.159 -179.62 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.43 ' HD3' ' HA ' ' A' ' 24' ' ' CYS . 40.0 Cg_endo -85.68 137.54 5.76 Favored 'Trans proline' 0 N--CA 1.45 -1.056 0 C-N-CA 123.257 2.638 . . . . 0.0 112.604 -179.584 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.247 0.922 0 CA-C-N 114.979 -1.01 . . . . 0.0 109.255 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 1' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo . . . . . 0 N--CA 1.481 0.757 0 N-CA-C 110.078 -0.778 . . . . 0.0 110.078 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -72.96 132.65 82.61 Favored Pre-proline 0 C--N 1.323 -0.582 0 O-C-N 123.389 0.431 . . . . 0.0 111.104 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -71.1 137.29 31.28 Favored 'Trans proline' 0 C--O 1.233 0.245 0 C-N-CA 122.585 2.19 . . . . 0.0 112.086 -179.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . 0.661 ' OE1' ' HB ' ' A' ' 16' ' ' THR . 1.4 mm-40 -71.88 143.66 49.29 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.201 0.524 . . . . 0.0 111.385 179.764 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 5' ' ' MET . . . . . . . . . . . . . 13.0 tpt -164.49 128.49 2.55 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 114.974 -1.012 . . . . 0.0 109.858 179.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 6' ' ' ARG . . . . . 0.639 ' NH1' ' HA ' ' A' ' 15' ' ' CYS . 54.0 ttm-85 -89.51 101.83 14.51 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 179.72 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 78.5 tt0 -98.71 144.65 27.73 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-O 121.304 0.573 . . . . 0.0 110.75 -179.123 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 21.8 mmmt -78.48 91.95 4.59 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 177.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . 0.994 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 16.5 mt -75.56 57.74 0.98 Allowed 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 113.722 1.008 . . . . 0.0 113.722 -176.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 10' ' ' CYS . . . . . 0.421 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 87.8 m -77.18 123.11 25.96 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 178.028 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 64.11 -125.26 31.82 Favored Glycine 0 CA--C 1.521 0.451 0 C-N-CA 121.204 -0.522 . . . . 0.0 113.865 179.629 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 22.7 t-160 -52.24 -32.03 35.03 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 112.779 0.659 . . . . 0.0 112.779 -178.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 13' ' ' HIS . . . . . 0.586 ' HB3' ' HA ' ' B' ' 9' ' ' LEU . 41.0 m170 -56.41 -43.06 78.98 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 120.766 -0.374 . . . . 0.0 110.996 -179.312 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 14' ' ' PHE . . . . . 0.582 ' HA ' HD13 ' B' ' 9' ' ' LEU . 35.4 t80 -61.21 -45.73 93.38 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.176 0.513 . . . . 0.0 109.987 178.867 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 43.4 t -59.87 -51.52 71.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 115.292 -0.867 . . . . 0.0 111.866 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . 0.578 ' HG3' ' N ' ' B' ' 17' ' ' ALA . 10.7 ptt180 -62.22 -45.19 94.46 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.303 0.483 . . . . 0.0 112.303 -178.361 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . 0.578 ' N ' ' HG3' ' B' ' 16' ' ' ARG . . . -67.95 -48.27 66.34 Favored 'General case' 0 C--O 1.223 -0.324 0 N-CA-C 111.749 0.277 . . . . 0.0 111.749 -178.838 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 18' ' ' LEU . . . . . 0.546 HD11 ' SG ' ' A' ' 24' ' ' CYS . 39.0 tp -57.01 -50.83 71.53 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.078 0.466 . . . . 0.0 110.898 -179.939 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 19' ' ' VAL . . . . . 0.556 ' HA ' ' CZ2' ' B' ' 27' ' ' TRP . 46.5 t -60.56 -48.29 89.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.698 -0.683 . . . . 0.0 112.635 -179.565 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . 0.489 ' HA ' ' CZ ' ' B' ' 20' ' ' ARG . 0.1 OUTLIER -75.0 -39.3 61.31 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 113.956 1.095 . . . . 0.0 113.956 -178.145 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 70.0 t -71.12 -46.04 68.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -178.436 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 91.9 m -64.45 -67.26 0.45 Allowed 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.332 -0.547 . . . . 0.0 111.519 -179.041 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.62 -52.6 0.49 Allowed Glycine 0 CA--C 1.528 0.881 0 N-CA-C 114.564 0.586 . . . . 0.0 114.564 178.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -54.45 -61.15 7.55 Favored Glycine 0 C--N 1.333 0.369 0 CA-C-O 119.961 -0.355 . . . . 0.0 113.251 -179.304 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 25' ' ' PRO . . . . . 0.632 ' HG3' ' HB3' ' A' ' 24' ' ' CYS . 37.2 Cg_endo -66.53 157.76 59.04 Favored 'Trans proline' 0 N--CA 1.457 -0.654 0 C-N-CA 122.049 1.833 . . . . 0.0 110.853 178.907 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . 0.838 ' HB3' ' HA ' ' B' ' 31' ' ' ALA . 22.5 mmm180 -122.62 128.18 50.32 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 -179.934 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 27' ' ' TRP . . . . . 0.556 ' CZ2' ' HA ' ' B' ' 19' ' ' VAL . 13.2 p90 -158.62 -45.35 0.06 Allowed 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -178.183 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 9.8 t -105.92 -138.76 0.37 Allowed 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.881 -178.543 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 5.0 t -56.47 -31.1 63.69 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.531 -0.915 . . . . 0.0 108.531 178.128 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 30' ' ' GLU . . . . . 0.544 ' O ' ' HA ' ' B' ' 26' ' ' ARG . 30.2 mm-40 -84.28 70.63 10.62 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 114.708 -1.133 . . . . 0.0 108.432 176.719 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 31' ' ' ALA . . . . . 0.838 ' HA ' ' HB3' ' B' ' 26' ' ' ARG . . . . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.104 -0.95 . . . . 0.0 109.87 -179.422 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.078 0 N-CA-C 110.163 -0.31 . . . . 0.0 110.163 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -71.79 130.84 42.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.445 0.164 . . . . 0.0 110.582 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -173.62 129.5 0.42 Allowed 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 116.231 -0.44 . . . . 0.0 109.874 -179.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 10.2 t -62.64 -23.43 67.08 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.567 179.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -158.7 105.63 1.62 Allowed Pre-proline 0 C--N 1.323 -0.554 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 178.774 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_exo -58.72 -44.19 38.44 Favored 'Trans proline' 0 C--N 1.334 -0.22 0 C-N-CA 123.67 2.913 . . . . 0.0 113.693 -178.256 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.45 -45.22 85.0 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.225 0.536 . . . . 0.0 110.733 -179.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.42 ' HD2' ' HA ' ' A' ' 8' ' ' ARG . 10.3 tpt85 -70.01 -48.38 58.3 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.333 179.541 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 19.7 t80 -54.86 -52.53 62.49 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.945 -1.025 . . . . 0.0 111.52 -179.481 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.994 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 33.5 m -63.47 -32.47 73.93 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.049 -0.523 . . . . 0.0 112.198 -179.497 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.421 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 37.4 t -77.14 -57.06 4.05 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.453 0.644 . . . . 0.0 111.015 179.867 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.435 ' HA ' HD12 ' A' ' 12' ' ' LEU . 14.0 tp -62.48 -60.9 2.89 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 114.938 -1.028 . . . . 0.0 112.139 -178.905 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 9.2 m -86.02 -50.52 6.99 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.851 -178.495 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.599 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 111.16 155.41 13.63 Favored Glycine 0 N--CA 1.451 -0.35 0 N-CA-C 110.036 -1.226 . . . . 0.0 110.036 -178.543 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.68 ' HB2' ' HB3' ' A' ' 19' ' ' ASP . 18.3 p -146.0 153.92 41.31 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 118.255 1.027 . . . . 0.0 112.859 -178.806 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.661 ' HB ' ' OE1' ' B' ' 4' ' ' GLU . 59.7 p -95.97 -179.46 4.7 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.693 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.609 ' HG2' ' OE1' ' B' ' 4' ' ' GLU . 19.8 pt20 -61.59 -44.91 96.14 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 120.679 0.276 . . . . 0.0 110.983 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 55.6 mt-30 -63.06 -36.87 85.01 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.475 0.655 . . . . 0.0 109.697 179.072 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.68 ' HB3' ' HB2' ' A' ' 15' ' ' CYS . 5.5 t0 -61.6 -42.48 98.93 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.809 -1.087 . . . . 0.0 109.481 179.416 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.678 HD23 HD12 ' B' ' 9' ' ' LEU . 1.6 mm? -67.67 -46.26 72.88 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 121.055 0.455 . . . . 0.0 110.513 177.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 26.3 tp -55.39 -47.4 75.91 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.406 -178.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.8 p -65.01 -9.95 25.76 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 -179.755 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.517 ' HG ' ' O ' ' A' ' 19' ' ' ASP . 95.7 mt -85.32 -24.76 27.52 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.79 0.329 . . . . 0.0 110.459 179.164 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.632 ' HB3' ' HG3' ' B' ' 25' ' ' PRO . 51.4 m -85.59 139.31 35.63 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-O 120.874 0.369 . . . . 0.0 111.475 -179.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.453 ' HD3' ' HA ' ' A' ' 24' ' ' CYS . 10.6 Cg_endo -84.96 132.21 4.58 Favored 'Trans proline' 0 N--CA 1.448 -1.191 0 C-N-CA 123.274 2.649 . . . . 0.0 111.912 179.512 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.251 1.138 0 CA-C-O 117.393 -1.289 . . . . 0.0 109.351 179.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 1' ' ' PRO . . . . . 0.423 ' O ' HG23 ' B' ' 2' ' ' THR . 1.6 Cg_endo . . . . . 0 N--CA 1.481 0.765 0 N-CA-C 110.666 -0.552 . . . . 0.0 110.666 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 2' ' ' THR . . . . . 0.524 ' HB ' ' HD2' ' B' ' 3' ' ' PRO . 0.7 OUTLIER -157.67 170.75 8.42 Favored Pre-proline 0 C--N 1.319 -0.726 0 CA-C-N 115.194 -0.912 . . . . 0.0 109.147 -179.027 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . 0.524 ' HD2' ' HB ' ' B' ' 2' ' ' THR . 58.6 Cg_endo -71.35 57.52 2.26 Favored 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 122.636 2.224 . . . . 0.0 111.383 179.077 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -65.58 133.91 52.19 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 114.187 -1.37 . . . . 0.0 111.8 -178.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 5' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.23 136.63 32.86 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.06 178.473 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 6' ' ' ARG . . . . . 0.692 ' HD2' HG22 ' A' ' 16' ' ' THR . 26.2 mmm180 -70.14 104.25 2.55 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . 0.417 ' CD ' HH21 ' B' ' 16' ' ' ARG . 40.0 tt0 -84.67 132.89 34.42 Favored 'General case' 0 CA--C 1.508 -0.643 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 -179.906 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -74.93 93.25 2.65 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 178.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . 0.89 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 2.5 mp -75.41 53.55 0.68 Allowed 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.627 -0.715 . . . . 0.0 112.906 -177.683 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 80.6 m -75.31 124.6 27.37 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.007 178.472 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 60.08 -120.87 24.66 Favored Glycine 0 CA--C 1.52 0.404 0 C-N-CA 121.301 -0.476 . . . . 0.0 114.089 179.167 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 22.4 t-160 -51.41 -35.22 38.15 Favored 'General case' 0 N--CA 1.467 0.376 0 N-CA-C 113.18 0.808 . . . . 0.0 113.18 -178.422 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 13' ' ' HIS . . . . . 0.656 ' C ' ' HG ' ' B' ' 9' ' ' LEU . 36.6 m170 -56.32 -43.01 78.57 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 120.435 -0.506 . . . . 0.0 110.581 -179.092 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 14' ' ' PHE . . . . . 0.567 ' HA ' ' CD2' ' B' ' 9' ' ' LEU . 27.8 t80 -61.27 -47.47 85.85 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 178.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 20.5 t -58.21 -52.24 61.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.93 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . 0.53 ' HG3' ' N ' ' B' ' 17' ' ' ALA . 15.6 ptt180 -61.84 -46.21 90.45 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -178.206 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . 0.53 ' N ' ' HG3' ' B' ' 16' ' ' ARG . . . -68.56 -44.29 74.77 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 111.788 0.292 . . . . 0.0 111.788 -179.027 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 18' ' ' LEU . . . . . 0.63 ' HG ' ' CZ2' ' B' ' 27' ' ' TRP . 20.0 tp -59.77 -51.88 67.86 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.087 -179.452 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 84.6 t -63.3 -41.19 91.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 120.662 0.268 . . . . 0.0 111.606 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . 0.912 ' HA ' ' HE ' ' B' ' 20' ' ' ARG . 0.4 OUTLIER -70.87 -48.17 55.27 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -179.071 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 21' ' ' VAL . . . . . 0.417 ' C ' ' H ' ' B' ' 23' ' ' GLY . 87.3 t -66.3 -41.05 88.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 120.538 0.208 . . . . 0.0 111.247 -179.363 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 79.2 m -79.05 36.82 0.29 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.158 0.504 . . . . 0.0 111.567 179.767 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . 0.417 ' H ' ' C ' ' B' ' 21' ' ' VAL . . . 73.85 -67.88 1.65 Allowed Glycine 0 N--CA 1.449 -0.447 0 CA-C-N 115.745 -0.662 . . . . 0.0 113.954 178.712 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . 0.406 ' O ' ' HB2' ' B' ' 27' ' ' TRP . . . 126.3 -67.72 0.53 Allowed Glycine 0 N--CA 1.449 -0.481 0 N-CA-C 111.465 -0.654 . . . . 0.0 111.465 -178.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -63.03 -36.03 61.95 Favored 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 122.274 1.983 . . . . 0.0 111.732 179.302 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 18.5 mmm-85 -94.21 36.87 1.11 Allowed 'General case' 0 CA--C 1.505 -0.777 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.256 179.164 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 27' ' ' TRP . . . . . 0.78 ' CE3' ' HA ' ' B' ' 27' ' ' TRP . 0.0 OUTLIER -80.01 51.08 1.3 Allowed 'General case' 0 C--N 1.3 -1.562 0 CA-C-O 121.584 0.707 . . . . 0.0 110.657 -179.83 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 23.7 m -69.49 60.06 0.14 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 114.432 -1.258 . . . . 0.0 112.023 179.609 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 29' ' ' THR . . . . . 0.531 ' HB ' ' CZ3' ' B' ' 27' ' ' TRP . 75.0 m -164.71 -46.41 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 179.741 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 30' ' ' GLU . . . . . 0.535 ' HB3' ' NE1' ' B' ' 27' ' ' TRP . 87.9 tt0 -110.9 18.5 19.46 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.029 -1.1 . . . . 0.0 108.029 178.643 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 31' ' ' ALA . . . . . 0.404 ' HB3' ' HB3' ' B' ' 27' ' ' TRP . . . . . . . . 0 C--O 1.246 0.907 0 CA-C-N 114.277 -1.329 . . . . 0.0 108.66 -179.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.015 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -68.0 133.44 49.04 Favored 'General case' 0 C--N 1.331 -0.206 0 O-C-N 123.04 0.212 . . . . 0.0 110.449 179.328 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -175.42 135.5 0.33 Allowed 'General case' 0 N--CA 1.444 -0.726 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 -179.552 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 2.9 p -60.18 -30.21 69.2 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.761 179.528 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 24.3 t-20 -147.16 102.73 3.81 Favored Pre-proline 0 C--N 1.32 -0.697 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.046 178.583 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_exo -58.0 -43.11 51.29 Favored 'Trans proline' 0 C--N 1.333 -0.262 0 C-N-CA 123.845 3.03 . . . . 0.0 113.416 -178.336 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.76 -43.95 85.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.136 0.493 . . . . 0.0 110.581 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.422 ' HD2' ' HA ' ' A' ' 8' ' ' ARG . 14.4 tpt180 -68.24 -51.27 47.15 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.283 179.52 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 47.0 t80 -55.57 -51.64 66.42 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 114.757 -1.11 . . . . 0.0 111.282 -179.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.89 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 14.1 m -62.48 -35.3 78.92 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.96 -179.725 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 38.2 t -72.43 -59.41 2.74 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.239 0.542 . . . . 0.0 111.562 -179.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.465 HD13 ' HA ' ' A' ' 12' ' ' LEU . 4.0 mm? -68.84 -56.6 7.46 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 113.005 0.743 . . . . 0.0 113.005 -178.416 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 13.9 m -81.74 -43.21 18.71 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 111.777 0.288 . . . . 0.0 111.777 -178.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.579 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 99.8 148.36 22.67 Favored Glycine 0 N--CA 1.45 -0.404 0 N-CA-C 110.875 -0.89 . . . . 0.0 110.875 -178.977 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.589 ' HB2' ' CB ' ' A' ' 19' ' ' ASP . 24.3 p -142.63 163.45 32.8 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 117.018 0.409 . . . . 0.0 111.897 -178.361 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.692 HG22 ' HD2' ' B' ' 6' ' ' ARG . 63.3 p -114.89 -172.88 2.21 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.812 -179.389 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 24.3 pt20 -57.64 -42.5 83.56 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 120.611 0.244 . . . . 0.0 111.01 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -60.8 -41.67 96.09 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.181 0.515 . . . . 0.0 110.213 179.287 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.589 ' CB ' ' HB2' ' A' ' 15' ' ' CYS . 0.5 OUTLIER -61.99 -39.76 93.34 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.92 179.696 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.608 HD13 HD11 ' B' ' 18' ' ' LEU . 3.4 mm? -71.67 -39.34 70.35 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.751 -0.462 . . . . 0.0 109.751 178.057 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.488 HD22 ' HA ' ' A' ' 21' ' ' LEU . 2.2 tm? -57.7 -41.36 81.55 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.879 -179.898 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 30.9 p -65.83 -5.39 8.86 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 71.6 mt -105.7 -10.5 16.74 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.009 0.433 . . . . 0.0 110.303 179.581 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 62.9 m -79.22 145.92 65.75 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.754 -179.368 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.581 ' HD3' ' HZ3' ' B' ' 27' ' ' TRP . 86.4 Cg_endo -88.77 -157.12 0.06 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.716 0 C-N-CA 123.376 2.718 . . . . 0.0 112.24 179.418 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 23.3 t80 . . . . . 0 C--O 1.25 1.095 0 CA-C-O 117.991 -1.004 . . . . 0.0 109.258 179.364 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 1' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_exo . . . . . 0 CA--C 1.511 -0.641 0 N-CA-C 110.911 -0.457 . . . . 0.0 110.911 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 2' ' ' THR . . . . . 0.511 HG21 ' HD2' ' B' ' 3' ' ' PRO . 5.8 m -54.46 132.63 62.92 Favored Pre-proline 0 C--N 1.32 -0.687 0 O-C-N 124.051 0.844 . . . . 0.0 109.278 179.346 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . 0.511 ' HD2' HG21 ' B' ' 2' ' ' THR . 62.9 Cg_exo -22.92 86.77 0.0 OUTLIER 'Trans proline' 0 C--N 1.358 1.04 1 C-N-CA 125.624 4.216 . . . . 0.0 115.38 -178.566 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 5.6 mp0 -77.05 141.71 40.17 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.012 -0.995 . . . . 0.0 109.878 -179.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 5' ' ' MET . . . . . . . . . . . . . 96.7 mmm -53.34 114.49 1.51 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.13 0.49 . . . . 0.0 110.907 -179.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 6' ' ' ARG . . . . . 0.699 ' HD2' ' HA ' ' A' ' 15' ' ' CYS . 57.8 mmt-85 -92.89 125.44 37.49 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.825 -179.473 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -104.4 135.74 45.27 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 178.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . 0.507 ' HA ' ' O ' ' A' ' 10' ' ' CYS . 65.7 mttm -77.55 95.01 4.43 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.579 0.704 . . . . 0.0 110.285 -179.643 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . 1.116 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 7.9 mp -75.02 52.02 0.54 Allowed 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 114.961 -1.018 . . . . 0.0 112.369 -179.106 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 67.5 m -73.08 123.13 22.96 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.222 -0.444 . . . . 0.0 109.94 178.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 59.24 -118.36 14.01 Favored Glycine 0 CA--C 1.52 0.383 0 C-N-CA 121.259 -0.496 . . . . 0.0 113.826 179.359 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 11.1 t-160 -54.14 -32.11 54.35 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 -178.661 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 13' ' ' HIS . . . . . 0.648 ' CB ' ' HA ' ' B' ' 9' ' ' LEU . 30.3 m170 -60.75 -36.94 80.17 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 120.109 -0.637 . . . . 0.0 110.815 -178.751 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 14' ' ' PHE . . . . . 0.856 ' HA ' HD21 ' B' ' 9' ' ' LEU . 15.9 t80 -62.13 -45.36 93.81 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 178.524 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 47.9 t -63.72 -52.94 50.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.087 -0.96 . . . . 0.0 111.9 179.699 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . 0.531 ' HG3' ' O ' ' B' ' 13' ' ' HIS . 3.7 ppt_? -59.68 -44.4 93.63 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.896 -0.593 . . . . 0.0 112.066 -178.442 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . 0.561 ' HB1' HD12 ' A' ' 20' ' ' LEU . . . -69.62 -41.8 75.18 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 121.146 -0.222 . . . . 0.0 111.115 -179.373 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 18' ' ' LEU . . . . . 0.531 HD22 ' CD1' ' B' ' 27' ' ' TRP . 7.2 mt -56.85 -55.61 32.24 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.836 0.35 . . . . 0.0 111.259 179.502 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 41.7 t -64.26 -38.44 82.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.995 -0.548 . . . . 0.0 112.315 -178.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . 0.754 ' NE ' ' HA ' ' B' ' 20' ' ' ARG . 0.1 OUTLIER -77.06 -54.5 6.46 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.125 -0.63 . . . . 0.0 112.592 -178.563 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 21' ' ' VAL . . . . . 0.632 HG11 ' HG3' ' A' ' 17' ' ' GLN . 78.3 t -63.46 -45.73 97.11 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 CA-C-N 115.734 -0.666 . . . . 0.0 112.164 -178.502 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 22' ' ' CYS . . . . . 0.773 ' HB3' ' HB2' ' B' ' 27' ' ' TRP . 88.1 m -86.48 42.25 0.99 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.337 0.589 . . . . 0.0 112.043 -179.225 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.32 -75.72 1.74 Allowed Glycine 0 C--O 1.236 0.271 0 CA-C-N 115.797 -0.638 . . . . 0.0 114.355 178.183 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 132.63 -58.96 0.69 Allowed Glycine 0 CA--C 1.522 0.51 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.885 -179.044 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_exo -60.84 -20.95 68.75 Favored 'Trans proline' 0 C--N 1.356 0.958 0 C-N-CA 122.842 2.361 . . . . 0.0 112.545 -179.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 19.4 ttt85 -166.1 140.87 4.55 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.262 179.278 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 27' ' ' TRP . . . . . 0.773 ' HB2' ' HB3' ' B' ' 22' ' ' CYS . 0.3 OUTLIER -173.52 -15.55 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.578 0 O-C-N 123.831 0.707 . . . . 0.0 112.775 -179.918 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 93.8 p -151.59 -130.65 0.04 OUTLIER 'General case' 0 N--CA 1.441 -0.882 0 CA-C-O 121.739 0.78 . . . . 0.0 112.594 -177.201 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -95.45 -36.22 11.41 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 114.436 -1.256 . . . . 0.0 109.429 -178.84 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -65.65 -32.87 74.68 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 114.284 -1.326 . . . . 0.0 110.176 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.124 0 CA-C-O 117.836 -1.078 . . . . 0.0 109.117 179.837 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . 0.426 ' HB2' ' H ' ' A' ' 2' ' ' ALA . . . . . . . . 0 N--CA 1.479 0.977 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . 0.426 ' H ' ' HB2' ' A' ' 1' ' ' ALA . . . -73.38 125.47 27.93 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 110.372 -0.232 . . . . 0.0 110.372 179.404 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -173.68 127.67 0.4 Allowed 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 2.4 p -64.47 -27.59 69.09 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.836 179.485 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 33.5 t-20 -151.79 105.89 2.87 Favored Pre-proline 0 C--N 1.321 -0.667 0 CA-C-N 115.164 -0.925 . . . . 0.0 108.772 178.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_exo -57.88 -48.64 15.69 Favored 'Trans proline' 0 C--N 1.331 -0.353 0 C-N-CA 123.67 2.913 . . . . 0.0 113.431 -178.499 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.6 -44.32 81.0 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.313 0.578 . . . . 0.0 110.587 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 17.3 mmm180 -67.62 -50.24 59.09 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.073 179.296 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -57.34 -49.09 77.24 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.794 179.629 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 1.116 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 65.0 m -61.88 -38.67 89.2 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.723 -0.672 . . . . 0.0 112.074 -179.66 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 47.7 t -74.46 -59.66 2.63 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.245 0.545 . . . . 0.0 111.664 -179.398 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.458 HD13 ' HA ' ' A' ' 12' ' ' LEU . 4.5 mm? -61.99 -56.56 17.89 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.541 -0.754 . . . . 0.0 112.629 -178.518 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 12.5 m -91.22 -59.26 2.2 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.932 0.396 . . . . 0.0 111.144 -179.234 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.594 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 123.57 144.46 6.55 Favored Glycine 0 N--CA 1.446 -0.675 0 N-CA-C 110.894 -0.883 . . . . 0.0 110.894 -179.513 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.699 ' HA ' ' HD2' ' B' ' 6' ' ' ARG . 20.8 p -130.3 153.51 48.57 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 117.162 0.481 . . . . 0.0 110.789 -179.783 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.579 HG21 ' H ' ' A' ' 19' ' ' ASP . 10.1 t -107.02 -176.86 3.2 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.638 -178.75 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.632 ' HG3' HG11 ' B' ' 21' ' ' VAL . 34.1 tt0 -59.0 -53.08 62.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.68 -179.737 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 8.8 mm100 -60.69 -38.43 84.93 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.392 0.615 . . . . 0.0 110.432 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.579 ' H ' HG21 ' A' ' 16' ' ' THR . 3.0 t0 -62.12 -41.64 98.44 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.176 -0.92 . . . . 0.0 109.818 179.362 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.561 HD12 ' HB1' ' B' ' 17' ' ' ALA . 77.8 mt -72.81 -41.36 65.01 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.014 179.131 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 45.8 tp -56.35 -45.88 80.21 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.88 -179.486 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 11.0 p -64.27 -9.98 20.87 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 179.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 98.4 mt -96.59 -20.77 18.08 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.032 179.422 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.507 ' SG ' ' HD1' ' B' ' 27' ' ' TRP . 76.5 m -99.06 133.1 22.43 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-O 121.181 0.515 . . . . 0.0 111.872 -179.026 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.484 ' HD3' ' HA ' ' A' ' 24' ' ' CYS . 63.6 Cg_endo -92.49 -158.41 0.06 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.975 0 C-N-CA 123.578 2.852 . . . . 0.0 111.941 179.197 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 37.5 m-85 . . . . . 0 C--O 1.247 0.929 0 CA-C-O 118.701 -0.666 . . . . 0.0 109.6 179.209 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 1' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_endo . . . . . 0 N--CA 1.48 0.729 0 N-CA-C 111.178 -0.354 . . . . 0.0 111.178 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 2' ' ' THR . . . . . 0.621 ' OG1' ' HD2' ' B' ' 3' ' ' PRO . 0.6 OUTLIER -175.73 167.9 1.63 Allowed Pre-proline 0 C--N 1.325 -0.478 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 -179.137 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . 0.621 ' HD2' ' OG1' ' B' ' 2' ' ' THR . 40.5 Cg_endo -67.86 65.09 0.92 Allowed 'Trans proline' 0 C--N 1.356 0.937 0 C-N-CA 122.677 2.251 . . . . 0.0 112.202 -179.765 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . 0.621 ' HG3' HG22 ' B' ' 2' ' ' THR . 18.6 mt-10 -66.83 145.57 55.34 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 114.35 -1.296 . . . . 0.0 111.179 -179.084 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 5' ' ' MET . . . . . . . . . . . . . 48.5 ttm -78.1 136.23 37.85 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 178.721 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 6' ' ' ARG . . . . . 0.603 ' HD2' HG23 ' A' ' 16' ' ' THR . 27.3 mmm180 -65.25 110.41 2.57 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 179.796 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . 0.619 ' HG3' HD12 ' B' ' 9' ' ' LEU . 8.8 tp10 -84.13 133.2 34.63 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-O 121.468 0.652 . . . . 0.0 109.475 179.821 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 6.0 mtmm -83.06 86.51 6.99 Favored 'General case' 0 C--N 1.308 -1.2 0 CA-C-N 115.331 -0.85 . . . . 0.0 109.555 -179.225 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . 0.619 HD12 ' HG3' ' B' ' 7' ' ' GLU . 1.6 mm? -74.73 54.44 0.62 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.653 -0.703 . . . . 0.0 112.878 -178.653 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 10' ' ' CYS . . . . . 0.493 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 81.2 m -71.28 119.66 15.74 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.608 178.78 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 53.47 -116.57 5.98 Favored Glycine 0 C--N 1.331 0.29 0 CA-C-N 116.161 -0.472 . . . . 0.0 113.583 179.213 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 22.6 t-160 -51.28 -34.04 31.19 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 122.978 0.511 . . . . 0.0 111.909 -179.634 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 13' ' ' HIS . . . . . 0.553 ' C ' HD13 ' B' ' 9' ' ' LEU . 46.7 m170 -55.16 -44.57 75.29 Favored 'General case' 0 C--N 1.32 -0.696 0 C-N-CA 120.495 -0.482 . . . . 0.0 110.48 -179.362 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 14' ' ' PHE . . . . . 0.456 ' CA ' ' HB3' ' B' ' 9' ' ' LEU . 25.7 t80 -62.64 -48.0 81.24 Favored 'General case' 0 C--N 1.329 -0.318 0 O-C-N 123.382 0.426 . . . . 0.0 110.229 178.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 13.0 t -56.43 -50.58 71.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.753 179.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.96 -45.08 96.17 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.016 -0.993 . . . . 0.0 112.061 -179.359 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.17 -44.56 83.7 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.769 0.319 . . . . 0.0 111.524 -179.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 29.4 tp -61.05 -51.53 68.79 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.607 -179.346 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 19' ' ' VAL . . . . . 0.427 HG12 ' CD1' ' B' ' 27' ' ' TRP . 21.1 m -64.36 -33.89 65.69 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 -179.448 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . 0.534 ' NE ' ' HA ' ' B' ' 20' ' ' ARG . 13.9 mmp_? -77.38 -52.33 9.33 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 112.395 0.517 . . . . 0.0 112.395 -179.376 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 91.1 t -71.13 -52.75 24.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -178.545 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 83.6 m -97.7 47.6 1.02 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.772 0.32 . . . . 0.0 111.282 -179.309 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -172.4 -38.71 0.03 OUTLIER Glycine 0 N--CA 1.444 -0.784 0 C-N-CA 119.986 -1.102 . . . . 0.0 112.831 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 74.23 -113.88 4.29 Favored Glycine 0 N--CA 1.445 -0.705 0 N-CA-C 110.663 -0.975 . . . . 0.0 110.663 -178.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_exo -60.4 -39.02 70.23 Favored 'Trans proline' 0 CA--C 1.531 0.351 0 C-N-CA 122.742 2.295 . . . . 0.0 112.237 179.375 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . 0.593 ' NH1' ' HB3' ' B' ' 26' ' ' ARG . 9.3 mtp-105 -152.95 156.08 38.19 Favored 'General case' 0 CA--C 1.495 -1.156 0 CA-C-O 121.597 0.713 . . . . 0.0 111.091 179.664 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 27' ' ' TRP . . . . . 0.592 ' HA ' ' HE3' ' B' ' 27' ' ' TRP . 0.0 OUTLIER -86.59 52.29 2.46 Favored 'General case' 0 C--N 1.305 -1.337 0 CA-C-N 113.972 -1.467 . . . . 0.0 107.349 176.032 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 63.6 m -61.37 63.47 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 114.827 -1.079 . . . . 0.0 113.709 -178.218 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 29' ' ' THR . . . . . 0.504 ' HB ' ' CZ3' ' B' ' 27' ' ' TRP . 59.0 m -169.32 -38.77 0.02 OUTLIER 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 179.239 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 30' ' ' GLU . . . . . 0.479 ' HB3' ' NE1' ' B' ' 27' ' ' TRP . 39.7 tt0 -125.25 -31.08 3.1 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 114.862 -1.063 . . . . 0.0 110.872 -179.312 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 31' ' ' ALA . . . . . 0.559 ' HB2' ' HB3' ' B' ' 27' ' ' TRP . . . . . . . . 0 C--O 1.25 1.129 0 CA-C-O 118.733 -0.651 . . . . 0.0 111.128 -179.385 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . 0.637 ' H3 ' ' HE2' ' A' ' 9' ' ' TYR . . . . . . . . 0 N--CA 1.479 1.019 0 N-CA-C 110.299 -0.26 . . . . 0.0 110.299 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -156.05 132.93 10.48 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.639 -0.255 . . . . 0.0 110.329 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -83.0 59.61 5.01 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.401 -179.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 4.7 p -141.18 -62.25 0.47 Allowed 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.413 0.625 . . . . 0.0 110.501 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 30.1 t-20 -170.93 109.76 0.42 Allowed Pre-proline 0 C--N 1.317 -0.821 0 CA-C-N 115.002 -0.999 . . . . 0.0 109.123 179.258 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -60.83 -46.81 14.99 Favored 'Trans proline' 0 C--N 1.333 -0.282 0 C-N-CA 123.21 2.607 . . . . 0.0 113.416 -178.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -58.66 -43.35 89.83 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.024 0.44 . . . . 0.0 110.925 -179.747 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.401 ' HA ' ' HD3' ' A' ' 8' ' ' ARG . 3.0 mmt85 -73.25 -43.87 60.36 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.498 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . 0.637 ' HE2' ' H3 ' ' A' ' 1' ' ' ALA . 32.3 t80 -62.7 -51.42 67.27 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.115 -179.714 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.674 ' O ' ' HA2' ' A' ' 14' ' ' GLY . 86.6 m -67.32 -17.54 64.8 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.883 -179.577 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.493 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 28.8 t -82.95 -57.28 3.36 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.298 0.571 . . . . 0.0 110.341 178.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 97.2 mt -69.49 -57.85 4.71 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.885 -1.052 . . . . 0.0 112.555 -178.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 14.1 m -84.36 -29.68 26.07 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.085 0.469 . . . . 0.0 111.446 -178.787 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.674 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 83.62 151.31 11.41 Favored Glycine 0 N--CA 1.446 -0.672 0 C-N-CA 120.779 -0.724 . . . . 0.0 111.493 -178.861 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.529 ' HA ' ' NH2' ' B' ' 6' ' ' ARG . 82.9 m -134.79 143.79 47.29 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.933 0.396 . . . . 0.0 111.046 -179.162 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.603 HG23 ' HD2' ' B' ' 6' ' ' ARG . 39.7 p -80.64 167.34 20.15 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 178.559 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 4.6 pp0? -61.73 -37.64 84.97 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 179.373 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 66.9 tp60 -63.63 -43.42 96.87 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.199 178.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -59.7 -44.18 93.78 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.464 179.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 81.2 mt -65.23 -46.32 81.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.344 178.723 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 30.9 tp -57.31 -41.11 79.27 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.808 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 21.2 m -62.62 -24.16 67.44 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.36 179.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 96.6 mt -77.65 -23.19 49.74 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.487 179.244 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.465 ' HA ' ' HD3' ' A' ' 25' ' ' PRO . 43.2 m -83.5 132.94 48.03 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.251 -179.541 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.465 ' HD3' ' HA ' ' A' ' 24' ' ' CYS . 3.7 Cg_exo -78.23 132.08 11.19 Favored 'Trans proline' 0 N--CA 1.455 -0.748 0 C-N-CA 123.117 2.545 . . . . 0.0 112.307 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.247 0.923 0 CA-C-N 115.176 -0.92 . . . . 0.0 109.434 179.314 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 1' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo . . . . . 0 N--CA 1.481 0.767 0 N-CA-C 110.019 -0.8 . . . . 0.0 110.019 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 2' ' ' THR . . . . . 0.486 HG23 ' HD2' ' B' ' 3' ' ' PRO . 6.3 m -71.81 127.13 91.17 Favored Pre-proline 0 C--N 1.324 -0.541 0 O-C-N 123.4 0.437 . . . . 0.0 110.703 -179.581 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . 0.486 ' HD2' HG23 ' B' ' 2' ' ' THR . 54.3 Cg_endo -70.97 135.36 27.4 Favored 'Trans proline' 0 N--CA 1.463 -0.268 0 C-N-CA 122.419 2.08 . . . . 0.0 111.861 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . 0.502 ' HB2' ' HG1' ' A' ' 16' ' ' THR . 1.3 pt-20 -69.0 132.83 47.29 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.247 0.546 . . . . 0.0 111.168 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 5' ' ' MET . . . . . . . . . . . . . 53.1 ttm -79.38 68.43 5.39 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.653 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 6' ' ' ARG . . . . . 0.58 ' HA ' ' HA ' ' A' ' 16' ' ' THR . 51.2 ttm-85 -76.14 118.7 19.15 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.638 -0.505 . . . . 0.0 109.638 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -120.35 144.88 47.63 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.817 -178.398 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 25.0 mtpp -71.8 98.04 1.9 Allowed 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 107.555 -1.276 . . . . 0.0 107.555 177.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . 0.786 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 32.5 mt -77.97 59.21 2.1 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 113.974 1.102 . . . . 0.0 113.974 -176.485 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 10' ' ' CYS . . . . . 0.435 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 93.2 m -80.99 122.83 27.78 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 177.759 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 63.08 -123.28 29.64 Favored Glycine 0 CA--C 1.52 0.35 0 C-N-CA 121.107 -0.568 . . . . 0.0 113.569 179.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 23.6 t-160 -53.41 -31.03 43.24 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 112.707 0.632 . . . . 0.0 112.707 -178.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 13' ' ' HIS . . . . . 0.625 ' CB ' ' HA ' ' B' ' 9' ' ' LEU . 51.4 m170 -56.5 -43.44 79.74 Favored 'General case' 0 C--N 1.321 -0.668 0 C-N-CA 120.665 -0.414 . . . . 0.0 111.26 -179.035 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 14' ' ' PHE . . . . . 0.731 ' HA ' HD11 ' B' ' 9' ' ' LEU . 45.8 t80 -61.44 -45.64 93.43 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.257 0.551 . . . . 0.0 109.666 178.691 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . 0.445 HG11 HG22 ' B' ' 19' ' ' VAL . 23.7 t -60.45 -49.4 84.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.023 -0.989 . . . . 0.0 111.588 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . 0.617 ' HG3' ' N ' ' B' ' 17' ' ' ALA . 12.5 ptt85 -61.03 -43.22 99.21 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.706 -0.224 . . . . 0.0 111.549 -178.587 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . 0.617 ' N ' ' HG3' ' B' ' 16' ' ' ARG . . . -66.41 -51.25 58.93 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.805 0.336 . . . . 0.0 111.43 -179.176 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 29.9 tp -60.37 -54.59 43.79 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.714 -179.394 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 19' ' ' VAL . . . . . 0.445 HG22 HG11 ' B' ' 15' ' ' VAL . 77.8 t -59.9 -45.36 95.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -178.698 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . 0.504 ' HA ' ' HD2' ' B' ' 20' ' ' ARG . 23.6 tpt85 -71.71 -56.18 6.28 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -178.107 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 21' ' ' VAL . . . . . 0.522 HG21 ' HB3' ' A' ' 17' ' ' GLN . 89.2 t -61.83 -45.97 97.52 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.844 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 -176.965 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 74.4 m -71.63 -23.05 61.63 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 -178.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 165.84 -102.92 0.2 Allowed Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.013 -1.089 . . . . 0.0 112.908 -179.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -177.92 -99.06 0.12 Allowed Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 121.028 -0.605 . . . . 0.0 112.27 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -60.76 -31.44 91.87 Favored 'Trans proline' 0 CA--C 1.529 0.256 0 C-N-CA 123.164 2.576 . . . . 0.0 113.038 -179.548 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . 0.568 ' HB2' ' CZ ' ' B' ' 26' ' ' ARG . 0.2 OUTLIER -163.82 152.49 13.63 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 109.562 -0.532 . . . . 0.0 109.562 179.905 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 27' ' ' TRP . . . . . 0.549 ' CZ3' ' HB2' ' B' ' 30' ' ' GLU . 0.0 OUTLIER -147.29 -90.26 0.09 Allowed 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.378 -179.33 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 39.6 m -166.68 58.76 0.09 Allowed 'General case' 0 C--N 1.326 -0.43 0 O-C-N 123.315 0.384 . . . . 0.0 111.714 -179.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 29' ' ' THR . . . . . 0.515 HG22 ' OE1' ' B' ' 30' ' ' GLU . 1.6 t -166.73 -90.4 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 179.074 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 30' ' ' GLU . . . . . 0.549 ' HB2' ' CZ3' ' B' ' 27' ' ' TRP . 2.0 mp0 -63.22 -27.66 69.51 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 177.812 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 31' ' ' ALA . . . . . 0.414 ' H ' ' HZ3' ' B' ' 27' ' ' TRP . . . . . . . . 0 C--O 1.253 1.261 0 CA-C-N 114.716 -1.129 . . . . 0.0 109.126 179.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . 0.541 ' H2 ' ' HE2' ' A' ' 9' ' ' TYR . . . . . . . . 0 N--CA 1.477 0.906 0 N-CA-C 109.95 -0.389 . . . . 0.0 109.95 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -66.29 130.87 44.69 Favored 'General case' 0 C--N 1.331 -0.208 0 O-C-N 123.024 0.203 . . . . 0.0 110.504 179.48 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -178.12 142.53 0.28 Allowed 'General case' 0 N--CA 1.443 -0.778 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 -179.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 10.0 t -59.3 -23.07 62.13 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.154 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 34.2 t-20 -148.94 103.01 3.38 Favored Pre-proline 0 C--N 1.325 -0.485 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 178.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_exo -59.11 -47.23 18.37 Favored 'Trans proline' 0 C--N 1.331 -0.354 0 C-N-CA 123.742 2.961 . . . . 0.0 113.093 -178.681 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.86 -41.88 78.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.271 0.557 . . . . 0.0 110.666 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.446 ' HD3' ' HA ' ' A' ' 8' ' ' ARG . 30.4 mmt-85 -70.35 -49.38 49.82 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.56 -0.746 . . . . 0.0 111.184 179.335 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . 0.541 ' HE2' ' H2 ' ' A' ' 1' ' ' ALA . 28.0 t80 -59.03 -49.12 79.12 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.657 -179.793 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.786 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 95.0 m -63.31 -30.48 71.61 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.65 -179.416 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.435 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 36.0 t -77.04 -56.0 4.96 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.207 0.527 . . . . 0.0 110.063 178.97 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 85.5 mt -55.23 -55.08 35.33 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.078 -0.964 . . . . 0.0 110.723 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 15.2 m -95.14 -92.88 0.19 Allowed 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.925 -0.579 . . . . 0.0 109.775 178.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 165.65 149.97 6.08 Favored Glycine 0 N--CA 1.448 -0.515 0 N-CA-C 111.221 -0.751 . . . . 0.0 111.221 179.649 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.494 ' HA ' ' NH1' ' B' ' 6' ' ' ARG . 73.9 m -134.99 134.41 40.46 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 117.191 0.495 . . . . 0.0 111.027 -179.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.722 HG22 ' HB2' ' A' ' 19' ' ' ASP . 6.4 t -81.52 160.89 23.8 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 179.212 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.522 ' HB3' HG21 ' B' ' 21' ' ' VAL . 68.2 mm-40 -56.96 -40.09 75.83 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.234 0.54 . . . . 0.0 109.753 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 38.4 tt0 -62.59 -38.92 92.04 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.46 -0.791 . . . . 0.0 109.83 178.113 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.722 ' HB2' HG22 ' A' ' 16' ' ' THR . 11.3 t0 -57.33 -47.49 81.42 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.006 -0.997 . . . . 0.0 109.183 178.848 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.537 ' N ' HD21 ' A' ' 20' ' ' LEU . 4.4 mm? -62.18 -43.19 99.39 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.303 178.605 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.461 ' HG ' ' HE2' ' A' ' 26' ' ' TYR . 39.4 tp -54.71 -51.47 65.47 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.663 179.816 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 6.8 p -62.83 -16.02 56.68 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.535 ' HG ' ' O ' ' A' ' 19' ' ' ASP . 89.2 mt -80.26 -27.43 38.63 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.948 0.404 . . . . 0.0 110.235 179.08 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.464 ' HA ' ' HD3' ' A' ' 25' ' ' PRO . 88.6 m -92.01 138.37 24.69 Favored Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.187 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.464 ' HD3' ' HA ' ' A' ' 24' ' ' CYS . 8.3 Cg_exo -71.11 139.28 35.28 Favored 'Trans proline' 0 N--CA 1.458 -0.601 0 C-N-CA 123.077 2.518 . . . . 0.0 112.1 179.83 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.461 ' HE2' ' HG ' ' A' ' 21' ' ' LEU . 0.5 OUTLIER . . . . . 0 C--O 1.252 1.22 0 CA-C-O 117.407 -1.282 . . . . 0.0 109.322 179.396 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 1' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo . . . . . 0 N--CA 1.482 0.799 0 N-CA-C 110.854 -0.479 . . . . 0.0 110.854 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 2' ' ' THR . . . . . 0.538 ' HB ' ' HD2' ' B' ' 3' ' ' PRO . 0.2 OUTLIER -155.6 174.65 3.74 Favored Pre-proline 0 C--N 1.319 -0.721 0 CA-C-N 115.377 -0.829 . . . . 0.0 108.778 -179.224 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . 0.538 ' HD2' ' HB ' ' B' ' 2' ' ' THR . 44.6 Cg_endo -67.82 59.94 0.87 Allowed 'Trans proline' 0 C--N 1.354 0.86 0 C-N-CA 122.872 2.382 . . . . 0.0 112.247 179.862 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . 0.512 ' OE1' ' HG3' ' A' ' 18' ' ' GLN . 22.0 mt-10 -81.32 140.71 34.63 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 114.308 -1.314 . . . . 0.0 111.155 -179.025 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 5' ' ' MET . . . . . . . . . . . . . 13.6 tpt -117.1 142.47 46.96 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.481 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 6' ' ' ARG . . . . . 0.759 ' NH1' ' HA ' ' A' ' 15' ' ' CYS . 14.1 tpp180 -73.98 122.82 23.2 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 178.96 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 62.2 tt0 -132.51 145.04 50.85 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-O 121.087 0.47 . . . . 0.0 111.123 -178.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 10.1 mmtp -81.61 96.17 7.4 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 177.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . 0.965 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 21.5 mt -76.41 56.42 1.08 Allowed 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 112.848 0.684 . . . . 0.0 112.848 -178.079 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 99.4 m -75.94 121.45 22.7 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.164 -0.471 . . . . 0.0 109.807 178.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 62.35 -123.64 31.48 Favored Glycine 0 CA--C 1.521 0.462 0 C-N-CA 121.262 -0.494 . . . . 0.0 114.015 179.382 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 12' ' ' HIS . . . . . 0.477 ' O ' ' HG2' ' B' ' 16' ' ' ARG . 20.7 t-160 -51.44 -32.37 26.56 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 112.894 0.701 . . . . 0.0 112.894 -178.526 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 13' ' ' HIS . . . . . 0.588 ' HB3' ' HA ' ' B' ' 9' ' ' LEU . 28.7 m170 -57.75 -42.9 84.89 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 120.905 -0.318 . . . . 0.0 110.799 -179.433 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 14' ' ' PHE . . . . . 0.769 ' HA ' HD12 ' B' ' 9' ' ' LEU . 43.3 t80 -61.42 -45.9 92.39 Favored 'General case' 0 C--N 1.327 -0.396 0 O-C-N 123.418 0.449 . . . . 0.0 110.0 178.995 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . 0.451 ' O ' HG22 ' B' ' 19' ' ' VAL . 59.3 t -55.7 -56.61 11.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.568 -0.742 . . . . 0.0 112.108 -179.62 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . 0.477 ' HG2' ' O ' ' B' ' 12' ' ' HIS . 2.5 ptm180 -59.91 -47.71 84.68 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -179.147 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . 0.708 ' HB2' HD12 ' A' ' 20' ' ' LEU . . . -66.79 -43.76 83.06 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.146 0.425 . . . . 0.0 112.146 -178.818 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 18' ' ' LEU . . . . . 0.48 HD12 ' SG ' ' B' ' 22' ' ' CYS . 36.9 tp -59.34 -48.76 80.42 Favored 'General case' 0 C--N 1.327 -0.406 0 O-C-N 123.156 0.285 . . . . 0.0 110.698 -179.873 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 19' ' ' VAL . . . . . 0.451 HG22 ' O ' ' B' ' 15' ' ' VAL . 72.7 t -61.31 -44.16 97.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.744 179.728 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.5 -47.07 86.94 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.595 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 21' ' ' VAL . . . . . 0.616 HG23 ' HA ' ' A' ' 17' ' ' GLN . 69.1 t -76.08 -45.95 35.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 N-CA-C 113.013 0.746 . . . . 0.0 113.013 -177.815 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 22' ' ' CYS . . . . . 0.48 ' SG ' HD12 ' B' ' 18' ' ' LEU . 95.6 m -77.66 27.79 0.17 Allowed 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 -178.464 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 154.94 -53.65 0.43 Allowed Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 119.853 -1.165 . . . . 0.0 113.346 178.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 122.21 -83.86 0.36 Allowed Glycine 0 N--CA 1.45 -0.409 0 N-CA-C 110.981 -0.848 . . . . 0.0 110.981 -178.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -67.74 -37.84 15.19 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.42 2.08 . . . . 0.0 110.615 178.585 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . 0.419 ' HA ' HG11 ' B' ' 19' ' ' VAL . 53.1 mtp180 -152.7 -150.26 0.33 Allowed 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 107.577 -1.268 . . . . 0.0 107.577 178.098 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 27' ' ' TRP . . . . . 0.55 ' CH2' ' HB2' ' B' ' 30' ' ' GLU . 0.0 OUTLIER -163.31 -34.67 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.886 0.374 . . . . 0.0 110.855 178.595 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 32.3 t -160.56 -147.98 0.16 Allowed 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.317 -179.497 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 29' ' ' THR . . . . . 0.557 HG22 ' OE1' ' B' ' 30' ' ' GLU . 3.0 t -84.07 -33.55 24.39 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.456 179.966 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 30' ' ' GLU . . . . . 0.557 ' OE1' HG22 ' B' ' 29' ' ' THR . 3.8 mp0 -59.02 -44.91 91.78 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.751 -0.658 . . . . 0.0 110.927 -179.559 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.163 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.582 179.795 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.033 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -161.78 147.44 13.51 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 123.459 0.474 . . . . 0.0 109.939 -179.643 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -82.52 50.17 1.6 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.369 0.604 . . . . 0.0 111.058 -179.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 4.8 p -83.9 51.18 1.98 Allowed 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.774 179.54 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 23.3 t-20 -171.48 116.66 0.43 Allowed Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.135 -179.403 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -56.88 -48.3 19.14 Favored 'Trans proline' 0 N--CA 1.47 0.125 0 C-N-CA 123.288 2.659 . . . . 0.0 113.448 -178.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.53 -39.42 87.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.499 0.666 . . . . 0.0 110.35 179.637 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.44 ' NE ' ' HA ' ' A' ' 8' ' ' ARG . 0.4 OUTLIER -67.93 -49.92 59.01 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.262 -0.881 . . . . 0.0 109.809 179.317 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 17.0 t80 -56.34 -51.59 67.7 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.031 -0.986 . . . . 0.0 111.1 179.684 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.965 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 57.6 m -61.92 -28.56 69.61 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.124 -179.588 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 42.3 t -82.52 -55.3 4.56 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.375 0.607 . . . . 0.0 111.124 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.433 HD12 ' HG3' ' A' ' 8' ' ' ARG . 91.6 mt -64.22 -58.73 5.74 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.157 -0.929 . . . . 0.0 112.417 -178.917 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 8.9 m -89.98 -43.75 10.34 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.999 0.428 . . . . 0.0 111.194 -179.17 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.691 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 103.81 149.46 20.47 Favored Glycine 0 N--CA 1.446 -0.635 0 N-CA-C 110.86 -0.896 . . . . 0.0 110.86 -178.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.759 ' HA ' ' NH1' ' B' ' 6' ' ' ARG . 28.2 p -139.95 -161.44 1.2 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 117.443 0.622 . . . . 0.0 110.944 -179.513 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.644 ' H ' ' HB2' ' A' ' 19' ' ' ASP . 6.9 t -160.1 -166.47 1.71 Allowed 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 -179.757 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.616 ' HA ' HG23 ' B' ' 21' ' ' VAL . 36.4 tt0 -59.0 -53.8 54.35 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.176 0.435 . . . . 0.0 112.176 -179.008 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.512 ' HG3' ' OE1' ' B' ' 4' ' ' GLU . 23.4 mt-30 -57.34 -45.85 83.87 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.819 0.343 . . . . 0.0 110.591 179.549 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.644 ' HB2' ' H ' ' A' ' 16' ' ' THR . 1.1 m-20 -56.53 -43.39 79.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.312 179.122 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.708 HD12 ' HB2' ' B' ' 17' ' ' ALA . 84.2 mt -72.04 -37.54 69.69 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.1 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 6.1 tt -57.13 -46.08 82.98 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.951 -179.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.5 p -64.98 -13.8 58.53 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.95 0.405 . . . . 0.0 111.73 179.076 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 19' ' ' ASP . 90.5 mt -94.19 -18.24 21.92 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.822 179.435 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.456 ' HA ' ' HD3' ' A' ' 25' ' ' PRO . 69.9 m -67.39 135.89 93.29 Favored Pre-proline 0 C--N 1.333 -0.149 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.886 -179.538 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.456 ' HD3' ' HA ' ' A' ' 24' ' ' CYS . 4.4 Cg_exo -74.2 124.81 9.29 Favored 'Trans proline' 0 N--CA 1.459 -0.549 0 C-N-CA 122.924 2.416 . . . . 0.0 112.317 -179.798 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.247 0.965 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.41 179.345 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 1' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo . . . . . 0 N--CA 1.481 0.752 0 N-CA-C 110.004 -0.806 . . . . 0.0 110.004 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 2' ' ' THR . . . . . 0.57 ' HB ' ' HD2' ' B' ' 3' ' ' PRO . 0.2 OUTLIER -158.33 176.28 2.72 Favored Pre-proline 0 C--N 1.316 -0.887 0 N-CA-C 107.11 -1.441 . . . . 0.0 107.11 -178.782 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . 0.57 ' HD2' ' HB ' ' B' ' 2' ' ' THR . 13.9 Cg_endo -58.99 90.86 0.07 OUTLIER 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 121.417 1.411 . . . . 0.0 110.188 179.086 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . 0.44 ' HG2' ' O ' ' B' ' 2' ' ' THR . 41.5 mm-40 -73.19 49.84 0.27 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.466 -0.788 . . . . 0.0 112.767 -176.933 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 5' ' ' MET . . . . . 0.449 ' HG3' ' HG1' ' A' ' 16' ' ' THR . 19.8 ptp -79.54 60.06 3.16 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-O 121.948 0.88 . . . . 0.0 109.103 178.17 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 86.1 mtt-85 -76.26 123.75 26.39 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.769 -1.105 . . . . 0.0 111.929 -178.103 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 69.1 tt0 -99.98 145.28 28.05 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 115.524 -0.762 . . . . 0.0 109.19 178.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 11.5 mmmm -76.23 93.01 3.33 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 178.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . 0.942 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 34.1 mt -78.2 57.47 1.86 Allowed 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 113.057 0.762 . . . . 0.0 113.057 -177.714 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 10' ' ' CYS . . . . . 0.409 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 87.4 m -73.43 121.6 20.78 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.192 178.413 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 58.65 -119.75 19.07 Favored Glycine 0 CA--C 1.52 0.391 0 N-CA-C 114.38 0.512 . . . . 0.0 114.38 179.22 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 12' ' ' HIS . . . . . 0.507 ' O ' ' HG3' ' B' ' 16' ' ' ARG . 16.5 t-160 -50.06 -32.46 15.6 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 -178.33 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 13' ' ' HIS . . . . . 0.614 ' HB3' ' HA ' ' B' ' 9' ' ' LEU . 23.6 m170 -59.36 -41.38 89.12 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 120.875 -0.33 . . . . 0.0 111.026 -179.267 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 14' ' ' PHE . . . . . . . . . . . . . 22.7 t80 -60.91 -44.42 97.19 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.171 0.51 . . . . 0.0 109.688 178.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 60.0 t -58.55 -58.65 5.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.162 -0.926 . . . . 0.0 112.508 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . 0.618 ' HD3' ' N ' ' B' ' 17' ' ' ALA . 0.0 OUTLIER -62.5 -31.92 72.75 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 120.732 -0.387 . . . . 0.0 111.916 -179.123 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . 0.618 ' N ' ' HD3' ' B' ' 16' ' ' ARG . . . -65.77 -47.56 74.79 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.545 179.329 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 18' ' ' LEU . . . . . 0.41 ' O ' ' HB2' ' B' ' 22' ' ' CYS . 57.9 mt -61.19 -49.6 76.52 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.838 179.302 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 19' ' ' VAL . . . . . 0.42 HG22 ' CD1' ' B' ' 27' ' ' TRP . 87.1 t -57.33 -40.98 77.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.789 -179.813 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . 0.602 ' NE ' ' HA ' ' B' ' 20' ' ' ARG . 4.5 tpm_? -80.55 -59.78 2.56 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 -178.737 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 92.2 t -61.14 -44.22 97.88 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 CA-C-N 115.085 -0.962 . . . . 0.0 113.295 -177.132 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 22' ' ' CYS . . . . . 0.41 ' HB2' ' O ' ' B' ' 18' ' ' LEU . 75.9 m -80.67 44.29 0.72 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.83 0.824 . . . . 0.0 111.684 -179.07 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.57 -66.68 3.47 Favored Glycine 0 N--CA 1.447 -0.593 0 CA-C-N 114.916 -1.038 . . . . 0.0 114.172 178.341 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 126.17 -70.17 0.49 Allowed Glycine 0 N--CA 1.449 -0.452 0 N-CA-C 111.173 -0.771 . . . . 0.0 111.173 -178.644 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_exo -61.13 -20.99 70.24 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 122.777 2.318 . . . . 0.0 111.471 178.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . 0.573 ' O ' ' HD3' ' B' ' 26' ' ' ARG . 1.7 tmt_? -66.59 -19.95 65.89 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.863 179.306 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 27' ' ' TRP . . . . . 0.746 ' CE3' ' HA ' ' B' ' 27' ' ' TRP . 0.0 OUTLIER -76.93 51.34 0.78 Allowed 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 122.61 1.195 . . . . 0.0 111.523 179.502 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 12.0 t -108.46 29.23 7.57 Favored 'General case' 0 C--N 1.301 -1.511 0 CA-C-N 113.048 -1.887 . . . . 0.0 108.241 179.474 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -166.18 -61.47 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 114.824 -1.08 . . . . 0.0 110.602 -178.02 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 34.3 mp0 -92.79 -162.42 0.93 Allowed 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 178.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 31' ' ' ALA . . . . . 0.567 ' HA ' ' CD1' ' B' ' 27' ' ' TRP . . . . . . . . 0 C--O 1.249 1.062 0 CA-C-O 117.752 -1.118 . . . . 0.0 109.901 179.202 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . 0.588 ' HB3' HD23 ' A' ' 23' ' ' LEU . . . . . . . . 0 N--CA 1.478 0.966 0 N-CA-C 110.218 -0.29 . . . . 0.0 110.218 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -151.81 129.53 11.58 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 110.311 -0.255 . . . . 0.0 110.311 179.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -79.84 61.53 3.8 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.92 -179.428 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -153.65 -53.33 0.1 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.223 0.535 . . . . 0.0 110.622 179.335 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -176.02 112.88 0.26 Allowed Pre-proline 0 C--N 1.32 -0.69 0 CA-C-N 115.184 -0.916 . . . . 0.0 109.478 179.417 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_exo -61.92 -46.17 14.26 Favored 'Trans proline' 0 C--N 1.334 -0.194 0 C-N-CA 123.443 2.762 . . . . 0.0 113.265 -178.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.59 -44.25 85.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.104 0.478 . . . . 0.0 110.424 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 35.6 ttp180 -63.31 -52.2 62.91 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.431 -0.804 . . . . 0.0 109.807 179.085 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 60.8 t80 -55.22 -49.56 71.67 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.369 -1.287 . . . . 0.0 111.27 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.942 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 72.4 m -64.64 -31.95 73.4 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.986 -0.552 . . . . 0.0 112.173 -179.323 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.409 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 42.6 t -76.89 -54.17 6.93 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.301 0.572 . . . . 0.0 110.952 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 11.0 mp -69.84 -59.61 2.83 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.296 -0.866 . . . . 0.0 112.547 -178.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.2 m -86.06 -45.6 11.27 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.767 0.318 . . . . 0.0 111.827 -178.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.609 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 104.72 149.71 19.69 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.841 -0.695 . . . . 0.0 111.421 -179.349 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.499 ' SG ' HD23 ' A' ' 20' ' ' LEU . 27.0 p -143.29 145.07 32.4 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.137 0.494 . . . . 0.0 111.509 -179.044 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.484 HG23 ' H ' ' A' ' 19' ' ' ASP . 8.8 t -94.95 168.57 10.7 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.43 -179.261 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 5.6 mp0 -49.61 -45.31 48.02 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 122.772 0.429 . . . . 0.0 111.464 -179.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 4.2 tp60 -61.14 -40.01 92.2 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.254 0.55 . . . . 0.0 110.14 179.508 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.484 ' H ' HG23 ' A' ' 16' ' ' THR . 1.7 t70 -60.3 -43.95 95.85 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.584 179.286 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.598 HD21 HD12 ' B' ' 9' ' ' LEU . 1.8 mm? -67.49 -44.32 78.8 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.685 178.731 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 31.1 tp -55.87 -44.57 78.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.61 -179.327 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 21.7 m -60.55 -24.07 65.11 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.489 179.535 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.588 HD23 ' HB3' ' A' ' 1' ' ' ALA . 97.3 mt -85.14 -22.51 28.8 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.304 179.79 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.44 ' HA ' ' HD3' ' A' ' 25' ' ' PRO . 89.2 m -97.29 138.06 21.18 Favored Pre-proline 0 C--N 1.326 -0.426 0 CA-C-O 121.112 0.482 . . . . 0.0 111.738 -179.419 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.44 ' HD3' ' HA ' ' A' ' 24' ' ' CYS . 52.4 Cg_endo -91.33 -175.63 0.77 Allowed 'Trans proline' 0 N--CA 1.446 -1.302 0 C-N-CA 123.084 2.522 . . . . 0.0 111.882 179.525 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 23.7 t80 . . . . . 0 C--O 1.25 1.112 0 CA-C-O 117.915 -1.041 . . . . 0.0 109.549 179.065 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 1' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_exo . . . . . 0 N--CA 1.474 0.351 0 N-CA-C 110.915 -0.456 . . . . 0.0 110.915 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 23.9 m -149.15 129.94 6.98 Favored Pre-proline 0 C--N 1.323 -0.552 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.354 -179.371 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -60.28 124.85 16.04 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.553 2.169 . . . . 0.0 111.565 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . 0.677 ' HB3' ' HB ' ' A' ' 16' ' ' THR . 2.0 tt0 -170.85 -149.74 0.07 Allowed 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 -178.894 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 5' ' ' MET . . . . . 0.572 ' H ' ' CG ' ' B' ' 4' ' ' GLU . 60.8 mtt -79.26 88.22 4.93 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.871 0.367 . . . . 0.0 110.227 179.187 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 65.8 ttt180 -67.13 127.67 33.48 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.179 -0.464 . . . . 0.0 109.931 -179.557 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . 0.403 ' HG2' ' N ' ' B' ' 8' ' ' LYS . 55.2 tt0 -131.5 150.0 52.31 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.106 0.479 . . . . 0.0 110.792 -178.798 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . 0.403 ' N ' ' HG2' ' B' ' 7' ' ' GLU . 41.3 mttm -87.63 96.47 10.43 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 108.031 -1.1 . . . . 0.0 108.031 177.528 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . 0.609 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 3.1 mm? -75.31 55.21 0.76 Allowed 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 -177.975 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 10' ' ' CYS . . . . . 0.435 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 73.4 m -76.24 121.8 23.44 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.697 179.018 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 55.26 -116.96 7.54 Favored Glycine 0 CA--C 1.52 0.4 0 CA-C-N 116.074 -0.512 . . . . 0.0 114.321 178.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 19.5 t-160 -50.89 -32.62 21.08 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 112.794 0.665 . . . . 0.0 112.794 -178.627 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 13' ' ' HIS . . . . . 0.589 ' HB3' ' HA ' ' B' ' 9' ' ' LEU . 20.7 m170 -59.48 -46.25 89.33 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.892 -179.273 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 14' ' ' PHE . . . . . . . . . . . . . 44.8 t80 -59.97 -40.88 90.59 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.076 0.465 . . . . 0.0 109.948 179.135 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 46.3 t -59.09 -55.35 24.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.46 -0.791 . . . . 0.0 111.439 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . 0.415 ' HG3' ' O ' ' B' ' 13' ' ' HIS . 2.8 ptm180 -63.18 -38.04 89.59 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.533 -179.484 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . 0.521 ' HB3' ' HG ' ' A' ' 20' ' ' LEU . . . -64.24 -47.46 79.54 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.714 0.293 . . . . 0.0 110.929 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 1.5 tt -60.46 -51.43 69.51 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.688 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 19' ' ' VAL . . . . . 0.462 ' HA ' ' HB3' ' B' ' 27' ' ' TRP . 67.8 t -59.85 -38.19 75.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -179.511 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . 0.769 ' NE ' ' HA ' ' B' ' 20' ' ' ARG . 0.3 OUTLIER -83.24 -54.83 4.71 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -178.326 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 60.9 t -64.14 -50.72 75.66 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.554 -178.458 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 22' ' ' CYS . . . . . 0.531 ' HB3' ' OG ' ' B' ' 28' ' ' SER . 60.8 m -86.11 43.1 1.03 Allowed 'General case' 0 C--O 1.217 -0.616 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 178.541 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -69.76 135.97 27.13 Favored Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.428 -0.891 . . . . 0.0 114.179 -178.198 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -169.23 -132.71 1.48 Allowed Glycine 0 N--CA 1.449 -0.482 0 N-CA-C 109.726 -1.349 . . . . 0.0 109.726 179.305 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -59.99 -39.49 70.23 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.282 1.988 . . . . 0.0 109.801 177.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . 0.774 ' HG3' ' HB1' ' B' ' 31' ' ' ALA . 6.8 mmm-85 -138.76 -62.75 0.55 Allowed 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 107.286 -1.375 . . . . 0.0 107.286 177.505 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 27' ' ' TRP . . . . . 0.621 ' HZ3' ' H ' ' B' ' 31' ' ' ALA . 0.0 OUTLIER -168.57 -105.83 0.01 OUTLIER 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.336 177.172 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 28' ' ' SER . . . . . 0.828 ' HB3' ' HD2' ' A' ' 25' ' ' PRO . 58.6 m -164.11 49.73 0.13 Allowed 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 113.063 0.764 . . . . 0.0 113.063 179.805 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 2.5 p -146.97 12.93 1.12 Allowed 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 120.986 0.422 . . . . 0.0 111.121 179.063 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 30' ' ' GLU . . . . . 0.46 ' HB3' ' CH2' ' B' ' 27' ' ' TRP . 4.1 tt0 178.37 -41.71 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 107.353 -1.351 . . . . 0.0 107.353 -179.766 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 31' ' ' ALA . . . . . 0.774 ' HB1' ' HG3' ' B' ' 26' ' ' ARG . . . . . . . . 0 N--CA 1.442 -0.834 0 CA-C-N 113.173 -1.83 . . . . 0.0 107.621 179.418 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . 0.566 ' HB2' ' HE1' ' A' ' 9' ' ' TYR . . . . . . . . 0 N--CA 1.48 1.074 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . 0.509 ' H ' ' HB1' ' A' ' 1' ' ' ALA . . . -153.83 133.92 13.26 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 179.575 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -173.32 122.26 0.37 Allowed 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 -179.867 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -76.23 47.96 0.49 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.138 0.494 . . . . 0.0 111.507 -179.378 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -176.42 113.17 0.25 Allowed Pre-proline 0 C--N 1.327 -0.398 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_exo -61.01 -42.17 38.8 Favored 'Trans proline' 0 CA--C 1.526 0.077 0 C-N-CA 123.306 2.671 . . . . 0.0 113.203 -178.778 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.3 -44.45 95.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.395 0.617 . . . . 0.0 110.142 179.642 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 17.8 tpt180 -66.5 -48.86 68.48 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.617 179.091 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . 0.566 ' HE1' ' HB2' ' A' ' 1' ' ' ALA . 23.6 t80 -55.52 -50.97 68.57 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 114.203 -1.362 . . . . 0.0 111.354 -179.695 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.701 ' O ' ' HA2' ' A' ' 14' ' ' GLY . 41.6 m -69.8 -16.04 63.22 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.796 179.99 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.435 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 24.0 t -85.3 -53.81 4.99 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.764 0.792 . . . . 0.0 109.605 178.821 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 98.6 mt -66.88 -60.38 2.71 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 114.635 -1.166 . . . . 0.0 111.642 -179.608 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 24.8 m -82.08 -42.42 19.23 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.425 -179.679 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.701 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 91.72 142.89 11.14 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.762 -0.732 . . . . 0.0 111.421 -178.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.634 ' SG ' HD21 ' A' ' 20' ' ' LEU . 29.9 p -141.06 151.5 44.08 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.579 0.228 . . . . 0.0 110.438 -179.117 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.677 ' HB ' ' HB3' ' B' ' 4' ' ' GLU . 27.8 p -76.63 170.59 16.14 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.607 -179.278 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 84.9 mm-40 -62.15 -38.0 87.34 Favored 'General case' 0 C--O 1.234 0.245 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 178.509 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 90.7 mm-40 -62.78 -37.5 86.9 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 115.397 -0.82 . . . . 0.0 109.147 177.429 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.618 ' CB ' ' HB2' ' A' ' 15' ' ' CYS . 91.8 m-20 -59.67 -43.41 94.0 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.342 -0.844 . . . . 0.0 109.022 178.355 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.634 HD21 ' SG ' ' A' ' 15' ' ' CYS . 1.8 mm? -61.25 -42.13 98.1 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 177.299 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.558 ' HA ' ' SG ' ' A' ' 24' ' ' CYS . 32.1 tp -57.98 -40.46 80.73 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.54 179.76 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 3.9 m -63.12 -22.17 66.68 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.27 0.557 . . . . 0.0 110.823 179.233 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.423 ' HA ' HD21 ' A' ' 23' ' ' LEU . 93.4 mt -82.64 -21.4 35.06 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.45 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.558 ' SG ' ' HA ' ' A' ' 21' ' ' LEU . 3.1 m -69.31 122.99 87.36 Favored Pre-proline 0 CA--C 1.53 0.18 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 -179.947 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.828 ' HD2' ' HB3' ' B' ' 28' ' ' SER . 6.3 Cg_exo -73.58 121.07 6.81 Favored 'Trans proline' 0 N--CA 1.459 -0.508 0 C-N-CA 122.885 2.39 . . . . 0.0 112.12 -179.781 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.251 1.175 0 CA-C-O 117.457 -1.258 . . . . 0.0 109.533 179.467 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 1' ' ' PRO . . . . . 0.462 ' HD2' ' OG1' ' A' ' 22' ' ' THR . 5.1 Cg_exo . . . . . 0 N--CA 1.479 0.635 0 N-CA-C 110.75 -0.519 . . . . 0.0 110.75 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 2' ' ' THR . . . . . 0.552 ' HB ' ' HG3' ' B' ' 4' ' ' GLU . 1.3 p -119.52 136.63 24.77 Favored Pre-proline 0 C--N 1.322 -0.619 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.336 -179.582 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -82.47 49.45 3.11 Favored 'Trans proline' 0 N--CA 1.461 -0.41 0 C-N-CA 122.945 2.43 . . . . 0.0 112.54 -179.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . 0.552 ' HG3' ' HB ' ' B' ' 2' ' ' THR . 25.7 mt-10 -85.18 -158.23 0.36 Allowed 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.029 -0.987 . . . . 0.0 109.685 179.344 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 5' ' ' MET . . . . . . . . . . . . . 16.9 tpt -82.23 67.41 8.23 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 177.647 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 42.0 mtt180 -56.62 118.26 4.68 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.525 -0.762 . . . . 0.0 111.855 -178.396 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . 0.521 ' OE2' ' HG2' ' B' ' 8' ' ' LYS . 4.7 tp10 -107.9 158.93 16.92 Favored 'General case' 0 N--CA 1.44 -0.929 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 178.767 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . 0.521 ' HG2' ' OE2' ' B' ' 7' ' ' GLU . 11.7 mmtm -82.72 97.8 8.75 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-O 121.372 0.605 . . . . 0.0 110.811 -177.713 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . 0.723 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 3.3 mm? -83.37 58.29 4.43 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.573 179.545 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 10' ' ' CYS . . . . . 0.523 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 71.9 m -65.07 130.95 45.24 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.857 -0.611 . . . . 0.0 112.041 -179.701 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 53.94 -122.23 22.13 Favored Glycine 0 C--N 1.332 0.325 0 CA-C-N 115.772 -0.649 . . . . 0.0 114.461 178.178 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 17.2 t-160 -52.55 -29.28 24.68 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 123.005 0.522 . . . . 0.0 112.17 -178.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 13' ' ' HIS . . . . . 0.559 ' O ' ' HG3' ' B' ' 16' ' ' ARG . 29.4 m170 -59.58 -41.86 91.19 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.736 -0.211 . . . . 0.0 110.49 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 14' ' ' PHE . . . . . 0.48 ' CZ ' ' HB2' ' A' ' 6' ' ' PRO . 8.1 t80 -62.31 -47.51 83.94 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.091 0.472 . . . . 0.0 109.931 178.387 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 56.0 t -55.58 -53.31 37.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.634 -179.645 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . 0.559 ' HG3' ' O ' ' B' ' 13' ' ' HIS . 0.0 OUTLIER -63.48 -39.03 93.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.422 -179.525 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.66 -52.91 47.97 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.557 0.218 . . . . 0.0 111.517 -179.681 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 18' ' ' LEU . . . . . 0.665 HD12 ' SG ' ' A' ' 24' ' ' CYS . 38.0 tp -57.78 -53.75 54.67 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.825 -179.329 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 19' ' ' VAL . . . . . 0.493 HG12 ' HA ' ' B' ' 26' ' ' ARG . 85.0 t -60.35 -42.85 92.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 -178.997 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . 0.692 ' HA ' HH11 ' B' ' 20' ' ' ARG . 2.4 mmt-85 -72.0 -47.98 48.12 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 113.159 0.8 . . . . 0.0 113.159 -178.921 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 76.6 t -64.74 -46.81 91.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 N-CA-C 112.197 0.443 . . . . 0.0 112.197 -178.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 89.5 m -69.34 -40.54 77.48 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.941 -0.304 . . . . 0.0 111.555 -179.379 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 119.78 157.36 10.25 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 119.979 -1.105 . . . . 0.0 113.259 179.243 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 94.49 154.92 31.31 Favored Glycine 0 N--CA 1.446 -0.635 0 C-N-CA 120.916 -0.659 . . . . 0.0 112.788 179.596 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -59.7 -34.46 96.21 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.723 2.282 . . . . 0.0 110.854 179.563 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . 0.493 ' HA ' HG12 ' B' ' 19' ' ' VAL . 49.5 mtp180 -141.12 -172.49 3.5 Favored 'General case' 0 CA--C 1.498 -1.053 0 CA-C-N 115.009 -0.996 . . . . 0.0 108.426 178.335 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 27' ' ' TRP . . . . . 0.945 ' HB3' ' HB3' ' B' ' 31' ' ' ALA . 0.0 OUTLIER -88.27 54.52 3.09 Favored 'General case' 0 N--CA 1.432 -1.342 0 N-CA-C 107.575 -1.269 . . . . 0.0 107.575 176.791 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 40.2 m -63.42 59.35 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 114.729 -1.123 . . . . 0.0 112.99 -178.607 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 29' ' ' THR . . . . . 0.442 ' HB ' ' CZ3' ' B' ' 27' ' ' TRP . 97.4 m -168.31 -36.54 0.02 OUTLIER 'General case' 0 C--N 1.318 -0.793 0 C-N-CA 124.369 1.068 . . . . 0.0 108.298 179.566 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -134.51 15.75 3.7 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.333 -0.848 . . . . 0.0 111.134 -179.395 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 31' ' ' ALA . . . . . 0.945 ' HB3' ' HB3' ' B' ' 27' ' ' TRP . . . . . . . . 0 C--O 1.247 0.95 0 CA-C-O 118.234 -0.889 . . . . 0.0 109.833 -179.401 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . 0.555 ' HA ' ' O ' ' A' ' 23' ' ' LEU . . . . . . . . 0 N--CA 1.476 0.833 0 N-CA-C 110.265 -0.272 . . . . 0.0 110.265 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -82.31 56.11 3.12 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.157 -179.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -174.0 133.63 0.44 Allowed 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 3.6 p -56.36 -40.3 74.29 Favored 'General case' 0 C--N 1.319 -0.726 0 O-C-N 123.809 0.693 . . . . 0.0 111.374 -179.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -151.51 85.66 4.85 Favored Pre-proline 0 C--N 1.319 -0.74 0 CA-C-O 122.288 1.042 . . . . 0.0 109.517 178.451 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.48 ' HB2' ' CZ ' ' B' ' 14' ' ' PHE . 23.4 Cg_exo -59.24 -38.97 82.54 Favored 'Trans proline' 0 C--N 1.328 -0.525 0 C-N-CA 123.999 3.132 . . . . 0.0 112.646 -179.061 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.19 -43.92 83.12 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.972 0.415 . . . . 0.0 110.75 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -67.87 -48.93 64.7 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.095 179.505 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 33.2 t80 -56.52 -52.99 62.68 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 114.936 -1.029 . . . . 0.0 111.306 -179.702 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.723 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 22.5 m -65.46 -23.9 67.03 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.036 -0.529 . . . . 0.0 112.32 -179.73 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.523 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 53.7 t -82.12 -52.89 6.55 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.413 0.625 . . . . 0.0 110.598 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 15.3 tp -69.71 -63.39 1.08 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.041 -0.982 . . . . 0.0 112.182 -178.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 36.3 t -81.3 -33.97 32.27 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.395 -178.682 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.69 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 88.6 158.47 33.82 Favored Glycine 0 N--CA 1.443 -0.887 0 C-N-CA 120.57 -0.824 . . . . 0.0 111.156 -178.541 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.618 ' SG ' HD23 ' A' ' 20' ' ' LEU . 26.5 p -151.04 166.8 29.61 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.818 0.309 . . . . 0.0 110.795 -179.204 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.603 ' O ' HD22 ' A' ' 20' ' ' LEU . 0.2 OUTLIER -121.95 -169.97 1.97 Allowed 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 116.444 -0.343 . . . . 0.0 111.323 -179.17 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 23.8 pt20 -58.4 -51.71 68.67 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -178.399 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.519 ' HB2' ' OG1' ' B' ' 2' ' ' THR . 95.4 mm-40 -63.18 -35.96 82.04 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 43.7 m-20 -58.68 -47.0 86.01 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.033 178.461 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.618 HD23 ' SG ' ' A' ' 15' ' ' CYS . 1.4 mm? -66.19 -44.68 83.28 Favored 'General case' 0 CA--C 1.522 -0.112 0 CA-C-O 120.878 0.37 . . . . 0.0 110.488 178.86 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 31.0 tp -55.36 -53.36 57.2 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.044 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.462 ' OG1' ' HD2' ' B' ' 1' ' ' PRO . 35.4 p -64.64 -12.05 41.84 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.093 -0.503 . . . . 0.0 112.24 179.919 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.661 HD21 HD13 ' B' ' 18' ' ' LEU . 24.6 tp -78.66 -28.74 45.44 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 179.688 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.665 ' SG ' HD12 ' B' ' 18' ' ' LEU . 93.2 m -84.34 139.18 38.79 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.672 179.563 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 24' ' ' CYS . 16.0 Cg_exo -67.99 127.65 16.4 Favored 'Trans proline' 0 N--CA 1.461 -0.437 0 C-N-CA 123.017 2.478 . . . . 0.0 111.882 -179.855 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 23.0 t80 . . . . . 0 C--O 1.248 1.011 0 CA-C-N 115.334 -0.848 . . . . 0.0 108.806 179.941 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 1' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo . . . . . 0 N--CA 1.481 0.781 0 N-CA-C 109.615 -0.956 . . . . 0.0 109.615 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 2' ' ' THR . . . . . 0.564 ' HB ' ' HD2' ' B' ' 3' ' ' PRO . 0.1 OUTLIER -153.89 179.04 1.39 Allowed Pre-proline 0 C--N 1.314 -0.963 0 CA-C-N 114.159 -1.382 . . . . 0.0 107.636 -178.385 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . 0.564 ' HD2' ' HB ' ' B' ' 2' ' ' THR . 30.2 Cg_endo -64.74 73.97 0.21 Allowed 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 121.953 1.769 . . . . 0.0 111.531 179.508 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -70.57 36.33 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 124.233 1.013 . . . . 0.0 112.439 -178.637 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 5' ' ' MET . . . . . 0.471 ' H ' ' C ' ' B' ' 3' ' ' PRO . 21.9 ptm -64.23 115.35 4.93 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.289 179.548 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 6' ' ' ARG . . . . . 0.624 ' HA ' ' O ' ' A' ' 15' ' ' CYS . 19.8 mmm180 -85.38 125.96 33.39 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.82 -179.387 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 77.4 tt0 -129.58 144.94 51.49 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 178.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . 0.444 ' HA ' ' O ' ' A' ' 10' ' ' CYS . 24.5 mmtp -82.47 104.68 12.93 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 179.383 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . 0.766 ' HB2' ' SG ' ' A' ' 10' ' ' CYS . 6.5 mp -81.12 52.04 1.71 Allowed 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 -179.158 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 71.0 m -72.56 121.32 19.5 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.172 178.856 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 61.08 -120.94 24.89 Favored Glycine 0 CA--C 1.522 0.47 0 N-CA-C 114.417 0.527 . . . . 0.0 114.417 179.168 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 13.5 t-80 -50.18 -33.36 18.95 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 113.589 0.959 . . . . 0.0 113.589 -178.082 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 13' ' ' HIS . . . . . 0.576 ' CB ' ' HA ' ' B' ' 9' ' ' LEU . 24.3 m170 -58.34 -41.43 84.62 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.914 -0.315 . . . . 0.0 111.024 -179.117 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 14' ' ' PHE . . . . . 0.668 ' HA ' HD23 ' B' ' 9' ' ' LEU . 22.5 t80 -62.63 -45.09 94.44 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.014 0.435 . . . . 0.0 110.127 179.321 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 51.4 t -59.02 -58.78 5.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.407 -0.815 . . . . 0.0 112.119 -179.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . 0.402 ' NH2' HD11 ' B' ' 9' ' ' LEU . 0.0 OUTLIER -59.53 -39.79 85.08 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.872 -179.104 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . 0.498 ' HB3' ' CD1' ' A' ' 20' ' ' LEU . . . -66.01 -43.27 88.17 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.967 -0.293 . . . . 0.0 111.069 -179.933 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 18' ' ' LEU . . . . . 0.445 ' HB3' ' HZ2' ' B' ' 27' ' ' TRP . 9.7 mt -60.01 -56.3 23.43 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.826 179.802 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 19' ' ' VAL . . . . . 0.659 ' O ' ' HA3' ' B' ' 23' ' ' GLY . 7.8 t -65.93 -29.04 45.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -178.569 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . 0.571 ' NE ' ' HA ' ' B' ' 20' ' ' ARG . 3.3 tpm_? -80.12 -59.79 2.58 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 119.906 -0.718 . . . . 0.0 111.512 -179.828 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 60.2 t -65.19 -50.28 74.68 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 CA-C-N 115.209 -0.905 . . . . 0.0 111.739 -178.434 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 56.4 m -101.97 37.28 1.88 Allowed 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.926 0.393 . . . . 0.0 110.635 -179.669 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . 0.659 ' HA3' ' O ' ' B' ' 19' ' ' VAL . . . -127.65 121.32 3.77 Favored Glycine 0 N--CA 1.445 -0.716 0 C-N-CA 120.486 -0.864 . . . . 0.0 112.076 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 166.02 -111.76 0.47 Allowed Glycine 0 N--CA 1.443 -0.898 0 N-CA-C 110.86 -0.896 . . . . 0.0 110.86 -179.635 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -63.07 -31.47 76.0 Favored 'Trans proline' 0 N--CA 1.465 -0.194 0 C-N-CA 122.574 2.182 . . . . 0.0 111.939 179.145 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 11.9 mmm180 -144.82 149.56 35.63 Favored 'General case' 0 CA--C 1.498 -1.033 0 CA-C-O 121.739 0.78 . . . . 0.0 111.034 179.741 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 27' ' ' TRP . . . . . 0.881 ' HB3' ' HB2' ' B' ' 31' ' ' ALA . 0.0 OUTLIER -159.18 52.22 0.38 Allowed 'General case' 0 C--N 1.305 -1.344 0 CA-C-N 113.365 -1.743 . . . . 0.0 108.06 178.837 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 28' ' ' SER . . . . . 0.448 ' HG ' ' C ' ' A' ' 26' ' ' TYR . 73.8 m -58.2 68.48 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 114.056 1.132 . . . . 0.0 114.056 -178.833 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 29' ' ' THR . . . . . 0.414 ' N ' ' O ' ' B' ' 27' ' ' TRP . 97.0 m -173.55 -38.95 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 179.17 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 30' ' ' GLU . . . . . 0.544 ' HB3' ' CD1' ' B' ' 27' ' ' TRP . 40.6 tt0 -119.65 -31.3 4.59 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 113.765 -1.562 . . . . 0.0 110.422 -179.492 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 31' ' ' ALA . . . . . 0.881 ' HB2' ' HB3' ' B' ' 27' ' ' TRP . . . . . . . . 0 C--O 1.248 0.995 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.813 -178.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.067 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -157.51 146.1 19.44 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 179.685 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.447 ' HB1' ' HB2' ' A' ' 9' ' ' TYR . . . -79.92 60.01 3.37 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.055 0.455 . . . . 0.0 111.104 -179.811 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 7.4 p -77.37 50.8 0.81 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.597 -179.884 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . 0.489 ' HB3' ' HB2' ' A' ' 8' ' ' ARG . 32.0 t-20 -171.64 111.83 0.4 Allowed Pre-proline 0 C--N 1.328 -0.363 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -59.28 -47.39 17.37 Favored 'Trans proline' 0 C--N 1.334 -0.207 0 C-N-CA 123.371 2.714 . . . . 0.0 113.631 -178.675 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.14 -43.32 95.8 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.347 0.594 . . . . 0.0 110.204 179.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.629 ' HA ' ' HE ' ' A' ' 8' ' ' ARG . 1.1 mmp_? -67.72 -47.59 68.92 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.956 179.147 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . 0.447 ' HB2' ' HB1' ' A' ' 3' ' ' ALA . 9.7 t80 -58.04 -53.4 58.72 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.891 -179.88 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.766 ' SG ' ' HB2' ' B' ' 9' ' ' LEU . 9.3 t -69.42 -18.4 63.74 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 112.08 0.4 . . . . 0.0 112.08 -178.41 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 26.9 t -85.51 -51.28 6.62 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.798 0.808 . . . . 0.0 109.879 178.817 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.417 ' HA ' HD13 ' A' ' 12' ' ' LEU . 14.9 tp -66.06 -62.5 1.45 Allowed 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 114.559 -1.2 . . . . 0.0 111.284 -179.798 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 6.8 m -85.07 -45.3 12.23 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.39 -179.165 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.731 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 99.93 144.19 15.7 Favored Glycine 0 N--CA 1.452 -0.264 0 N-CA-C 111.2 -0.76 . . . . 0.0 111.2 -179.077 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.624 ' O ' ' HA ' ' B' ' 6' ' ' ARG . 24.0 p -134.69 -151.03 0.41 Allowed 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 120.749 -0.38 . . . . 0.0 111.303 -178.475 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.575 HG21 ' H ' ' A' ' 19' ' ' ASP . 13.1 t -158.9 176.99 11.63 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -179.099 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 5.7 mp0 -56.62 -45.01 81.76 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 123.289 0.368 . . . . 0.0 110.823 -179.546 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -64.23 -41.61 96.93 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.965 0.412 . . . . 0.0 109.956 179.621 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.575 ' H ' HG21 ' A' ' 16' ' ' THR . 0.1 OUTLIER -58.73 -38.83 79.21 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.278 -0.873 . . . . 0.0 110.154 178.959 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.498 ' CD1' ' HB3' ' B' ' 17' ' ' ALA . 77.5 mt -75.7 -47.26 26.93 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.911 179.292 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 36.3 tp -52.08 -51.96 54.28 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.734 -0.666 . . . . 0.0 112.158 -178.581 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 15.3 t -63.48 -13.03 36.46 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 112.245 0.461 . . . . 0.0 112.245 -179.445 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 39.8 tp -102.73 -16.83 15.87 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.035 -179.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.47 ' HA ' ' HD3' ' A' ' 25' ' ' PRO . 87.4 m -80.59 135.0 53.35 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 120.939 0.399 . . . . 0.0 112.046 -179.092 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.47 ' HD3' ' HA ' ' A' ' 24' ' ' CYS . 4.5 Cg_endo -82.84 134.02 7.08 Favored 'Trans proline' 0 N--CA 1.449 -1.116 0 C-N-CA 123.204 2.603 . . . . 0.0 111.361 178.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.448 ' C ' ' HG ' ' B' ' 28' ' ' SER . 22.4 t80 . . . . . 0 C--O 1.247 0.947 0 CA-C-O 118.14 -0.933 . . . . 0.0 109.802 179.648 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 1' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo . . . . . 0 N--CA 1.486 1.071 0 N-CA-C 110.482 -0.622 . . . . 0.0 110.482 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 2' ' ' THR . . . . . 0.562 ' HB ' ' HD2' ' B' ' 3' ' ' PRO . 0.1 OUTLIER -168.93 177.73 1.14 Allowed Pre-proline 0 C--N 1.316 -0.861 0 N-CA-C 106.256 -1.757 . . . . 0.0 106.256 -178.761 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . 0.562 ' HD2' ' HB ' ' B' ' 2' ' ' THR . 7.2 Cg_endo -53.09 96.89 0.04 OUTLIER 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 121.408 1.405 . . . . 0.0 108.76 178.689 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -58.77 127.35 31.77 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-O 122.615 1.198 . . . . 0.0 113.525 -175.006 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 5' ' ' MET . . . . . . . . . . . . . 22.1 ptt? -169.84 46.15 0.03 OUTLIER 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 112.457 -2.156 . . . . 0.0 105.786 179.464 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 6' ' ' ARG . . . . . 0.422 ' HA ' HG21 ' A' ' 16' ' ' THR . 21.2 mtp85 -56.38 118.62 4.94 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 113.08 -1.873 . . . . 0.0 112.082 -177.137 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 74.2 tt0 -94.15 142.08 27.81 Favored 'General case' 0 N--CA 1.444 -0.738 0 N-CA-C 108.374 -0.973 . . . . 0.0 108.374 178.151 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 18.0 mmtp -76.06 101.54 5.33 Favored 'General case' 0 C--N 1.315 -0.923 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 179.469 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . 0.994 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 8.4 mp -80.91 51.9 1.64 Allowed 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 112.57 0.581 . . . . 0.0 112.57 -178.772 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 73.5 m -70.67 120.21 15.95 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.061 178.645 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 61.65 -120.24 21.55 Favored Glycine 0 CA--C 1.523 0.545 0 N-CA-C 114.542 0.577 . . . . 0.0 114.542 179.207 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 13.3 t-80 -49.56 -33.99 16.39 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 113.751 1.019 . . . . 0.0 113.751 -177.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 13' ' ' HIS . . . . . 0.631 ' CB ' ' HA ' ' B' ' 9' ' ' LEU . 25.7 m170 -58.28 -41.27 84.02 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.795 -0.362 . . . . 0.0 110.949 -179.252 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 14' ' ' PHE . . . . . 0.562 ' HA ' ' CD2' ' B' ' 9' ' ' LEU . 31.7 t80 -62.51 -46.39 88.65 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.898 0.38 . . . . 0.0 110.074 178.866 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 62.1 t -55.5 -57.73 6.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.571 -0.741 . . . . 0.0 112.05 -179.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.08 -40.18 92.71 Favored 'General case' 0 N--CA 1.464 0.226 0 N-CA-C 112.342 0.497 . . . . 0.0 112.342 -178.93 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . 0.437 ' HB1' ' HG ' ' A' ' 20' ' ' LEU . . . -70.05 -46.82 64.19 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.612 -179.601 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 18' ' ' LEU . . . . . 0.48 ' HG ' ' CD1' ' B' ' 27' ' ' TRP . 57.7 tp -56.76 -52.17 66.05 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.836 -179.877 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 19' ' ' VAL . . . . . 0.541 ' HA ' ' O ' ' B' ' 26' ' ' ARG . 89.7 t -62.47 -48.14 89.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.824 -0.625 . . . . 0.0 112.252 -179.659 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . 0.881 ' HA ' ' HE ' ' B' ' 20' ' ' ARG . 0.0 OUTLIER -70.52 -40.85 73.25 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 114.031 1.123 . . . . 0.0 114.031 -178.322 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 21' ' ' VAL . . . . . 0.454 HG22 ' HG3' ' A' ' 17' ' ' GLN . 71.3 t -73.11 -46.77 50.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -178.233 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 22' ' ' CYS . . . . . 0.403 ' HB3' ' OG ' ' B' ' 28' ' ' SER . 80.6 m -75.99 -36.04 59.35 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 -178.225 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -161.33 -127.24 0.87 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 119.294 -1.431 . . . . 0.0 113.993 -179.243 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -146.11 -64.49 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 121.179 -0.534 . . . . 0.0 112.143 -179.465 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 25' ' ' PRO . . . . . 0.598 ' HB2' ' HB1' ' B' ' 31' ' ' ALA . 23.9 Cg_exo -63.15 -41.95 25.45 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 122.181 1.921 . . . . 0.0 110.515 179.053 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . 0.646 ' HB2' ' HB2' ' B' ' 31' ' ' ALA . 12.0 mmt85 -140.25 -90.92 0.17 Allowed 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 115.195 -0.911 . . . . 0.0 109.376 177.723 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 27' ' ' TRP . . . . . 0.48 ' CD1' ' HG ' ' B' ' 18' ' ' LEU . 0.0 OUTLIER -156.25 -86.62 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 118.316 0.507 . . . . 0.0 111.93 179.731 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 28' ' ' SER . . . . . 0.403 ' OG ' ' HB3' ' B' ' 22' ' ' CYS . 55.7 m -154.56 58.15 0.69 Allowed 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 113.551 0.945 . . . . 0.0 113.551 -178.251 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 4.3 t 179.9 -54.72 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.361 0 O-C-N 122.424 -0.172 . . . . 0.0 111.122 177.696 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -85.73 -39.23 17.4 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 178.485 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 31' ' ' ALA . . . . . 0.646 ' HB2' ' HB2' ' B' ' 26' ' ' ARG . . . . . . . . 0 C--O 1.252 1.204 0 CA-C-O 116.739 -1.601 . . . . 0.0 107.221 179.563 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.03 0 N-CA-C 110.416 -0.216 . . . . 0.0 110.416 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -70.42 144.71 51.44 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.706 179.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -164.78 128.6 2.44 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 5.7 t -56.44 -33.13 65.57 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.361 -179.48 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -178.0 108.68 0.22 Allowed Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.663 178.719 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.408 ' HB2' ' CZ ' ' B' ' 14' ' ' PHE . 16.9 Cg_exo -64.33 -44.88 10.68 Favored 'Trans proline' 0 C--N 1.333 -0.283 0 C-N-CA 123.421 2.747 . . . . 0.0 113.179 -179.053 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.71 -42.07 78.51 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.051 0.453 . . . . 0.0 110.527 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 13.9 ttm180 -61.7 -54.45 42.41 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.012 179.367 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 35.3 t80 -57.57 -49.16 77.3 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.627 -1.17 . . . . 0.0 111.295 -179.705 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.994 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 54.3 m -65.23 -27.39 68.63 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.966 -0.561 . . . . 0.0 112.243 -179.365 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 52.2 t -80.83 -52.7 7.2 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.556 0.693 . . . . 0.0 110.23 179.516 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 90.8 mt -64.25 -57.9 8.1 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 114.891 -1.05 . . . . 0.0 112.44 -179.175 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 35.5 t -93.3 -44.35 8.35 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 111.725 0.269 . . . . 0.0 111.725 -179.006 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.659 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 105.26 157.82 22.94 Favored Glycine 0 N--CA 1.452 -0.26 0 N-CA-C 110.924 -0.87 . . . . 0.0 110.924 -178.814 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.513 ' HB2' ' CB ' ' A' ' 19' ' ' ASP . 25.7 p -151.28 159.75 44.18 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 117.343 0.571 . . . . 0.0 112.513 -178.295 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.508 ' O ' HD23 ' A' ' 20' ' ' LEU . 48.2 p -106.73 -174.41 2.53 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.242 179.583 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.454 ' HG3' HG22 ' B' ' 21' ' ' VAL . 54.9 tt0 -57.42 -48.97 77.73 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 111.933 0.346 . . . . 0.0 111.933 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 60.9 tp60 -59.55 -41.96 91.29 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.109 0.481 . . . . 0.0 109.884 179.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.627 ' O ' ' HG ' ' A' ' 23' ' ' LEU . 34.2 m-20 -57.14 -44.94 83.88 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.274 -0.875 . . . . 0.0 109.629 179.061 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.508 HD23 ' O ' ' A' ' 16' ' ' THR . 3.6 mm? -59.65 -48.37 81.93 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-O 120.768 0.318 . . . . 0.0 110.527 178.228 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 8.9 tt -55.62 -47.46 76.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.68 179.472 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 8.3 m -60.59 -25.21 66.05 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.331 -0.85 . . . . 0.0 111.816 179.605 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.627 ' HG ' ' O ' ' A' ' 19' ' ' ASP . 96.6 mt -73.09 -30.6 63.79 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.272 179.324 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 7.4 m -74.74 165.76 51.05 Favored Pre-proline 0 C--N 1.326 -0.419 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.034 178.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -47.87 112.07 0.52 Allowed 'Trans proline' 0 C--N 1.353 0.763 0 C-N-CA 122.669 2.246 . . . . 0.0 112.594 -178.796 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 24.3 t80 . . . . . 0 C--O 1.243 0.715 0 N-CA-C 107.713 -1.217 . . . . 0.0 107.713 -179.427 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 1' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo . . . . . 0 N--CA 1.485 0.98 0 N-CA-C 110.688 -0.543 . . . . 0.0 110.688 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 2' ' ' THR . . . . . 0.552 ' HB ' ' HD2' ' B' ' 3' ' ' PRO . 0.6 OUTLIER -155.72 173.33 4.99 Favored Pre-proline 0 C--N 1.318 -0.782 0 CA-C-N 115.084 -0.962 . . . . 0.0 108.671 -178.905 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . 0.552 ' HD2' ' HB ' ' B' ' 2' ' ' THR . 56.6 Cg_endo -70.62 56.05 1.71 Allowed 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.389 2.059 . . . . 0.0 112.588 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . 0.573 ' HB2' HH12 ' B' ' 6' ' ' ARG . 2.7 mp0 -68.07 131.43 45.41 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.18 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 5' ' ' MET . . . . . 0.425 ' HB2' ' HE2' ' B' ' 5' ' ' MET . 49.6 ttm -66.07 112.99 4.15 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.924 0.392 . . . . 0.0 109.964 179.255 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 6' ' ' ARG . . . . . 0.746 ' HD2' ' HA ' ' A' ' 15' ' ' CYS . 47.0 mmt-85 -79.48 125.78 30.01 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.307 179.877 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -91.68 131.58 36.97 Favored 'General case' 0 N--CA 1.446 -0.635 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 -179.95 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -80.31 86.4 5.68 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 179.365 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . 0.967 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 14.6 mt -74.11 55.1 0.56 Allowed 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 -176.891 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 10' ' ' CYS . . . . . 0.412 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 73.8 m -74.24 117.36 15.96 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 177.878 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 63.46 -121.76 24.92 Favored Glycine 0 CA--C 1.521 0.459 0 C-N-CA 121.157 -0.544 . . . . 0.0 113.78 179.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 23.6 t-160 -51.79 -32.08 29.71 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 112.825 0.676 . . . . 0.0 112.825 -178.706 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 13' ' ' HIS . . . . . 0.683 ' CB ' ' HA ' ' B' ' 9' ' ' LEU . 52.0 m170 -57.57 -39.76 77.43 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 120.437 -0.505 . . . . 0.0 110.74 -179.387 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 14' ' ' PHE . . . . . 0.576 ' CA ' ' HB3' ' B' ' 9' ' ' LEU . 34.4 t80 -62.01 -44.34 96.92 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.331 0.586 . . . . 0.0 109.823 178.766 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 55.1 t -62.02 -49.23 84.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.121 -0.945 . . . . 0.0 111.76 179.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . 0.643 ' HG2' ' HA ' ' B' ' 13' ' ' HIS . 19.2 ptt180 -62.51 -44.99 95.02 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.731 -178.885 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . 0.511 ' N ' ' HG3' ' B' ' 16' ' ' ARG . . . -65.54 -41.28 93.2 Favored 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 120.925 -0.31 . . . . 0.0 111.021 -179.854 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 63.6 tp -59.35 -54.72 43.51 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.175 179.89 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 19' ' ' VAL . . . . . 0.4 HG23 ' O ' ' B' ' 16' ' ' ARG . 22.3 m -64.67 -28.11 44.08 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.187 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -179.387 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . 0.765 ' NE ' ' HA ' ' B' ' 20' ' ' ARG . 3.5 mmp_? -84.49 -48.93 9.09 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -179.41 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 21' ' ' VAL . . . . . 0.424 HG12 ' HG3' ' A' ' 17' ' ' GLN . 58.4 t -63.54 -47.21 92.56 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.781 -179.245 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 22' ' ' CYS . . . . . 0.418 ' O ' ' HZ3' ' B' ' 27' ' ' TRP . 79.3 m -102.55 37.83 1.83 Allowed 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 120.412 -0.515 . . . . 0.0 111.753 -179.272 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -172.59 121.88 0.9 Allowed Glycine 0 N--CA 1.446 -0.661 0 C-N-CA 120.085 -1.055 . . . . 0.0 112.883 179.542 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -77.86 -65.97 1.82 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.896 -0.669 . . . . 0.0 112.259 179.502 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_exo -68.63 -54.63 0.27 Allowed 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.375 2.05 . . . . 0.0 111.698 179.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 29.2 mtm105 -150.5 -140.45 0.1 Allowed 'General case' 0 CA--C 1.512 -0.484 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 179.424 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 27' ' ' TRP . . . . . 0.708 ' HA ' ' HE3' ' B' ' 27' ' ' TRP . 0.0 OUTLIER -85.07 50.7 1.99 Allowed 'General case' 0 N--CA 1.438 -1.074 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 178.074 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 24.7 m -64.87 64.74 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 114.594 -1.185 . . . . 0.0 113.347 -179.037 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 29' ' ' THR . . . . . 0.508 ' HB ' ' CZ3' ' B' ' 27' ' ' TRP . 23.7 m -169.86 -44.12 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 179.143 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 30' ' ' GLU . . . . . 0.452 ' HB3' ' NE1' ' B' ' 27' ' ' TRP . 88.5 tt0 -114.08 -23.58 9.45 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.026 -0.988 . . . . 0.0 110.605 -179.819 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 31' ' ' ALA . . . . . 0.545 ' HB1' ' HB3' ' B' ' 27' ' ' TRP . . . . . . . . 0 C--O 1.246 0.915 0 CA-C-O 118.626 -0.702 . . . . 0.0 111.078 -179.047 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . 0.557 ' HB2' HD23 ' A' ' 12' ' ' LEU . . . . . . . . 0 N--CA 1.484 1.236 0 N-CA-C 110.417 -0.216 . . . . 0.0 110.417 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -64.89 144.15 57.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.16 -179.761 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -169.87 124.66 0.79 Allowed 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 116.134 -0.485 . . . . 0.0 109.982 179.897 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 6.4 p -75.29 62.55 1.29 Allowed 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.814 179.616 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . 0.541 ' HB3' ' HB2' ' A' ' 8' ' ' ARG . 13.3 t-20 -168.59 120.79 0.68 Allowed Pre-proline 0 C--N 1.325 -0.488 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 -178.585 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -53.0 -55.28 3.86 Favored 'Trans proline' 0 N--CA 1.473 0.301 0 C-N-CA 123.438 2.759 . . . . 0.0 114.156 -178.261 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -58.83 -41.64 87.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.404 0.621 . . . . 0.0 110.401 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.541 ' HB2' ' HB3' ' A' ' 5' ' ' ASN . 13.4 mmt180 -66.21 -44.45 83.84 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.722 179.051 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 7.1 t80 -58.58 -46.77 86.24 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.093 0.473 . . . . 0.0 110.188 178.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.967 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 55.3 m -61.17 -29.42 69.79 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.446 -0.797 . . . . 0.0 112.134 -179.913 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.412 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 44.0 t -86.96 -53.59 4.81 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.552 0.692 . . . . 0.0 111.06 -179.945 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.557 HD23 ' HB2' ' A' ' 1' ' ' ALA . 9.0 mp -62.79 -40.64 97.97 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.857 -1.065 . . . . 0.0 113.433 -178.673 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 19.6 m -113.71 -42.01 3.5 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 121.074 0.464 . . . . 0.0 111.131 -178.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.613 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 105.99 144.13 12.04 Favored Glycine 0 N--CA 1.442 -0.929 0 C-N-CA 120.869 -0.681 . . . . 0.0 111.512 -179.073 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.746 ' HA ' ' HD2' ' B' ' 6' ' ' ARG . 31.0 p -139.04 149.58 44.79 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 -179.453 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.623 HG22 ' OD1' ' A' ' 19' ' ' ASP . 6.2 t -111.78 -167.37 1.17 Allowed 'General case' 0 C--N 1.327 -0.384 0 O-C-N 122.256 -0.277 . . . . 0.0 110.702 -179.037 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.424 ' HG3' HG12 ' B' ' 21' ' ' VAL . 53.7 tt0 -53.28 -46.28 69.24 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.199 -0.455 . . . . 0.0 112.067 -179.186 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -60.23 -44.33 95.3 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.691 -0.231 . . . . 0.0 110.819 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.677 ' CB ' ' HB2' ' A' ' 15' ' ' CYS . 1.6 m-20 -58.65 -44.62 90.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.237 -0.438 . . . . 0.0 109.918 179.276 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.518 HD23 ' O ' ' A' ' 16' ' ' THR . 3.9 mm? -66.95 -44.82 79.57 Favored 'General case' 0 CA--C 1.52 -0.2 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.787 179.376 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 19.6 tp -56.86 -48.53 77.89 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.912 -179.232 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 18.2 p -63.6 -15.96 59.56 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 179.786 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 45.3 tp -87.01 -24.76 24.55 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.572 179.611 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.416 ' HA ' ' HD3' ' A' ' 25' ' ' PRO . 79.9 m -84.87 135.24 40.24 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.257 -179.539 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 24' ' ' CYS . 4.6 Cg_exo -77.75 133.66 12.9 Favored 'Trans proline' 0 N--CA 1.456 -0.677 0 C-N-CA 123.151 2.567 . . . . 0.0 112.349 -179.853 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.251 1.157 0 CA-C-O 117.574 -1.203 . . . . 0.0 109.271 179.317 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 1' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo . . . . . 0 N--CA 1.489 1.262 0 CA-C-O 121.579 0.575 . . . . 0.0 110.931 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 2' ' ' THR . . . . . 0.473 HG21 ' HD2' ' B' ' 3' ' ' PRO . 0.0 OUTLIER -157.84 171.42 7.47 Favored Pre-proline 0 C--N 1.316 -0.885 0 CA-C-N 114.885 -1.052 . . . . 0.0 108.421 -179.443 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . 0.564 ' HA ' ' O ' ' A' ' 13' ' ' SER . 52.8 Cg_endo -69.31 53.96 0.97 Allowed 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 122.569 2.179 . . . . 0.0 113.433 -179.168 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -78.94 -150.37 0.05 Allowed 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.339 179.564 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 5' ' ' MET . . . . . . . . . . . . . 14.0 tpt -78.19 52.0 1.06 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.968 0.89 . . . . 0.0 109.743 178.621 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 6' ' ' ARG . . . . . 0.471 ' HB3' ' N ' ' A' ' 15' ' ' CYS . 26.1 mtt85 -124.11 151.72 43.59 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 114.659 -1.155 . . . . 0.0 108.831 -179.836 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -84.42 131.74 34.64 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.074 0.464 . . . . 0.0 109.77 -179.636 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . 0.437 ' HA ' ' O ' ' A' ' 10' ' ' CYS . 1.5 mppt? -78.85 97.71 6.07 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.546 179.622 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . 0.872 HD11 HD23 ' A' ' 20' ' ' LEU . 15.1 mt -76.25 52.48 0.75 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.417 -0.81 . . . . 0.0 112.49 -178.517 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 69.4 m -72.72 120.2 18.01 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 178.649 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 61.06 -118.07 13.79 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 121.244 -0.503 . . . . 0.0 113.891 179.599 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 18.1 t-160 -54.07 -31.68 52.47 Favored 'General case' 0 N--CA 1.465 0.306 0 N-CA-C 113.06 0.763 . . . . 0.0 113.06 -178.471 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 13' ' ' HIS . . . . . 0.621 ' CB ' ' HA ' ' B' ' 9' ' ' LEU . 26.8 m170 -61.22 -38.76 87.76 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 120.164 -0.614 . . . . 0.0 111.187 -178.668 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 14' ' ' PHE . . . . . 0.609 ' CA ' ' HB3' ' B' ' 9' ' ' LEU . 33.0 t80 -61.19 -45.0 96.4 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 178.567 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 56.4 t -62.01 -50.92 78.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 114.972 -1.013 . . . . 0.0 111.753 179.776 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . 0.604 ' HG3' ' O ' ' B' ' 13' ' ' HIS . 4.4 ppt_? -61.88 -42.83 99.53 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 112.258 0.466 . . . . 0.0 112.258 -178.414 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -70.33 -45.85 65.35 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 121.01 -0.276 . . . . 0.0 111.406 -179.446 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 18' ' ' LEU . . . . . 0.894 HD21 ' HB2' ' B' ' 27' ' ' TRP . 0.4 OUTLIER -56.63 -54.41 46.41 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.647 -179.869 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 19' ' ' VAL . . . . . 0.497 ' HA ' ' HB3' ' B' ' 27' ' ' TRP . 90.8 t -62.26 -48.25 89.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -178.819 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . 0.412 ' HD2' ' HA ' ' B' ' 20' ' ' ARG . 24.6 mmm-85 -67.63 -45.06 76.47 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 114.245 1.202 . . . . 0.0 114.245 -178.23 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 99.4 t -76.2 -42.95 37.68 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 N-CA-C 113.01 0.745 . . . . 0.0 113.01 -177.671 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 22' ' ' CYS . . . . . 0.407 ' HB2' ' HA ' ' B' ' 27' ' ' TRP . 99.0 m -81.53 36.94 0.44 Allowed 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 113.347 0.869 . . . . 0.0 113.347 -177.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 139.59 -48.0 0.87 Allowed Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.304 -0.95 . . . . 0.0 113.293 178.257 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 125.39 -72.99 0.43 Allowed Glycine 0 N--CA 1.448 -0.516 0 N-CA-C 110.703 -0.959 . . . . 0.0 110.703 -178.763 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -97.41 17.54 0.57 Allowed 'Trans proline' 0 N--CA 1.453 -0.905 0 C-N-CA 123.268 2.645 . . . . 0.0 111.333 178.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 17.9 mtp85 -169.27 148.07 3.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.3 -179.284 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 27' ' ' TRP . . . . . 0.894 ' HB2' HD21 ' B' ' 18' ' ' LEU . 0.0 OUTLIER -109.13 59.29 0.6 Allowed 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.533 178.553 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 16.5 m -46.3 91.77 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -178.066 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 29' ' ' THR . . . . . 0.653 HG21 ' N ' ' B' ' 30' ' ' GLU . 7.2 t 178.37 -43.06 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.339 -0.846 . . . . 0.0 108.798 178.842 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 30' ' ' GLU . . . . . 0.653 ' N ' HG21 ' B' ' 29' ' ' THR . 33.2 tt0 -83.78 -38.02 21.84 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.057 179.137 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.238 0 CA-C-N 114.614 -1.175 . . . . 0.0 108.906 179.553 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.072 0 N-CA-C 110.104 -0.332 . . . . 0.0 110.104 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -168.16 -151.46 0.11 Allowed 'General case' 0 C--N 1.328 -0.355 0 O-C-N 123.361 0.413 . . . . 0.0 110.156 -179.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -148.71 -157.08 0.78 Allowed 'General case' 0 N--CA 1.439 -1.003 0 CA-C-O 121.552 0.691 . . . . 0.0 109.681 179.642 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 5.9 p -74.82 62.36 1.08 Allowed 'General case' 0 C--N 1.3 -1.579 0 CA-C-N 114.258 -1.337 . . . . 0.0 112.134 -179.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -165.71 111.83 0.77 Allowed Pre-proline 0 C--N 1.327 -0.397 0 CA-C-O 121.139 0.495 . . . . 0.0 109.883 179.646 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_exo -58.42 -46.57 23.72 Favored 'Trans proline' 0 N--CA 1.469 0.061 0 C-N-CA 123.549 2.833 . . . . 0.0 113.351 -178.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -58.8 -42.56 89.4 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.303 0.573 . . . . 0.0 110.296 179.822 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.439 ' HD3' ' HA ' ' A' ' 8' ' ' ARG . 14.4 tpp180 -64.96 -50.06 67.87 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.36 -0.836 . . . . 0.0 109.742 179.026 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 31.8 t80 -55.86 -49.58 72.96 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.573 -1.194 . . . . 0.0 111.214 179.806 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.846 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 56.5 m -68.11 -29.14 68.0 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.0 -0.545 . . . . 0.0 112.398 -179.323 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 44.7 t -79.16 -55.05 5.39 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.369 0.604 . . . . 0.0 110.902 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.483 ' N ' HD13 ' A' ' 12' ' ' LEU . 11.2 mp -67.14 -47.34 71.36 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.266 -0.879 . . . . 0.0 112.562 -179.024 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.564 ' O ' ' HA ' ' B' ' 3' ' ' PRO . 16.5 m -100.98 -52.67 3.23 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.931 0.396 . . . . 0.0 111.323 -179.223 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.626 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 115.29 161.67 13.23 Favored Glycine 0 N--CA 1.445 -0.754 0 C-N-CA 120.36 -0.924 . . . . 0.0 112.295 -179.898 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.471 ' N ' ' HB3' ' B' ' 6' ' ' ARG . 21.4 p -155.1 153.58 31.07 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.899 0.38 . . . . 0.0 110.206 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.431 ' O ' HD21 ' A' ' 20' ' ' LEU . 72.0 p -103.08 179.9 4.14 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.319 -179.373 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 5.9 mp0 -58.04 -39.76 79.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.245 179.295 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 10.8 mm100 -63.5 -40.88 98.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.3 179.215 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.413 ' HB2' ' HB2' ' A' ' 15' ' ' CYS . 51.4 m-20 -61.23 -42.79 99.23 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.457 178.934 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.872 HD23 HD11 ' B' ' 9' ' ' LEU . 3.6 mm? -66.11 -45.6 80.56 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.365 178.541 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 25.7 tp -56.84 -42.38 79.54 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.848 -179.619 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 19.7 m -65.65 -21.07 66.53 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.345 0.593 . . . . 0.0 111.327 179.676 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 33.8 tp -86.33 -1.28 57.38 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.946 179.852 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 74.3 m -128.95 139.4 35.57 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-O 120.947 0.403 . . . . 0.0 111.451 -179.582 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_exo -67.88 127.06 15.5 Favored 'Trans proline' 0 N--CA 1.459 -0.513 0 C-N-CA 122.857 2.372 . . . . 0.0 111.78 179.873 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 22.4 t80 . . . . . 0 C--O 1.248 1.018 0 CA-C-N 115.433 -0.803 . . . . 0.0 108.92 -179.968 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 1' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo . . . . . 0 N--CA 1.484 0.953 0 N-CA-C 110.709 -0.535 . . . . 0.0 110.709 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 2' ' ' THR . . . . . 0.536 ' HB ' ' HD2' ' B' ' 3' ' ' PRO . 0.4 OUTLIER -161.07 173.75 4.47 Favored Pre-proline 0 C--N 1.317 -0.841 0 CA-C-N 114.828 -1.078 . . . . 0.0 108.521 -178.799 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . 0.536 ' HD2' ' HB ' ' B' ' 2' ' ' THR . 61.5 Cg_endo -71.84 50.43 1.41 Allowed 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 122.546 2.164 . . . . 0.0 111.263 178.808 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . 0.646 ' HG3' HG21 ' A' ' 16' ' ' THR . 3.1 pt-20 -71.87 135.88 46.74 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 114.208 -1.36 . . . . 0.0 111.448 -178.87 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 5' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.1 130.7 42.18 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.853 -179.569 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 6' ' ' ARG . . . . . 0.438 ' HA ' HG23 ' A' ' 16' ' ' THR . 44.8 mtp85 -73.49 129.92 39.01 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.439 -179.823 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . 0.665 ' HG3' HD23 ' B' ' 9' ' ' LEU . 11.8 tp10 -93.54 135.17 35.07 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-O 121.46 0.648 . . . . 0.0 110.309 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . 0.456 ' HD3' ' N ' ' B' ' 8' ' ' LYS . 0.7 OUTLIER -82.87 95.33 7.91 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 179.876 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . 0.665 HD23 ' HG3' ' B' ' 7' ' ' GLU . 18.8 mt -77.45 54.47 1.16 Allowed 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 -177.561 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 10' ' ' CYS . . . . . 0.418 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 74.4 m -72.51 121.06 19.02 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.039 178.307 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 57.97 -120.21 20.57 Favored Glycine 0 CA--C 1.52 0.392 0 C-N-CA 121.34 -0.457 . . . . 0.0 113.892 179.323 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 23.6 t-160 -52.77 -30.71 34.42 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -178.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 13' ' ' HIS . . . . . 0.613 ' HA ' ' HG2' ' B' ' 16' ' ' ARG . 46.9 m170 -58.46 -41.84 86.08 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 120.438 -0.505 . . . . 0.0 110.682 -179.456 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 14' ' ' PHE . . . . . 0.639 ' HA ' HD12 ' B' ' 9' ' ' LEU . 34.3 t80 -60.88 -44.39 97.14 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.217 0.532 . . . . 0.0 109.753 178.766 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 46.9 t -61.15 -50.59 79.87 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.254 -0.885 . . . . 0.0 111.751 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . 0.613 ' HG2' ' HA ' ' B' ' 13' ' ' HIS . 18.5 ptt180 -62.05 -45.31 94.1 Favored 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -178.723 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . 0.531 ' N ' ' HG3' ' B' ' 16' ' ' ARG . . . -67.53 -43.43 80.8 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 111.76 0.281 . . . . 0.0 111.76 -179.216 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 18' ' ' LEU . . . . . 0.618 HD13 HG21 ' B' ' 29' ' ' THR . 3.7 tt -60.61 -55.38 34.04 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 110.118 -0.327 . . . . 0.0 110.118 -179.799 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 19' ' ' VAL . . . . . 0.46 ' HA ' ' NE1' ' B' ' 27' ' ' TRP . 83.5 t -57.28 -41.43 78.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.166 -0.47 . . . . 0.0 112.217 -179.605 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . 0.616 ' NE ' ' HA ' ' B' ' 20' ' ' ARG . 4.0 tpm_? -78.95 -60.87 2.21 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 113.32 0.859 . . . . 0.0 113.32 -178.517 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 63.0 t -65.44 -45.68 92.22 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.85 0 N-CA-C 114.004 1.113 . . . . 0.0 114.004 -176.489 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 22' ' ' CYS . . . . . 0.596 ' HB3' ' HB3' ' B' ' 27' ' ' TRP . 73.0 m -67.9 -25.63 65.59 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -178.271 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . 0.425 ' N ' ' HD1' ' B' ' 27' ' ' TRP . . . 165.46 -109.72 0.37 Allowed Glycine 0 N--CA 1.445 -0.751 0 C-N-CA 119.66 -1.257 . . . . 0.0 113.015 -179.673 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 174.47 -66.6 0.1 Allowed Glycine 0 N--CA 1.446 -0.655 0 N-CA-C 111.472 -0.651 . . . . 0.0 111.472 -179.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -72.68 -27.51 15.05 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.478 2.119 . . . . 0.0 112.36 179.626 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . 0.697 ' NH1' ' HB2' ' B' ' 26' ' ' ARG . 0.1 OUTLIER -167.49 151.48 6.54 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 116.123 -0.49 . . . . 0.0 109.935 -179.59 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 27' ' ' TRP . . . . . 0.67 ' CZ3' ' HB2' ' B' ' 30' ' ' GLU . 0.0 OUTLIER -156.91 -88.43 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.742 179.727 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 21.1 m -166.07 62.2 0.1 Allowed 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 112.978 0.733 . . . . 0.0 112.978 -179.824 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 29' ' ' THR . . . . . 0.618 HG21 HD13 ' B' ' 18' ' ' LEU . 7.5 t -173.09 -68.06 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.332 0 O-C-N 122.348 -0.22 . . . . 0.0 110.658 177.771 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 30' ' ' GLU . . . . . 0.67 ' HB2' ' CZ3' ' B' ' 27' ' ' TRP . 20.2 mm-40 -84.72 -26.75 27.46 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.555 -0.906 . . . . 0.0 108.555 178.492 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 31' ' ' ALA . . . . . 0.44 ' HB2' ' HA ' ' B' ' 26' ' ' ARG . . . . . . . . 0 C--O 1.252 1.23 0 CA-C-N 114.124 -1.398 . . . . 0.0 108.459 179.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . 0.478 ' HB3' ' H ' ' A' ' 2' ' ' ALA . . . . . . . . 0 N--CA 1.482 1.15 0 N-CA-C 110.217 -0.29 . . . . 0.0 110.217 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . 0.478 ' H ' ' HB3' ' A' ' 1' ' ' ALA . . . -69.51 142.29 53.73 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.716 -0.22 . . . . 0.0 110.586 179.544 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.462 ' HB3' ' HD2' ' A' ' 8' ' ' ARG . . . -168.8 119.14 0.73 Allowed 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.402 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.6 m -75.46 59.53 1.1 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.596 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 15.3 t-20 -175.5 119.42 0.32 Allowed Pre-proline 0 C--N 1.326 -0.439 0 N-CA-C 108.531 -0.915 . . . . 0.0 108.531 -179.108 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -54.47 -47.86 24.55 Favored 'Trans proline' 0 N--CA 1.472 0.216 0 C-N-CA 123.365 2.71 . . . . 0.0 114.091 -178.146 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.86 -43.25 98.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.4 0.619 . . . . 0.0 110.169 179.79 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.462 ' HD2' ' HB3' ' A' ' 3' ' ' ALA . 26.1 ttm180 -66.28 -49.07 68.34 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.258 -0.883 . . . . 0.0 109.885 179.212 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 16.2 t80 -54.93 -50.76 68.05 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 114.452 -1.249 . . . . 0.0 111.33 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.648 ' SG ' ' HG ' ' B' ' 9' ' ' LEU . 35.5 t -73.01 -12.67 61.01 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.798 0.332 . . . . 0.0 111.713 -179.15 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.418 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 16.0 t -83.99 -53.55 5.48 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 121.723 0.773 . . . . 0.0 109.075 178.36 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.9 mp -69.81 -45.21 68.41 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.376 -1.283 . . . . 0.0 112.67 -179.73 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 8.3 m -98.36 -34.78 10.54 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 112.174 0.435 . . . . 0.0 112.174 -178.218 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.605 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 87.76 150.52 19.73 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.642 -0.79 . . . . 0.0 112.105 -179.026 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.609 ' HB2' ' CB ' ' A' ' 19' ' ' ASP . 32.1 p -148.28 148.73 30.77 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.845 0.355 . . . . 0.0 110.152 -179.216 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.646 HG21 ' HG3' ' B' ' 4' ' ' GLU . 65.1 p -94.13 -176.63 4.05 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.95 0.405 . . . . 0.0 111.448 -178.545 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.0 pm0 -60.78 -40.2 91.71 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 115.956 -0.566 . . . . 0.0 109.785 178.321 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 37.2 tt0 -60.29 -45.04 94.72 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.25 -0.886 . . . . 0.0 109.531 178.498 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.609 ' CB ' ' HB2' ' A' ' 15' ' ' CYS . 12.3 m-20 -56.26 -45.84 79.9 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 114.997 -1.001 . . . . 0.0 109.762 178.897 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.555 HD21 ' SG ' ' A' ' 15' ' ' CYS . 3.2 mm? -63.96 -44.7 91.99 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.543 178.491 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 32.0 tp -56.7 -45.85 81.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.413 -179.284 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.0 p -66.19 -10.75 44.47 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -179.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -109.39 12.42 24.66 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.601 -0.272 . . . . 0.0 111.26 179.57 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 96.1 m -141.39 133.65 13.93 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.192 0.52 . . . . 0.0 111.491 179.709 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -97.63 -158.84 0.04 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.987 0 C-N-CA 123.887 3.058 . . . . 0.0 112.277 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 23.4 t80 . . . . . 0 C--O 1.249 1.039 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.207 178.623 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 1' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_exo . . . . . 0 N--CA 1.478 0.566 0 N-CA-C 111.221 -0.338 . . . . 0.0 111.221 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 32.4 p -130.15 137.16 30.26 Favored Pre-proline 0 C--N 1.327 -0.394 0 CA-C-O 120.914 0.388 . . . . 0.0 111.621 -179.862 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -80.33 107.21 1.99 Allowed 'Trans proline' 0 N--CA 1.458 -0.61 0 C-N-CA 122.643 2.229 . . . . 0.0 111.515 179.451 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . 0.58 ' CD ' HG21 ' A' ' 16' ' ' THR . 11.4 pt-20 -167.62 -157.27 0.22 Allowed 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 -179.079 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 5' ' ' MET . . . . . 0.468 ' O ' ' HB ' ' A' ' 16' ' ' THR . 26.3 ptt? -71.4 129.8 39.71 Favored 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 177.922 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 58.7 mtp85 -131.95 141.89 49.46 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.712 -178.329 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -131.29 148.91 52.73 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.533 -0.544 . . . . 0.0 109.533 179.208 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . 0.773 ' HB2' ' HZ2' ' B' ' 8' ' ' LYS . 4.8 mtmp? -73.17 96.29 2.21 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.293 179.943 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . 0.685 ' HB2' ' SG ' ' A' ' 10' ' ' CYS . 96.6 mt -88.01 58.9 5.05 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.4 0.619 . . . . 0.0 111.307 -179.723 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 10' ' ' CYS . . . . . 0.462 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 99.5 m -64.45 136.86 57.5 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.611 -0.722 . . . . 0.0 112.001 179.827 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 57.42 -125.05 37.96 Favored Glycine 0 CA--C 1.518 0.266 0 CA-C-N 115.644 -0.707 . . . . 0.0 114.809 177.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 15.4 t-160 -50.69 -31.45 16.46 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 123.325 0.65 . . . . 0.0 112.736 -178.228 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 13' ' ' HIS . . . . . 0.445 ' HB3' HD21 ' B' ' 9' ' ' LEU . 22.6 m170 -59.51 -43.68 93.31 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 121.216 -0.194 . . . . 0.0 111.134 -179.42 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 14' ' ' PHE . . . . . . . . . . . . . 34.6 t80 -64.05 -42.3 97.09 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.168 0.509 . . . . 0.0 109.86 178.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . 0.562 ' O ' HG22 ' B' ' 19' ' ' VAL . 39.3 t -58.84 -56.67 15.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.379 -179.935 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . 0.531 ' HD3' ' N ' ' B' ' 17' ' ' ALA . 0.0 OUTLIER -61.07 -35.06 75.95 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-O 120.754 0.311 . . . . 0.0 110.971 -179.676 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . 0.531 ' N ' ' HD3' ' B' ' 16' ' ' ARG . . . -64.15 -46.76 82.61 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.48 179.109 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 21.2 mt -60.51 -45.92 92.03 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.433 179.452 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 19' ' ' VAL . . . . . 0.689 HG23 ' HE1' ' B' ' 27' ' ' TRP . 14.7 t -60.62 -39.55 81.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-O 120.939 0.4 . . . . 0.0 110.8 -179.737 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 31.4 tpt85 -74.27 -57.67 3.8 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.286 0.565 . . . . 0.0 112.081 -179.657 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 21' ' ' VAL . . . . . 0.534 HG23 ' HA ' ' A' ' 17' ' ' GLN . 65.2 t -65.9 -57.36 10.95 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.892 0 CA-C-N 114.706 -1.134 . . . . 0.0 113.502 -177.019 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 56.8 m -101.52 37.95 1.7 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.883 0.373 . . . . 0.0 111.527 -178.219 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -78.46 124.18 6.57 Favored Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.315 179.522 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 154.21 -150.16 21.71 Favored Glycine 0 N--CA 1.445 -0.726 0 C-N-CA 120.827 -0.701 . . . . 0.0 111.971 179.836 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_exo -64.15 -27.92 64.96 Favored 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 123.022 2.481 . . . . 0.0 112.377 179.793 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 32.1 mmt180 -80.23 -11.87 59.69 Favored 'General case' 0 CA--C 1.51 -0.572 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.667 -179.632 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 27' ' ' TRP . . . . . 0.689 ' HE1' HG23 ' B' ' 19' ' ' VAL . 0.0 OUTLIER -81.05 58.52 3.49 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 122.424 1.106 . . . . 0.0 110.89 -179.407 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 22.5 m -157.19 53.81 0.5 Allowed 'General case' 0 C--N 1.306 -1.288 0 CA-C-N 113.298 -1.774 . . . . 0.0 107.533 178.777 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 29' ' ' THR . . . . . 0.456 HG23 ' HG2' ' B' ' 30' ' ' GLU . 1.7 t -139.43 -55.48 0.58 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.602 -1.181 . . . . 0.0 110.717 -177.945 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 30' ' ' GLU . . . . . 0.662 ' HB2' ' CZ3' ' B' ' 27' ' ' TRP . 22.2 mm-40 -77.11 -28.33 54.35 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.664 179.699 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.876 0 CA-C-N 114.651 -1.159 . . . . 0.0 108.029 179.665 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.051 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -71.96 137.83 47.61 Favored 'General case' 0 C--N 1.327 -0.4 0 O-C-N 123.338 0.399 . . . . 0.0 110.558 179.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -81.1 56.35 2.79 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.131 0.491 . . . . 0.0 111.138 -179.797 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 2.1 m -78.01 54.65 1.34 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.7 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -169.42 112.3 0.5 Allowed Pre-proline 0 C--N 1.324 -0.528 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 -179.539 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -57.66 -47.02 23.17 Favored 'Trans proline' 0 C--O 1.235 0.338 0 C-N-CA 123.291 2.661 . . . . 0.0 113.446 -178.708 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.31 -46.35 90.19 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.202 0.525 . . . . 0.0 110.64 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.426 ' HD3' ' HA ' ' A' ' 8' ' ' ARG . 3.6 mmt180 -68.8 -39.35 80.16 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.121 179.484 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 31.3 t80 -57.93 -53.43 58.34 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.081 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.685 ' SG ' ' HB2' ' B' ' 9' ' ' LEU . 49.0 t -69.46 -18.35 63.71 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.018 0.437 . . . . 0.0 111.487 -179.64 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.462 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 16.2 t -81.09 -53.02 6.76 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.474 0.654 . . . . 0.0 110.47 179.401 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 94.2 mt -75.37 -57.88 3.62 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.044 -0.98 . . . . 0.0 112.51 -179.131 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 14.2 m -81.98 -29.4 32.15 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.823 0.344 . . . . 0.0 111.72 -178.783 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.587 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 86.13 147.66 10.71 Favored Glycine 0 N--CA 1.447 -0.59 0 C-N-CA 120.533 -0.841 . . . . 0.0 111.648 -178.914 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.404 ' SG ' HD13 ' B' ' 9' ' ' LEU . 18.1 p -139.84 -160.03 1.02 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.885 0.342 . . . . 0.0 110.529 -179.885 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.699 HG22 ' HB2' ' A' ' 19' ' ' ASP . 2.8 t -160.19 -178.65 7.12 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 -179.086 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.534 ' HA ' HG23 ' B' ' 21' ' ' VAL . 38.1 tt0 -62.7 -54.5 38.33 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -179.341 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -63.11 -34.17 77.02 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 179.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.699 ' HB2' HG22 ' A' ' 16' ' ' THR . 13.7 t70 -61.95 -45.77 92.2 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.949 179.076 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.497 ' HA ' HD21 ' A' ' 20' ' ' LEU . 53.2 mt -69.15 -42.72 75.57 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.523 179.498 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 32.4 tp -55.84 -52.48 63.88 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.349 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 16.1 p -65.37 -11.5 42.86 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.971 179.364 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 48.8 tp -93.6 -26.8 16.94 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.188 -0.46 . . . . 0.0 109.965 179.108 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.432 ' HA ' ' HD3' ' A' ' 25' ' ' PRO . 80.5 m -85.15 136.79 37.75 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.874 -179.868 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.432 ' HD3' ' HA ' ' A' ' 24' ' ' CYS . 16.5 Cg_exo -67.08 119.87 6.92 Favored 'Trans proline' 0 N--CA 1.457 -0.632 0 C-N-CA 122.592 2.195 . . . . 0.0 110.62 179.21 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 25.4 m-85 . . . . . 0 C--O 1.248 0.985 0 CA-C-O 118.654 -0.689 . . . . 0.0 110.53 -179.135 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 1' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo . . . . . 0 N--CA 1.478 0.568 0 N-CA-C 110.722 -0.53 . . . . 0.0 110.722 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 2' ' ' THR . . . . . 0.462 HG21 ' N ' ' B' ' 3' ' ' PRO . 22.4 m -163.51 144.15 7.04 Favored Pre-proline 0 C--N 1.326 -0.426 0 N-CA-C 109.457 -0.572 . . . . 0.0 109.457 -178.904 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . 0.462 ' N ' HG21 ' B' ' 2' ' ' THR . 80.1 Cg_exo -45.8 145.1 4.98 Favored 'Trans proline' 0 C--N 1.359 1.091 0 C-N-CA 122.809 2.34 . . . . 0.0 111.411 179.528 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -47.31 115.2 1.04 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 122.323 1.059 . . . . 0.0 113.151 -177.129 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 5' ' ' MET . . . . . . . . . . . . . 39.3 ttp 177.25 47.48 0.0 OUTLIER 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 112.658 -2.064 . . . . 0.0 107.149 179.264 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.48 155.71 19.76 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 114.853 -1.067 . . . . 0.0 112.276 -177.372 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -147.89 151.86 36.6 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.308 -0.86 . . . . 0.0 109.152 178.226 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . 0.443 ' HE2' ' HB2' ' B' ' 8' ' ' LYS . 25.3 mtmm -67.91 97.44 0.66 Allowed 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.957 -178.981 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . 0.636 ' HB2' ' SG ' ' A' ' 10' ' ' CYS . 84.1 mt -88.9 53.24 2.63 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.275 0.559 . . . . 0.0 110.752 179.581 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 10' ' ' CYS . . . . . 0.413 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 96.6 m -60.18 138.72 57.86 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.788 -179.931 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 66.95 -133.88 31.73 Favored Glycine 0 N--CA 1.451 -0.327 0 CA-C-N 115.668 -0.696 . . . . 0.0 114.824 178.334 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 17.5 t-160 -52.47 -29.25 23.85 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 -178.077 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 13' ' ' HIS . . . . . 0.57 ' O ' ' HG3' ' B' ' 16' ' ' ARG . 22.7 m170 -58.6 -46.11 87.71 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.471 0.177 . . . . 0.0 111.286 -179.147 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 14' ' ' PHE . . . . . 0.566 ' CZ ' ' HB2' ' A' ' 6' ' ' PRO . 54.0 t80 -63.22 -45.19 92.82 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 178.509 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 40.6 t -54.2 -54.56 20.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.473 -179.608 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . 0.57 ' HG3' ' O ' ' B' ' 13' ' ' HIS . 0.0 OUTLIER -61.75 -42.74 99.36 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.852 -0.339 . . . . 0.0 111.598 -179.481 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . 0.476 ' N ' ' HE ' ' B' ' 16' ' ' ARG . . . -63.68 -52.39 60.88 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 -179.953 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 18' ' ' LEU . . . . . 0.492 HD12 ' SG ' ' B' ' 22' ' ' CYS . 16.2 tp -64.57 -53.84 41.59 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.264 -179.044 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 19' ' ' VAL . . . . . 0.628 ' HA ' ' NE1' ' B' ' 27' ' ' TRP . 83.1 t -58.31 -40.31 77.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -178.295 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . 0.993 ' HA ' ' HE ' ' B' ' 20' ' ' ARG . 1.0 OUTLIER -82.29 -46.53 13.53 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 114.183 1.179 . . . . 0.0 114.183 -178.658 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 21' ' ' VAL . . . . . 0.442 HG21 ' HB3' ' A' ' 17' ' ' GLN . 72.8 t -73.83 -45.49 49.53 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 N-CA-C 113.447 0.906 . . . . 0.0 113.447 -177.778 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 22' ' ' CYS . . . . . 0.781 ' HB3' ' HB3' ' B' ' 27' ' ' TRP . 63.6 m -73.22 -33.23 65.23 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 -178.4 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 170.34 -101.95 0.17 Allowed Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 119.365 -1.398 . . . . 0.0 113.432 -179.202 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 170.68 -71.55 0.12 Allowed Glycine 0 N--CA 1.449 -0.471 0 N-CA-C 111.802 -0.519 . . . . 0.0 111.802 -179.743 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -69.41 -31.09 22.8 Favored 'Trans proline' 0 C--N 1.348 0.527 0 C-N-CA 122.531 2.154 . . . . 0.0 112.288 179.627 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . 0.573 ' HB2' ' OXT' ' B' ' 31' ' ' ALA . 0.0 OUTLIER -166.01 154.01 10.64 Favored 'General case' 0 CA--C 1.512 -0.496 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 179.559 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 27' ' ' TRP . . . . . 0.781 ' HB3' ' HB3' ' B' ' 22' ' ' CYS . 0.0 OUTLIER -140.26 -78.38 0.3 Allowed 'General case' 0 C--N 1.314 -0.976 0 O-C-N 123.357 0.411 . . . . 0.0 110.332 -179.215 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 28' ' ' SER . . . . . 0.45 ' HB2' ' HD3' ' A' ' 25' ' ' PRO . 5.6 t -178.68 49.03 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -179.805 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 29' ' ' THR . . . . . 0.433 ' CG2' ' H ' ' B' ' 30' ' ' GLU . 2.9 t -172.92 -79.18 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 121.184 -0.206 . . . . 0.0 110.761 178.949 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 30' ' ' GLU . . . . . 0.487 ' HB2' ' CZ3' ' B' ' 27' ' ' TRP . 0.6 OUTLIER -67.29 -26.9 66.77 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 178.045 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 31' ' ' ALA . . . . . 0.573 ' OXT' ' HB2' ' B' ' 26' ' ' ARG . . . . . . . . 0 C--O 1.258 1.512 0 CA-C-N 114.099 -1.409 . . . . 0.0 107.747 179.069 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.016 0 N-CA-C 110.084 -0.339 . . . . 0.0 110.084 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -81.19 66.3 6.67 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.826 0.346 . . . . 0.0 110.569 179.815 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -168.74 134.6 1.74 Allowed 'General case' 0 N--CA 1.442 -0.83 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 -179.602 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 4.8 p -54.2 -35.37 62.3 Favored 'General case' 0 C--N 1.318 -0.773 0 O-C-N 123.836 0.71 . . . . 0.0 111.495 -179.715 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -156.38 99.25 2.11 Favored Pre-proline 0 C--N 1.318 -0.786 0 CA-C-N 115.393 -0.821 . . . . 0.0 109.365 178.554 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.566 ' HB2' ' CZ ' ' B' ' 14' ' ' PHE . 24.0 Cg_exo -60.35 -39.45 66.93 Favored 'Trans proline' 0 C--N 1.331 -0.388 0 C-N-CA 123.826 3.017 . . . . 0.0 112.853 -178.708 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.94 -47.12 83.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.212 0.529 . . . . 0.0 110.527 179.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.402 ' HA ' ' HD2' ' A' ' 8' ' ' ARG . 14.0 tpt85 -66.73 -48.07 70.33 Favored 'General case' 0 CA--C 1.511 -0.532 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.698 179.222 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 10.5 t80 -52.23 -57.07 10.8 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 114.33 -1.305 . . . . 0.0 112.0 -179.518 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.654 ' O ' ' HA2' ' A' ' 14' ' ' GLY . 18.1 t -66.25 -19.83 65.94 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -178.535 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.413 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 14.4 t -84.89 -53.08 5.55 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.641 0.734 . . . . 0.0 110.427 179.453 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 15.0 tp -72.28 -62.52 1.41 Allowed 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 114.89 -1.05 . . . . 0.0 111.923 -179.138 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 14.7 m -79.86 -28.25 40.02 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.339 -178.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.654 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 85.7 152.52 19.28 Favored Glycine 0 N--CA 1.445 -0.714 0 C-N-CA 120.669 -0.777 . . . . 0.0 111.84 -179.267 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 9.1 p -151.57 -163.05 1.66 Allowed 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 179.451 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.652 HG23 ' HB2' ' A' ' 19' ' ' ASP . 13.4 t -153.33 168.52 25.78 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 108.37 -0.974 . . . . 0.0 108.37 179.493 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.442 ' HB3' HG21 ' B' ' 21' ' ' VAL . 0.0 OUTLIER -55.25 -48.27 74.21 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.616 0.246 . . . . 0.0 111.39 -178.858 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 8.7 mp0 -62.78 -38.07 89.15 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.475 179.712 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.652 ' HB2' HG23 ' A' ' 16' ' ' THR . 30.3 t70 -61.5 -44.03 97.8 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.782 179.371 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.401 ' HA ' HD23 ' A' ' 20' ' ' LEU . 67.9 mt -68.1 -39.91 82.72 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.258 178.687 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 49.9 tp -57.93 -43.55 86.35 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.704 179.469 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 36.3 p -69.61 0.77 4.9 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 120.964 0.411 . . . . 0.0 111.865 179.762 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 89.1 mt -117.01 9.92 13.82 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.007 179.241 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 75.4 m -134.18 143.19 46.06 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.331 -179.221 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.45 ' HD3' ' HB2' ' B' ' 28' ' ' SER . 66.4 Cg_endo -90.35 -157.95 0.07 OUTLIER 'Trans proline' 0 N--CA 1.45 -1.075 0 C-N-CA 123.293 2.662 . . . . 0.0 111.312 178.724 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 12.6 t80 . . . . . 0 C--O 1.251 1.138 0 CA-C-O 118.851 -0.595 . . . . 0.0 109.999 179.277 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 1' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo . . . . . 0 CA--C 1.512 -0.588 0 N-CA-C 110.159 -0.747 . . . . 0.0 110.159 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 6.0 m -62.5 123.64 79.7 Favored Pre-proline 0 C--N 1.318 -0.769 0 O-C-N 123.719 0.637 . . . . 0.0 109.944 179.529 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -68.77 144.94 61.27 Favored 'Trans proline' 0 C--O 1.234 0.322 0 C-N-CA 122.71 2.273 . . . . 0.0 112.666 -179.155 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . 0.545 ' OE1' ' HB ' ' A' ' 16' ' ' THR . 1.6 mp0 -76.26 -149.03 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.502 0.668 . . . . 0.0 109.995 179.673 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 5' ' ' MET . . . . . . . . . . . . . 24.9 ptt? -82.62 121.36 26.73 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 178.186 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 49.6 mtt180 -72.61 123.96 24.29 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.762 0.315 . . . . 0.0 111.172 -179.158 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 22.3 tt0 -100.05 151.28 21.55 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 179.124 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . 0.439 ' HA ' ' O ' ' A' ' 10' ' ' CYS . 55.2 mttm -86.8 95.52 9.87 Favored 'General case' 0 C--N 1.312 -1.065 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 178.447 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . 0.715 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 2.8 mm? -76.65 57.08 1.21 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.81 -0.632 . . . . 0.0 112.249 -178.472 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 10' ' ' CYS . . . . . 0.448 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 93.7 m -74.26 124.91 27.3 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.158 179.313 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 52.25 -115.04 3.77 Favored Glycine 0 CA--C 1.519 0.304 0 CA-C-N 115.897 -0.592 . . . . 0.0 114.326 178.617 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 12' ' ' HIS . . . . . 0.411 ' O ' ' HG3' ' B' ' 16' ' ' ARG . 15.6 t-160 -51.29 -31.69 22.27 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 123.131 0.573 . . . . 0.0 112.396 -178.97 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 13' ' ' HIS . . . . . 0.625 ' HB3' ' HA ' ' B' ' 9' ' ' LEU . 27.0 m170 -62.39 -42.82 99.72 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 120.695 -0.402 . . . . 0.0 110.589 -179.67 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 14' ' ' PHE . . . . . . . . . . . . . 19.3 t80 -60.49 -38.85 85.61 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 178.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 65.1 t -60.97 -57.5 11.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.386 -0.825 . . . . 0.0 111.4 179.497 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . 0.491 ' HD3' ' N ' ' B' ' 17' ' ' ALA . 0.0 OUTLIER -63.85 -28.54 69.92 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 120.964 -0.295 . . . . 0.0 111.322 179.93 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . 0.491 ' N ' ' HD3' ' B' ' 16' ' ' ARG . . . -63.75 -53.08 56.65 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.29 179.188 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 100.0 mt -60.77 -46.79 89.09 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.732 179.285 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 19' ' ' VAL . . . . . 0.403 ' O ' HG11 ' B' ' 19' ' ' VAL . 71.8 t -58.43 -38.51 70.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.621 -0.718 . . . . 0.0 112.825 -179.35 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . 0.599 ' NE ' ' HA ' ' B' ' 20' ' ' ARG . 0.0 OUTLIER -93.27 -43.75 8.65 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 -178.171 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 94.7 t -70.7 -40.82 77.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -178.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 52.5 m -116.6 47.26 1.47 Allowed 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 120.907 -0.317 . . . . 0.0 111.538 -179.126 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . 0.864 ' HA2' ' HB2' ' B' ' 28' ' ' SER . . . -168.38 139.47 5.68 Favored Glycine 0 N--CA 1.443 -0.875 0 C-N-CA 119.268 -1.444 . . . . 0.0 114.006 -179.9 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -84.14 -77.62 1.14 Allowed Glycine 0 N--CA 1.447 -0.57 0 N-CA-C 110.713 -0.955 . . . . 0.0 110.713 178.454 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 25' ' ' PRO . . . . . 0.473 ' HD2' ' OG ' ' B' ' 28' ' ' SER . 39.2 Cg_endo -68.6 -45.74 2.24 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.35 2.033 . . . . 0.0 110.928 178.57 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . 0.546 ' NH2' ' HB3' ' B' ' 31' ' ' ALA . 25.1 mtm105 -150.58 -128.55 0.04 OUTLIER 'General case' 0 CA--C 1.506 -0.719 0 CA-C-O 121.57 0.7 . . . . 0.0 110.364 178.582 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 27' ' ' TRP . . . . . 0.618 ' HA ' ' HE3' ' B' ' 27' ' ' TRP . 0.0 OUTLIER -82.83 62.07 6.22 Favored 'General case' 0 N--CA 1.422 -1.872 0 CA-C-N 114.254 -1.339 . . . . 0.0 109.645 -179.758 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 28' ' ' SER . . . . . 0.864 ' HB2' ' HA2' ' B' ' 23' ' ' GLY . 69.4 m -53.37 81.57 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.014 0 CA-C-O 122.244 1.021 . . . . 0.0 113.282 -179.712 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 28.3 m 177.31 -42.28 0.01 OUTLIER 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 102.97 -2.974 . . . . 0.0 102.97 179.806 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 30' ' ' GLU . . . . . 0.48 ' OE1' ' HB3' ' B' ' 27' ' ' TRP . 3.6 tm-20 -98.71 -31.61 11.82 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 111.009 -2.814 . . . . 0.0 106.329 176.154 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 31' ' ' ALA . . . . . 0.563 ' O ' ' HA ' ' B' ' 28' ' ' SER . . . . . . . . 0 C--O 1.245 0.837 0 CA-C-N 113.142 -1.845 . . . . 0.0 109.459 179.551 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.147 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -69.22 144.24 53.76 Favored 'General case' 0 C--N 1.329 -0.291 0 O-C-N 123.085 0.24 . . . . 0.0 110.527 179.35 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -165.15 119.56 1.28 Allowed 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 116.312 -0.404 . . . . 0.0 109.999 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 3.9 p -77.73 52.86 1.05 Allowed 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.445 -179.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . 0.451 ' HB3' ' HB2' ' A' ' 8' ' ' ARG . 29.6 t-20 -171.49 113.2 0.41 Allowed Pre-proline 0 C--N 1.327 -0.411 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 -179.716 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_exo -59.36 -48.06 14.85 Favored 'Trans proline' 0 C--N 1.335 -0.146 0 C-N-CA 123.209 2.606 . . . . 0.0 113.487 -178.637 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -58.73 -44.86 90.57 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.402 0.62 . . . . 0.0 110.408 179.781 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.451 ' HB2' ' HB3' ' A' ' 5' ' ' ASN . 12.0 mmt85 -67.47 -45.48 75.81 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.698 178.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 26.9 t80 -58.44 -48.73 79.76 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.088 179.784 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.715 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 61.9 m -65.9 -23.42 66.63 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.968 -179.811 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.448 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 37.6 t -88.2 -59.58 2.2 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.433 0.635 . . . . 0.0 110.475 179.531 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 13.0 tp -55.3 -54.2 46.5 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.848 -1.069 . . . . 0.0 111.083 -179.629 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 14.3 m -96.48 -59.52 1.81 Allowed 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.977 -179.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.699 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 121.48 156.14 9.67 Favored Glycine 0 N--CA 1.452 -0.29 0 N-CA-C 110.82 -0.912 . . . . 0.0 110.82 -179.692 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.693 ' SG ' HD21 ' B' ' 9' ' ' LEU . 31.3 p -150.56 155.75 40.05 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 117.546 0.673 . . . . 0.0 111.574 -178.985 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.545 ' HB ' ' OE1' ' B' ' 4' ' ' GLU . 72.8 p -91.01 -173.28 3.61 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.017 -179.495 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 -69.14 -40.13 78.43 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 177.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 62.6 mt-30 -65.79 -39.55 91.07 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.535 178.674 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.575 ' CB ' ' HB2' ' A' ' 15' ' ' CYS . 38.5 m-20 -59.51 -47.19 86.48 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 178.212 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.422 HD21 ' SG ' ' A' ' 15' ' ' CYS . 30.6 mt -63.8 -45.99 87.19 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.804 179.026 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.45 HD23 ' HA ' ' A' ' 21' ' ' LEU . 2.3 tm? -55.04 -45.14 75.19 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.237 -179.869 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 23.9 m -60.93 -25.04 66.49 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.557 179.658 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.447 ' HG ' ' O ' ' A' ' 19' ' ' ASP . 85.2 mt -79.48 -24.64 42.22 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.593 179.301 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.462 ' HA ' ' HD3' ' A' ' 25' ' ' PRO . 56.5 m -85.04 133.74 42.49 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.126 -179.623 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.462 ' HD3' ' HA ' ' A' ' 24' ' ' CYS . 3.0 Cg_exo -73.79 125.17 9.76 Favored 'Trans proline' 0 N--CA 1.457 -0.652 0 C-N-CA 122.852 2.368 . . . . 0.0 111.68 179.572 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 17.8 t80 . . . . . 0 C--O 1.25 1.08 0 CA-C-O 117.521 -1.228 . . . . 0.0 108.899 179.891 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 . . . . . 0 N--CA 1.45 -0.453 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 65.5 mttm -72.97 97.15 2.24 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.643 0.735 . . . . 0.0 109.324 179.261 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 9' ' ' LEU . . . . . 0.769 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 61.1 mt -79.1 56.22 1.97 Allowed 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 114.85 -1.068 . . . . 0.0 113.295 -177.407 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 10' ' ' CYS . . . . . 0.496 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 88.8 m -74.06 125.09 27.54 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.266 178.42 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 61.05 -126.47 40.65 Favored Glycine 0 N--CA 1.452 -0.296 0 CA-C-N 116.075 -0.511 . . . . 0.0 113.697 179.601 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 12' ' ' HIS . . . . . 0.597 ' O ' ' HG2' ' B' ' 16' ' ' ARG . 3.5 t60 -55.01 -25.73 32.22 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -179.117 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 13' ' ' HIS . . . . . 0.603 ' HB3' ' HA ' ' B' ' 9' ' ' LEU . 51.6 m170 -56.12 -42.16 76.43 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.908 -0.317 . . . . 0.0 111.03 -179.255 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 14' ' ' PHE . . . . . 0.583 ' HA ' ' HB3' ' B' ' 9' ' ' LEU . 36.0 t80 -60.18 -45.83 91.79 Favored 'General case' 0 C--N 1.328 -0.34 0 O-C-N 123.43 0.456 . . . . 0.0 110.235 178.975 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 15' ' ' VAL . . . . . 0.563 ' O ' HG23 ' B' ' 19' ' ' VAL . 93.1 t -59.12 -56.89 14.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.496 -0.774 . . . . 0.0 112.228 -179.777 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 16' ' ' ARG . . . . . 0.597 ' HG2' ' O ' ' B' ' 12' ' ' HIS . 1.9 ptm180 -60.0 -38.56 82.97 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 120.736 0.303 . . . . 0.0 111.603 -179.727 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 17' ' ' ALA . . . . . 0.817 ' HA ' ' HE ' ' B' ' 20' ' ' ARG . . . -66.43 -41.57 88.99 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.823 0.344 . . . . 0.0 110.381 179.31 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 53.0 tp -58.02 -45.44 86.89 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.727 179.056 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 19' ' ' VAL . . . . . 0.563 HG23 ' O ' ' B' ' 15' ' ' VAL . 40.6 t -62.39 -44.77 99.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.609 178.885 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 20' ' ' ARG . . . . . 0.817 ' HE ' ' HA ' ' B' ' 17' ' ' ALA . 81.5 mtm180 -57.0 -50.18 73.5 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.67 -0.696 . . . . 0.0 112.801 -179.309 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 21' ' ' VAL . . . . . 0.54 HG22 ' HG3' ' A' ' 17' ' ' GLN . 74.2 t -76.84 -53.19 15.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 N-CA-C 113.888 1.07 . . . . 0.0 113.888 -177.131 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 81.9 m . . . . . 0 C--N 1.327 -0.398 0 N-CA-C 111.94 0.348 . . . . 0.0 111.94 -178.103 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo . . . . . 0 CA--C 1.528 0.181 0 N-CA-C 113.473 0.528 . . . . 0.0 113.473 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -59.3 -42.78 92.13 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.309 0.576 . . . . 0.0 110.456 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 5.7 tpt85 -67.89 -45.8 73.43 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.973 179.273 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 32.0 t80 -57.39 -47.46 81.62 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 114.78 -1.1 . . . . 0.0 110.78 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.769 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 89.3 m -65.45 -30.8 71.63 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.139 179.813 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.496 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 26.7 t -75.87 -57.18 4.03 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.583 0.706 . . . . 0.0 110.706 179.63 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 92.8 mt -59.91 -55.93 28.01 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 114.932 -1.031 . . . . 0.0 112.1 -179.3 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.2 m -92.02 -63.65 1.21 Allowed 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.194 -179.373 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.571 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 133.85 158.07 8.48 Favored Glycine 0 N--CA 1.451 -0.345 0 N-CA-C 110.686 -0.966 . . . . 0.0 110.686 -179.521 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 93.2 m -140.33 145.16 36.84 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 117.43 0.615 . . . . 0.0 111.79 -179.449 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 63.5 p -100.89 -168.64 1.59 Allowed 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.544 179.702 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.54 ' HG3' HG22 ' B' ' 21' ' ' VAL . 49.8 tt0 -69.78 -41.4 75.18 Favored 'General case' 0 CA--C 1.512 -0.487 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 177.979 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 66.7 tp60 -62.96 -45.92 90.15 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.801 179.197 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 63.1 m-20 -57.04 -46.72 82.2 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.326 -0.852 . . . . 0.0 109.9 179.177 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.534 HD11 ' HB1' ' B' ' 17' ' ' ALA . 54.7 mt -69.11 -39.81 78.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.925 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 30.3 tp -58.42 -39.45 79.8 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.99 0.424 . . . . 0.0 110.539 -179.649 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.6 m -63.99 -21.38 66.47 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.062 179.408 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -97.69 -4.43 37.31 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.685 179.729 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 93.1 m . . . . . 0 C--N 1.33 -0.251 0 CA-C-O 121.075 0.465 . . . . 0.0 110.831 -179.991 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 . . . . . 0 N--CA 1.449 -0.5 0 N-CA-C 109.287 -0.635 . . . . 0.0 109.287 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 8' ' ' LYS . . . . . 0.447 ' HA ' ' O ' ' A' ' 10' ' ' CYS . 65.6 mttm -73.98 94.82 2.4 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 178.818 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 9' ' ' LEU . . . . . 0.729 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 28.7 mt -76.18 55.33 0.94 Allowed 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 114.794 -1.093 . . . . 0.0 113.93 -176.643 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 10' ' ' CYS . . . . . 0.445 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 75.1 m -74.87 117.69 17.0 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 177.99 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 61.18 -121.64 27.02 Favored Glycine 0 CA--C 1.521 0.411 0 C-N-CA 121.09 -0.576 . . . . 0.0 113.695 179.811 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 14.8 t-160 -53.47 -28.67 31.79 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -178.911 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 13' ' ' HIS . . . . . 0.624 ' CB ' ' HA ' ' B' ' 9' ' ' LEU . 49.6 m170 -58.37 -40.71 83.04 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.766 -0.373 . . . . 0.0 110.707 -179.288 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 14' ' ' PHE . . . . . 0.653 ' HA ' HD13 ' B' ' 9' ' ' LEU . 21.4 t80 -58.55 -45.79 88.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.347 0.594 . . . . 0.0 109.8 178.897 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 15' ' ' VAL . . . . . 0.541 ' O ' HG23 ' B' ' 19' ' ' VAL . 94.6 t -63.04 -53.76 42.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.892 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 16' ' ' ARG . . . . . 0.605 ' O ' ' HG3' ' B' ' 20' ' ' ARG . 0.0 OUTLIER -61.27 -40.35 93.76 Favored 'General case' 0 N--CA 1.462 0.154 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 -179.038 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.41 -41.05 89.85 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 121.027 -0.269 . . . . 0.0 110.436 179.41 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 10.7 mt -56.45 -49.81 73.53 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.342 178.933 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 19' ' ' VAL . . . . . 0.541 HG23 ' O ' ' B' ' 15' ' ' VAL . 11.5 t -64.95 -38.07 81.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.748 179.691 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 20' ' ' ARG . . . . . 0.605 ' HG3' ' O ' ' B' ' 16' ' ' ARG . 33.4 mtm105 -62.07 -51.99 65.73 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 49.1 t -73.46 -53.95 16.72 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 -177.295 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 60.3 m . . . . . 0 C--N 1.326 -0.419 0 C-N-CA 121.182 -0.207 . . . . 0.0 110.918 -178.605 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo . . . . . 0 C--O 1.226 -0.116 0 N-CA-C 113.262 0.447 . . . . 0.0 113.262 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -58.07 -40.98 82.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.169 0.509 . . . . 0.0 110.116 179.491 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 43.6 ttt85 -64.61 -54.69 27.93 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.134 178.911 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 26.7 t80 -56.04 -48.44 75.99 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 114.162 -1.381 . . . . 0.0 111.284 -179.583 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.729 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 91.0 m -64.6 -30.03 71.05 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.551 -179.834 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.445 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 35.5 t -77.83 -57.87 3.57 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.336 0.588 . . . . 0.0 110.641 179.708 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 88.6 mt -57.13 -58.69 7.09 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 114.94 -1.027 . . . . 0.0 111.976 -179.117 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 34.6 t -92.56 -63.21 1.26 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 120.927 0.394 . . . . 0.0 110.672 -179.785 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.628 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 132.01 155.73 8.1 Favored Glycine 0 N--CA 1.446 -0.691 0 N-CA-C 110.56 -1.016 . . . . 0.0 110.56 -179.454 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 90.8 m -131.85 135.48 46.74 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 117.191 0.495 . . . . 0.0 111.097 -179.186 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 31.4 p -80.6 170.07 16.81 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.054 179.372 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 23.2 mt-30 -66.62 -40.49 88.83 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 178.243 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 77.6 mm-40 -63.16 -43.53 98.05 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 178.593 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -58.82 -43.5 90.63 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.947 178.826 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.683 HD11 HD11 ' B' ' 9' ' ' LEU . 96.9 mt -69.41 -41.75 75.98 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.275 179.464 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 40.8 tp -57.55 -44.04 84.88 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.216 0.531 . . . . 0.0 110.55 -179.727 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.1 m -64.49 -16.63 62.83 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.219 179.615 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 23.8 tp -113.61 16.61 18.64 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.321 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 43.5 m . . . . . 0 C--N 1.332 -0.191 0 C-N-CA 120.208 -0.597 . . . . 0.0 111.015 179.375 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 7' ' ' GLU . . . . . 0.42 ' HG2' ' N ' ' B' ' 8' ' ' LYS . 26.3 tt0 . . . . . 0 C--O 1.238 0.494 0 CA-C-O 121.037 0.446 . . . . 0.0 111.028 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 8' ' ' LYS . . . . . 0.42 ' N ' ' HG2' ' B' ' 7' ' ' GLU . 47.3 mttm -79.48 98.22 6.73 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 177.572 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 9' ' ' LEU . . . . . 0.918 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 38.6 mt -78.89 57.45 2.14 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 112.805 0.669 . . . . 0.0 112.805 -177.889 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 10' ' ' CYS . . . . . 0.438 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 80.1 m -72.66 124.22 24.85 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.03 178.638 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 61.28 -124.3 34.66 Favored Glycine 0 CA--C 1.52 0.382 0 C-N-CA 121.334 -0.46 . . . . 0.0 114.077 179.272 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -51.99 -31.2 28.33 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 123.233 0.613 . . . . 0.0 112.634 -178.734 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 13' ' ' HIS . . . . . 0.616 ' HB3' ' HA ' ' B' ' 9' ' ' LEU . 43.2 m170 -57.09 -42.64 81.09 Favored 'General case' 0 C--N 1.32 -0.712 0 C-N-CA 120.714 -0.395 . . . . 0.0 110.793 -179.339 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 14' ' ' PHE . . . . . 0.566 ' HA ' HD13 ' B' ' 9' ' ' LEU . 54.7 t80 -61.39 -46.26 90.9 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.183 0.516 . . . . 0.0 109.866 178.61 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 15' ' ' VAL . . . . . 0.468 ' O ' HG23 ' B' ' 19' ' ' VAL . 40.5 t -59.82 -52.35 62.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.276 -0.874 . . . . 0.0 111.674 -179.754 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 16' ' ' ARG . . . . . 0.681 ' HG3' ' N ' ' B' ' 17' ' ' ALA . 0.1 OUTLIER -58.65 -45.29 89.65 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.084 -178.936 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 17' ' ' ALA . . . . . 0.681 ' N ' ' HG3' ' B' ' 16' ' ' ARG . . . -68.41 -42.94 78.25 Favored 'General case' 0 C--O 1.218 -0.589 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.445 -179.453 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 50.2 tp -55.09 -51.1 67.45 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.731 0.301 . . . . 0.0 110.455 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 19' ' ' VAL . . . . . 0.468 HG23 ' O ' ' B' ' 15' ' ' VAL . 59.2 t -60.75 -44.82 98.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.048 179.337 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 65.7 mtp85 -66.33 -47.93 71.92 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 -179.344 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 21' ' ' VAL . . . . . 0.542 HG23 ' O ' ' B' ' 17' ' ' ALA . 95.5 t -62.01 -61.13 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 -178.882 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 68.2 m . . . . . 0 C--N 1.326 -0.436 0 CA-C-O 121.153 0.501 . . . . 0.0 111.424 -178.974 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_exo . . . . . 0 CA--C 1.528 0.203 0 N-CA-C 113.666 0.602 . . . . 0.0 113.666 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -59.27 -42.77 91.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.401 0.619 . . . . 0.0 110.303 179.671 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 25.0 ttt85 -65.74 -49.08 69.7 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.188 -0.915 . . . . 0.0 109.944 179.178 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 13.6 t80 -55.85 -48.17 75.99 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.833 -1.076 . . . . 0.0 110.889 179.534 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.918 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 69.0 m -63.69 -27.73 69.41 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.789 -0.641 . . . . 0.0 112.083 -179.748 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.438 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 52.7 t -86.56 -59.71 2.2 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.311 0.577 . . . . 0.0 110.792 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 53.2 mt -54.66 -51.6 64.96 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.158 -0.928 . . . . 0.0 111.785 -179.64 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 9.7 m -99.68 -63.07 1.16 Allowed 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 120.989 0.423 . . . . 0.0 110.546 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.634 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 127.67 149.62 7.17 Favored Glycine 0 N--CA 1.448 -0.503 0 N-CA-C 110.216 -1.154 . . . . 0.0 110.216 -179.403 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.684 ' HB2' ' CB ' ' A' ' 19' ' ' ASP . 28.3 p -144.07 -157.93 0.83 Allowed 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 117.485 0.642 . . . . 0.0 110.292 -179.01 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.631 ' H ' ' HB2' ' A' ' 19' ' ' ASP . 14.3 t -171.32 -162.77 0.25 Allowed 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 110.321 -0.251 . . . . 0.0 110.321 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.489 ' CD ' HG22 ' B' ' 21' ' ' VAL . 53.2 mm-40 -57.55 -50.29 73.57 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.674 -179.25 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 11.4 mm100 -62.02 -43.65 98.39 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.853 0.359 . . . . 0.0 110.852 -179.523 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.684 ' CB ' ' HB2' ' A' ' 15' ' ' CYS . 2.9 m-20 -58.16 -41.6 84.16 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.459 179.443 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.452 HD12 HG21 ' B' ' 21' ' ' VAL . 69.0 mt -78.78 -40.36 33.36 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 -179.376 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 21.2 tp -56.59 -44.29 80.94 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.561 -179.456 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 19.1 m -60.34 -22.93 63.81 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.597 179.716 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 94.2 mt -80.6 -26.79 37.63 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.157 179.702 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 97.9 m . . . . . 0 C--N 1.327 -0.397 0 CA-C-O 121.082 0.468 . . . . 0.0 111.159 -179.62 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 78.5 tt0 . . . . . 0 N--CA 1.45 -0.448 0 CA-C-O 121.304 0.573 . . . . 0.0 110.75 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 21.8 mmmt -78.48 91.95 4.59 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 177.914 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 9' ' ' LEU . . . . . 1.02 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 16.5 mt -75.56 57.74 0.98 Allowed 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 113.722 1.008 . . . . 0.0 113.722 -176.926 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 10' ' ' CYS . . . . . 0.424 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 87.8 m -77.18 123.11 25.96 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 178.028 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 64.11 -125.26 31.82 Favored Glycine 0 CA--C 1.521 0.451 0 C-N-CA 121.204 -0.522 . . . . 0.0 113.865 179.629 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -52.24 -32.03 35.03 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 112.779 0.659 . . . . 0.0 112.779 -178.574 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 13' ' ' HIS . . . . . 0.621 ' HB3' ' HA ' ' B' ' 9' ' ' LEU . 41.0 m170 -56.41 -43.06 78.98 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 120.766 -0.374 . . . . 0.0 110.996 -179.312 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 14' ' ' PHE . . . . . 0.828 ' HA ' HD13 ' B' ' 9' ' ' LEU . 35.4 t80 -61.21 -45.73 93.38 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.176 0.513 . . . . 0.0 109.987 178.867 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 43.4 t -59.87 -51.52 71.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 115.292 -0.867 . . . . 0.0 111.866 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 16' ' ' ARG . . . . . 0.581 ' HG3' ' N ' ' B' ' 17' ' ' ALA . 10.7 ptt180 -62.22 -45.19 94.46 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.303 0.483 . . . . 0.0 112.303 -178.361 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 17' ' ' ALA . . . . . 0.581 ' N ' ' HG3' ' B' ' 16' ' ' ARG . . . -67.95 -48.27 66.34 Favored 'General case' 0 C--O 1.223 -0.324 0 N-CA-C 111.749 0.277 . . . . 0.0 111.749 -178.838 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 39.0 tp -57.01 -50.83 71.53 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.078 0.466 . . . . 0.0 110.898 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 46.5 t -60.56 -48.29 89.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.698 -0.683 . . . . 0.0 112.635 -179.565 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 20' ' ' ARG . . . . . 0.485 ' CZ ' ' HA ' ' B' ' 20' ' ' ARG . 0.1 OUTLIER -75.0 -39.3 61.31 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 113.956 1.095 . . . . 0.0 113.956 -178.145 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 21' ' ' VAL . . . . . 0.442 HG11 ' O ' ' A' ' 17' ' ' GLN . 70.0 t -71.12 -46.04 68.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -178.436 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 91.9 m . . . . . 0 C--N 1.33 -0.248 0 C-N-CA 120.332 -0.547 . . . . 0.0 111.519 -179.041 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.509 ' HB3' HD13 ' A' ' 23' ' ' LEU . 35.3 Cg_exo . . . . . 0 C--O 1.229 0.058 0 N-CA-C 113.693 0.613 . . . . 0.0 113.693 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.45 -45.22 85.0 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.225 0.536 . . . . 0.0 110.733 -179.804 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.427 ' HD2' ' HA ' ' A' ' 8' ' ' ARG . 10.3 tpt85 -70.01 -48.38 58.3 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.333 179.541 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 19.7 t80 -54.86 -52.53 62.49 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.945 -1.025 . . . . 0.0 111.52 -179.481 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 1.02 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 33.5 m -63.47 -32.47 73.93 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.049 -0.523 . . . . 0.0 112.198 -179.497 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.424 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 37.4 t -77.14 -57.06 4.05 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.453 0.644 . . . . 0.0 111.015 179.867 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 14.0 tp -62.48 -60.9 2.89 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 114.938 -1.028 . . . . 0.0 112.139 -178.905 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 9.2 m -86.02 -50.52 6.99 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.851 -178.495 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.597 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 111.16 155.41 13.63 Favored Glycine 0 N--CA 1.451 -0.35 0 N-CA-C 110.036 -1.226 . . . . 0.0 110.036 -178.543 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.703 ' HB2' ' HB3' ' A' ' 19' ' ' ASP . 18.3 p -146.0 153.92 41.31 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 118.255 1.027 . . . . 0.0 112.859 -178.806 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 59.7 p -95.97 -179.46 4.7 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.693 -179.612 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.442 ' O ' HG11 ' B' ' 21' ' ' VAL . 19.8 pt20 -61.59 -44.91 96.14 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 120.679 0.276 . . . . 0.0 110.983 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 55.6 mt-30 -63.06 -36.87 85.01 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.475 0.655 . . . . 0.0 109.697 179.072 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.703 ' HB3' ' HB2' ' A' ' 15' ' ' CYS . 5.5 t0 -61.6 -42.48 98.93 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.809 -1.087 . . . . 0.0 109.481 179.416 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.695 HD21 HD11 ' B' ' 9' ' ' LEU . 1.6 mm? -67.67 -46.26 72.88 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 121.055 0.455 . . . . 0.0 110.513 177.964 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 26.3 tp -55.39 -47.4 75.91 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.406 -178.746 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.8 p -65.01 -9.95 25.76 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 -179.755 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.523 ' HG ' ' O ' ' A' ' 19' ' ' ASP . 95.7 mt -85.32 -24.76 27.52 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.79 0.329 . . . . 0.0 110.459 179.164 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 51.4 m . . . . . 0 C--N 1.328 -0.355 0 CA-C-O 120.874 0.369 . . . . 0.0 111.475 -179.94 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 7' ' ' GLU . . . . . 0.414 ' CD ' HH21 ' B' ' 16' ' ' ARG . 40.0 tt0 . . . . . 0 CA--C 1.508 -0.643 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -74.93 93.25 2.65 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 178.753 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 9' ' ' LEU . . . . . 0.908 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 2.5 mp -75.41 53.55 0.68 Allowed 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.627 -0.715 . . . . 0.0 112.906 -177.683 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 80.6 m -75.31 124.6 27.37 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.007 178.472 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 60.08 -120.87 24.66 Favored Glycine 0 CA--C 1.52 0.404 0 C-N-CA 121.301 -0.476 . . . . 0.0 114.089 179.167 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 2.1 t60 -51.41 -35.22 38.15 Favored 'General case' 0 N--CA 1.467 0.376 0 N-CA-C 113.18 0.808 . . . . 0.0 113.18 -178.422 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 13' ' ' HIS . . . . . 0.666 ' C ' ' HG ' ' B' ' 9' ' ' LEU . 36.6 m170 -56.32 -43.01 78.57 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 120.435 -0.506 . . . . 0.0 110.581 -179.092 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 14' ' ' PHE . . . . . 0.75 ' HA ' HD23 ' B' ' 9' ' ' LEU . 27.8 t80 -61.27 -47.47 85.85 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 178.956 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 20.5 t -58.21 -52.24 61.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.93 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 16' ' ' ARG . . . . . 0.539 ' HG3' ' N ' ' B' ' 17' ' ' ALA . 15.6 ptt180 -61.84 -46.21 90.45 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -178.206 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 17' ' ' ALA . . . . . 0.773 ' HB3' HD21 ' B' ' 9' ' ' LEU . . . -68.56 -44.29 74.77 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 111.788 0.292 . . . . 0.0 111.788 -179.027 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 20.0 tp -59.77 -51.88 67.86 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.087 -179.452 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 84.6 t -63.3 -41.19 91.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 120.662 0.268 . . . . 0.0 111.606 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 20' ' ' ARG . . . . . 0.923 ' HE ' ' HA ' ' B' ' 20' ' ' ARG . 0.4 OUTLIER -70.87 -48.17 55.27 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -179.071 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 87.3 t -66.3 -41.05 88.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 120.538 0.208 . . . . 0.0 111.247 -179.363 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 79.2 m . . . . . 0 C--N 1.328 -0.342 0 CA-C-O 121.158 0.504 . . . . 0.0 111.567 179.767 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_exo . . . . . 0 N--CA 1.464 -0.218 0 N-CA-C 113.416 0.506 . . . . 0.0 113.416 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.76 -43.95 85.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.136 0.493 . . . . 0.0 110.581 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.428 ' HD2' ' HA ' ' A' ' 8' ' ' ARG . 14.4 tpt180 -68.24 -51.27 47.15 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.283 179.52 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 47.0 t80 -55.57 -51.64 66.42 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 114.757 -1.11 . . . . 0.0 111.282 -179.584 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.908 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 14.1 m -62.48 -35.3 78.92 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.96 -179.725 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 38.2 t -72.43 -59.41 2.74 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.239 0.542 . . . . 0.0 111.562 -179.646 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.413 HD13 ' HA ' ' A' ' 12' ' ' LEU . 4.0 mm? -68.84 -56.6 7.46 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 113.005 0.743 . . . . 0.0 113.005 -178.416 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 13.9 m -81.74 -43.21 18.71 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 111.777 0.288 . . . . 0.0 111.777 -178.539 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.572 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 99.8 148.36 22.67 Favored Glycine 0 N--CA 1.45 -0.404 0 N-CA-C 110.875 -0.89 . . . . 0.0 110.875 -178.977 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.649 ' SG ' HD22 ' B' ' 9' ' ' LEU . 24.3 p -142.63 163.45 32.8 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 117.018 0.409 . . . . 0.0 111.897 -178.361 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.401 ' H ' ' HB2' ' A' ' 19' ' ' ASP . 63.3 p -114.89 -172.88 2.21 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.812 -179.389 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 24.3 pt20 -57.64 -42.5 83.56 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 120.611 0.244 . . . . 0.0 111.01 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 -60.8 -41.67 96.09 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.181 0.515 . . . . 0.0 110.213 179.287 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.607 ' CB ' ' HB2' ' A' ' 15' ' ' CYS . 0.5 OUTLIER -61.99 -39.76 93.34 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.92 179.696 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.411 HD21 ' CD2' ' B' ' 9' ' ' LEU . 3.4 mm? -71.67 -39.34 70.35 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.751 -0.462 . . . . 0.0 109.751 178.057 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -57.7 -41.36 81.55 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.879 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 30.9 p -65.83 -5.39 8.86 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 71.6 mt -105.7 -10.5 16.74 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.009 0.433 . . . . 0.0 110.303 179.581 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 62.9 m . . . . . 0 C--N 1.326 -0.429 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.754 -179.368 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 . . . . . 0 N--CA 1.453 -0.304 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 8' ' ' LYS . . . . . 0.518 ' HA ' ' O ' ' A' ' 10' ' ' CYS . 65.7 mttm -77.55 95.01 4.43 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.579 0.704 . . . . 0.0 110.285 -179.643 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 9' ' ' LEU . . . . . 1.108 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 7.9 mp -75.02 52.02 0.54 Allowed 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 114.961 -1.018 . . . . 0.0 112.369 -179.106 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 67.5 m -73.08 123.13 22.96 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.222 -0.444 . . . . 0.0 109.94 178.579 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 59.24 -118.36 14.01 Favored Glycine 0 CA--C 1.52 0.383 0 C-N-CA 121.259 -0.496 . . . . 0.0 113.826 179.359 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 11.1 t-160 -54.14 -32.11 54.35 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 -178.661 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 13' ' ' HIS . . . . . 0.664 ' CB ' ' HA ' ' B' ' 9' ' ' LEU . 30.3 m170 -60.75 -36.94 80.17 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 120.109 -0.637 . . . . 0.0 110.815 -178.751 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 14' ' ' PHE . . . . . 0.877 ' HA ' HD23 ' B' ' 9' ' ' LEU . 15.9 t80 -62.13 -45.36 93.81 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 178.524 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 47.9 t -63.72 -52.94 50.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.087 -0.96 . . . . 0.0 111.9 179.699 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 16' ' ' ARG . . . . . 0.546 ' HG3' ' O ' ' B' ' 13' ' ' HIS . 3.7 ppt_? -59.68 -44.4 93.63 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.896 -0.593 . . . . 0.0 112.066 -178.442 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 17' ' ' ALA . . . . . 0.734 ' HB3' HD21 ' B' ' 9' ' ' LEU . . . -69.62 -41.8 75.18 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 121.146 -0.222 . . . . 0.0 111.115 -179.373 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 18' ' ' LEU . . . . . 0.436 ' O ' ' HB2' ' B' ' 22' ' ' CYS . 7.2 mt -56.85 -55.61 32.24 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.836 0.35 . . . . 0.0 111.259 179.502 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 41.7 t -64.26 -38.44 82.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.995 -0.548 . . . . 0.0 112.315 -178.94 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 20' ' ' ARG . . . . . 0.739 ' NE ' ' HA ' ' B' ' 20' ' ' ARG . 0.1 OUTLIER -77.06 -54.5 6.46 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.125 -0.63 . . . . 0.0 112.592 -178.563 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 21' ' ' VAL . . . . . 0.634 HG13 ' HG3' ' A' ' 17' ' ' GLN . 78.3 t -63.46 -45.73 97.11 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 CA-C-N 115.734 -0.666 . . . . 0.0 112.164 -178.502 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 22' ' ' CYS . . . . . 0.436 ' HB2' ' O ' ' B' ' 18' ' ' LEU . 88.1 m . . . . . 0 C--N 1.322 -0.607 0 CA-C-O 121.337 0.589 . . . . 0.0 112.043 -179.225 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_exo . . . . . 0 N--CA 1.465 -0.182 0 N-CA-C 113.431 0.512 . . . . 0.0 113.431 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.6 -44.32 81.0 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.313 0.578 . . . . 0.0 110.587 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 17.3 mmm180 -67.62 -50.24 59.09 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.073 179.296 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -57.34 -49.09 77.24 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.794 179.629 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 1.108 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 65.0 m -61.88 -38.67 89.2 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.723 -0.672 . . . . 0.0 112.074 -179.66 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 47.7 t -74.46 -59.66 2.63 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.245 0.545 . . . . 0.0 111.664 -179.398 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -61.99 -56.56 17.89 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.541 -0.754 . . . . 0.0 112.629 -178.518 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 12.5 m -91.22 -59.26 2.2 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.932 0.396 . . . . 0.0 111.144 -179.234 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.592 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 123.57 144.46 6.55 Favored Glycine 0 N--CA 1.446 -0.675 0 N-CA-C 110.894 -0.883 . . . . 0.0 110.894 -179.513 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.601 ' SG ' HD22 ' B' ' 9' ' ' LEU . 20.8 p -130.3 153.51 48.57 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 117.162 0.481 . . . . 0.0 110.789 -179.783 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.528 HG22 ' HB2' ' A' ' 19' ' ' ASP . 10.1 t -107.02 -176.86 3.2 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.638 -178.75 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.634 ' HG3' HG13 ' B' ' 21' ' ' VAL . 34.1 tt0 -59.0 -53.08 62.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.68 -179.737 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 8.8 mm100 -60.69 -38.43 84.93 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.392 0.615 . . . . 0.0 110.432 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.528 ' HB2' HG22 ' A' ' 16' ' ' THR . 3.0 t0 -62.12 -41.64 98.44 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.176 -0.92 . . . . 0.0 109.818 179.362 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 77.8 mt -72.81 -41.36 65.01 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.014 179.131 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 45.8 tp -56.35 -45.88 80.21 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.88 -179.486 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 11.0 p -64.27 -9.98 20.87 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 179.85 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 98.4 mt -96.59 -20.77 18.08 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.032 179.422 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 76.5 m . . . . . 0 C--N 1.327 -0.381 0 CA-C-O 121.181 0.515 . . . . 0.0 111.872 -179.026 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 7' ' ' GLU . . . . . 0.548 ' O ' HD22 ' B' ' 9' ' ' LEU . 8.8 tp10 . . . . . 0 N--CA 1.445 -0.685 0 CA-C-O 121.468 0.652 . . . . 0.0 109.475 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 6.0 mtmm -83.06 86.51 6.99 Favored 'General case' 0 C--N 1.308 -1.2 0 CA-C-N 115.331 -0.85 . . . . 0.0 109.555 -179.225 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 9' ' ' LEU . . . . . 0.638 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 1.6 mm? -74.73 54.44 0.62 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.653 -0.703 . . . . 0.0 112.878 -178.653 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 10' ' ' CYS . . . . . 0.488 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 81.2 m -71.28 119.66 15.74 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.608 178.78 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 53.47 -116.57 5.98 Favored Glycine 0 C--N 1.331 0.29 0 CA-C-N 116.161 -0.472 . . . . 0.0 113.583 179.213 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -51.28 -34.04 31.19 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 122.978 0.511 . . . . 0.0 111.909 -179.634 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 13' ' ' HIS . . . . . 0.589 ' O ' HD12 ' B' ' 9' ' ' LEU . 46.7 m170 -55.16 -44.57 75.29 Favored 'General case' 0 C--N 1.32 -0.696 0 C-N-CA 120.495 -0.482 . . . . 0.0 110.48 -179.362 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 14' ' ' PHE . . . . . 0.461 ' CA ' ' HB3' ' B' ' 9' ' ' LEU . 25.7 t80 -62.64 -48.0 81.24 Favored 'General case' 0 C--N 1.329 -0.318 0 O-C-N 123.382 0.426 . . . . 0.0 110.229 178.945 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 13.0 t -56.43 -50.58 71.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.753 179.616 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.96 -45.08 96.17 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.016 -0.993 . . . . 0.0 112.061 -179.359 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.17 -44.56 83.7 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.769 0.319 . . . . 0.0 111.524 -179.797 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 29.4 tp -61.05 -51.53 68.79 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.607 -179.346 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 21.1 m -64.36 -33.89 65.69 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 -179.448 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 20' ' ' ARG . . . . . 0.534 ' HA ' ' NE ' ' B' ' 20' ' ' ARG . 13.9 mmp_? -77.38 -52.33 9.33 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 112.395 0.517 . . . . 0.0 112.395 -179.376 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 91.1 t -71.13 -52.75 24.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -178.545 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 83.6 m . . . . . 0 C--N 1.324 -0.542 0 CA-C-O 120.772 0.32 . . . . 0.0 111.282 -179.309 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo . . . . . 0 N--CA 1.466 -0.098 0 N-CA-C 113.416 0.506 . . . . 0.0 113.416 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -58.66 -43.35 89.83 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.024 0.44 . . . . 0.0 110.925 -179.747 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.404 ' HA ' ' HD3' ' A' ' 8' ' ' ARG . 3.0 mmt85 -73.25 -43.87 60.36 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.498 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 32.3 t80 -62.7 -51.42 67.27 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.115 -179.714 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.667 ' O ' ' HA2' ' A' ' 14' ' ' GLY . 86.6 m -67.32 -17.54 64.8 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.883 -179.577 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.488 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 28.8 t -82.95 -57.28 3.36 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.298 0.571 . . . . 0.0 110.341 178.986 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 97.2 mt -69.49 -57.85 4.71 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.885 -1.052 . . . . 0.0 112.555 -178.866 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 14.1 m -84.36 -29.68 26.07 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.085 0.469 . . . . 0.0 111.446 -178.787 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.667 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 83.62 151.31 11.41 Favored Glycine 0 N--CA 1.446 -0.672 0 C-N-CA 120.779 -0.724 . . . . 0.0 111.493 -178.861 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 82.9 m -134.79 143.79 47.29 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.933 0.396 . . . . 0.0 111.046 -179.162 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 39.7 p -80.64 167.34 20.15 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 178.559 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 4.6 pp0? -61.73 -37.64 84.97 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 179.373 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 66.9 tp60 -63.63 -43.42 96.87 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.199 178.678 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -59.7 -44.18 93.78 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.464 179.654 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.509 HD11 HD21 ' B' ' 9' ' ' LEU . 81.2 mt -65.23 -46.32 81.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.344 178.723 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 30.9 tp -57.31 -41.11 79.27 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.808 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 21.2 m -62.62 -24.16 67.44 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.36 179.864 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 96.6 mt -77.65 -23.19 49.74 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.487 179.244 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 43.2 m . . . . . 0 C--N 1.325 -0.458 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.251 -179.541 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 . . . . . 0 N--CA 1.451 -0.381 0 CA-C-O 120.661 0.267 . . . . 0.0 110.817 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 25.0 mtpp -71.8 98.04 1.9 Allowed 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 107.555 -1.276 . . . . 0.0 107.555 177.976 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 9' ' ' LEU . . . . . 0.811 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 32.5 mt -77.97 59.21 2.1 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 113.974 1.102 . . . . 0.0 113.974 -176.485 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 10' ' ' CYS . . . . . 0.424 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 93.2 m -80.99 122.83 27.78 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 177.759 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 63.08 -123.28 29.64 Favored Glycine 0 CA--C 1.52 0.35 0 C-N-CA 121.107 -0.568 . . . . 0.0 113.569 179.799 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -53.41 -31.03 43.24 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 112.707 0.632 . . . . 0.0 112.707 -178.788 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 13' ' ' HIS . . . . . 0.641 ' CB ' ' HA ' ' B' ' 9' ' ' LEU . 51.4 m170 -56.5 -43.44 79.74 Favored 'General case' 0 C--N 1.321 -0.668 0 C-N-CA 120.665 -0.414 . . . . 0.0 111.26 -179.035 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 14' ' ' PHE . . . . . 0.713 ' HA ' HD13 ' B' ' 9' ' ' LEU . 45.8 t80 -61.44 -45.64 93.43 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.257 0.551 . . . . 0.0 109.666 178.691 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 23.7 t -60.45 -49.4 84.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.023 -0.989 . . . . 0.0 111.588 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 16' ' ' ARG . . . . . 0.623 ' HG3' ' N ' ' B' ' 17' ' ' ALA . 12.5 ptt85 -61.03 -43.22 99.21 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.706 -0.224 . . . . 0.0 111.549 -178.587 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 17' ' ' ALA . . . . . 0.623 ' N ' ' HG3' ' B' ' 16' ' ' ARG . . . -66.41 -51.25 58.93 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.805 0.336 . . . . 0.0 111.43 -179.176 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 29.9 tp -60.37 -54.59 43.79 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.714 -179.394 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 77.8 t -59.9 -45.36 95.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -178.698 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 20' ' ' ARG . . . . . 0.491 ' HD2' ' HA ' ' B' ' 20' ' ' ARG . 23.6 tpt85 -71.71 -56.18 6.28 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -178.107 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 21' ' ' VAL . . . . . 0.466 HG11 ' O ' ' A' ' 17' ' ' GLN . 89.2 t -61.83 -45.97 97.52 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.844 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 -176.965 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 74.4 m . . . . . 0 C--N 1.326 -0.425 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 -178.89 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_exo . . . . . 0 N--CA 1.466 -0.137 0 N-CA-C 113.093 0.382 . . . . 0.0 113.093 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.86 -41.88 78.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.271 0.557 . . . . 0.0 110.666 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.452 ' HD3' ' HA ' ' A' ' 8' ' ' ARG . 30.4 mmt-85 -70.35 -49.38 49.82 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.56 -0.746 . . . . 0.0 111.184 179.335 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 28.0 t80 -59.03 -49.12 79.12 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.657 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.811 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 95.0 m -63.31 -30.48 71.61 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.65 -179.416 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.424 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 36.0 t -77.04 -56.0 4.96 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.207 0.527 . . . . 0.0 110.063 178.97 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 85.5 mt -55.23 -55.08 35.33 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.078 -0.964 . . . . 0.0 110.723 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.403 ' HB2' ' H ' ' A' ' 14' ' ' GLY . 15.2 m -95.14 -92.88 0.19 Allowed 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.925 -0.579 . . . . 0.0 109.775 178.87 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.403 ' H ' ' HB2' ' A' ' 13' ' ' SER . . . 165.65 149.97 6.08 Favored Glycine 0 N--CA 1.448 -0.515 0 N-CA-C 111.221 -0.751 . . . . 0.0 111.221 179.649 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 73.9 m -134.99 134.41 40.46 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 117.191 0.495 . . . . 0.0 111.027 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.818 HG23 ' H ' ' A' ' 19' ' ' ASP . 6.4 t -81.52 160.89 23.8 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 179.212 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.466 ' O ' HG11 ' B' ' 21' ' ' VAL . 68.2 mm-40 -56.96 -40.09 75.83 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.234 0.54 . . . . 0.0 109.753 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 38.4 tt0 -62.59 -38.92 92.04 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.46 -0.791 . . . . 0.0 109.83 178.113 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.818 ' H ' HG23 ' A' ' 16' ' ' THR . 11.3 t0 -57.33 -47.49 81.42 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.006 -0.997 . . . . 0.0 109.183 178.848 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.718 HD21 HD11 ' B' ' 9' ' ' LEU . 4.4 mm? -62.18 -43.19 99.39 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.303 178.605 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 39.4 tp -54.71 -51.47 65.47 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.663 179.816 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 6.8 p -62.83 -16.02 56.68 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.546 ' HG ' ' O ' ' A' ' 19' ' ' ASP . 89.2 mt -80.26 -27.43 38.63 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.948 0.404 . . . . 0.0 110.235 179.08 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 88.6 m . . . . . 0 C--N 1.327 -0.387 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.187 179.941 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 62.2 tt0 . . . . . 0 C--O 1.237 0.414 0 CA-C-O 121.087 0.47 . . . . 0.0 111.123 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 10.1 mmtp -81.61 96.17 7.4 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 177.88 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 9' ' ' LEU . . . . . 0.996 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 21.5 mt -76.41 56.42 1.08 Allowed 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 112.848 0.684 . . . . 0.0 112.848 -178.079 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 99.4 m -75.94 121.45 22.7 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.164 -0.471 . . . . 0.0 109.807 178.351 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 62.35 -123.64 31.48 Favored Glycine 0 CA--C 1.521 0.462 0 C-N-CA 121.262 -0.494 . . . . 0.0 114.015 179.382 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 12' ' ' HIS . . . . . 0.485 ' O ' ' HG2' ' B' ' 16' ' ' ARG . 20.7 t-160 -51.44 -32.37 26.56 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 112.894 0.701 . . . . 0.0 112.894 -178.526 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 13' ' ' HIS . . . . . 0.628 ' HB3' ' HA ' ' B' ' 9' ' ' LEU . 28.7 m170 -57.75 -42.9 84.89 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 120.905 -0.318 . . . . 0.0 110.799 -179.433 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 14' ' ' PHE . . . . . 0.683 ' HA ' HD13 ' B' ' 9' ' ' LEU . 43.3 t80 -61.42 -45.9 92.39 Favored 'General case' 0 C--N 1.327 -0.396 0 O-C-N 123.418 0.449 . . . . 0.0 110.0 178.995 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 59.3 t -55.7 -56.61 11.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.568 -0.742 . . . . 0.0 112.108 -179.62 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 16' ' ' ARG . . . . . 0.485 ' HG2' ' O ' ' B' ' 12' ' ' HIS . 2.5 ptm180 -59.91 -47.71 84.68 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -179.147 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.79 -43.76 83.06 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.146 0.425 . . . . 0.0 112.146 -178.818 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 36.9 tp -59.34 -48.76 80.42 Favored 'General case' 0 C--N 1.327 -0.406 0 O-C-N 123.156 0.285 . . . . 0.0 110.698 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 72.7 t -61.31 -44.16 97.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.744 179.728 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.5 -47.07 86.94 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.595 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 21' ' ' VAL . . . . . 0.445 HG21 ' HA ' ' A' ' 17' ' ' GLN . 69.1 t -76.08 -45.95 35.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 N-CA-C 113.013 0.746 . . . . 0.0 113.013 -177.815 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 95.6 m . . . . . 0 C--N 1.324 -0.51 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 -178.464 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.64 ' HB3' HD13 ' A' ' 23' ' ' LEU . 33.5 Cg_exo . . . . . 0 N--CA 1.47 0.125 0 N-CA-C 113.448 0.519 . . . . 0.0 113.448 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.53 -39.42 87.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.499 0.666 . . . . 0.0 110.35 179.637 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.45 ' HA ' ' NE ' ' A' ' 8' ' ' ARG . 0.4 OUTLIER -67.93 -49.92 59.01 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.262 -0.881 . . . . 0.0 109.809 179.317 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 17.0 t80 -56.34 -51.59 67.7 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.031 -0.986 . . . . 0.0 111.1 179.684 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.996 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 57.6 m -61.92 -28.56 69.61 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.124 -179.588 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 42.3 t -82.52 -55.3 4.56 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.375 0.607 . . . . 0.0 111.124 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 91.6 mt -64.22 -58.73 5.74 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.157 -0.929 . . . . 0.0 112.417 -178.917 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 8.9 m -89.98 -43.75 10.34 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.999 0.428 . . . . 0.0 111.194 -179.17 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.688 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 103.81 149.46 20.47 Favored Glycine 0 N--CA 1.446 -0.635 0 N-CA-C 110.86 -0.896 . . . . 0.0 110.86 -178.98 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.556 ' HB2' ' CB ' ' A' ' 19' ' ' ASP . 28.2 p -139.95 -161.44 1.2 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 117.443 0.622 . . . . 0.0 110.944 -179.513 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.693 ' H ' ' HB2' ' A' ' 19' ' ' ASP . 6.9 t -160.1 -166.47 1.71 Allowed 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 -179.757 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.445 ' HA ' HG21 ' B' ' 21' ' ' VAL . 36.4 tt0 -59.0 -53.8 54.35 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.176 0.435 . . . . 0.0 112.176 -179.008 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -57.34 -45.85 83.87 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.819 0.343 . . . . 0.0 110.591 179.549 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.693 ' HB2' ' H ' ' A' ' 16' ' ' THR . 1.1 m-20 -56.53 -43.39 79.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.312 179.122 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.519 HD11 HD11 ' B' ' 9' ' ' LEU . 84.2 mt -72.04 -37.54 69.69 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.1 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 6.1 tt -57.13 -46.08 82.98 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.951 -179.76 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.5 p -64.98 -13.8 58.53 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.95 0.405 . . . . 0.0 111.73 179.076 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.64 HD13 ' HB3' ' A' ' 6' ' ' PRO . 90.5 mt -94.19 -18.24 21.92 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.822 179.435 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 69.9 m . . . . . 0 C--N 1.333 -0.149 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.886 -179.538 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 69.1 tt0 . . . . . 0 N--CA 1.447 -0.612 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 11.5 mmmm -76.23 93.01 3.33 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 178.894 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 9' ' ' LEU . . . . . 0.964 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 34.1 mt -78.2 57.47 1.86 Allowed 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 113.057 0.762 . . . . 0.0 113.057 -177.714 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 10' ' ' CYS . . . . . 0.405 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 87.4 m -73.43 121.6 20.78 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.192 178.413 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 58.65 -119.75 19.07 Favored Glycine 0 CA--C 1.52 0.391 0 N-CA-C 114.38 0.512 . . . . 0.0 114.38 179.22 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 12' ' ' HIS . . . . . 0.518 ' O ' ' HG3' ' B' ' 16' ' ' ARG . 16.5 t-160 -50.06 -32.46 15.6 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 -178.33 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 13' ' ' HIS . . . . . 0.644 ' HB3' ' HA ' ' B' ' 9' ' ' LEU . 23.6 m170 -59.36 -41.38 89.12 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 120.875 -0.33 . . . . 0.0 111.026 -179.267 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 14' ' ' PHE . . . . . 0.627 ' HA ' HD13 ' B' ' 9' ' ' LEU . 22.7 t80 -60.91 -44.42 97.19 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.171 0.51 . . . . 0.0 109.688 178.995 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 15' ' ' VAL . . . . . 0.463 ' O ' HG23 ' B' ' 19' ' ' VAL . 60.0 t -58.55 -58.65 5.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.162 -0.926 . . . . 0.0 112.508 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 16' ' ' ARG . . . . . 0.624 ' HD3' ' N ' ' B' ' 17' ' ' ALA . 0.0 OUTLIER -62.5 -31.92 72.75 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 120.732 -0.387 . . . . 0.0 111.916 -179.123 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 17' ' ' ALA . . . . . 0.624 ' N ' ' HD3' ' B' ' 16' ' ' ARG . . . -65.77 -47.56 74.79 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.545 179.329 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 18' ' ' LEU . . . . . 0.401 ' O ' ' HB2' ' B' ' 22' ' ' CYS . 57.9 mt -61.19 -49.6 76.52 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.838 179.302 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 19' ' ' VAL . . . . . 0.463 HG23 ' O ' ' B' ' 15' ' ' VAL . 87.1 t -57.33 -40.98 77.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.789 -179.813 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 20' ' ' ARG . . . . . 0.573 ' HA ' ' NE ' ' B' ' 20' ' ' ARG . 4.5 tpm_? -80.55 -59.78 2.56 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 -178.737 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 92.2 t -61.14 -44.22 97.88 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 CA-C-N 115.085 -0.962 . . . . 0.0 113.295 -177.132 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 22' ' ' CYS . . . . . 0.401 ' HB2' ' O ' ' B' ' 18' ' ' LEU . 75.9 m . . . . . 0 C--N 1.324 -0.509 0 CA-C-O 121.83 0.824 . . . . 0.0 111.684 -179.07 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.422 ' HB2' ' CZ ' ' B' ' 14' ' ' PHE . 23.3 Cg_exo . . . . . 0 N--CA 1.466 -0.135 0 N-CA-C 113.265 0.448 . . . . 0.0 113.265 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.59 -44.25 85.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.104 0.478 . . . . 0.0 110.424 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 35.6 ttp180 -63.31 -52.2 62.91 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.431 -0.804 . . . . 0.0 109.807 179.085 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 60.8 t80 -55.22 -49.56 71.67 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.369 -1.287 . . . . 0.0 111.27 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.964 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 72.4 m -64.64 -31.95 73.4 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.986 -0.552 . . . . 0.0 112.173 -179.323 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.405 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 42.6 t -76.89 -54.17 6.93 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.301 0.572 . . . . 0.0 110.952 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 11.0 mp -69.84 -59.61 2.83 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.296 -0.866 . . . . 0.0 112.547 -178.833 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.2 m -86.06 -45.6 11.27 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.767 0.318 . . . . 0.0 111.827 -178.976 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.607 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 104.72 149.71 19.69 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.841 -0.695 . . . . 0.0 111.421 -179.349 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.519 ' SG ' HD12 ' B' ' 9' ' ' LEU . 27.0 p -143.29 145.07 32.4 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.137 0.494 . . . . 0.0 111.509 -179.044 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 8.8 t -94.95 168.57 10.7 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.43 -179.261 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 5.6 mp0 -49.61 -45.31 48.02 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 122.772 0.429 . . . . 0.0 111.464 -179.537 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 4.2 tp60 -61.14 -40.01 92.2 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.254 0.55 . . . . 0.0 110.14 179.508 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.494 ' HB3' ' HB2' ' A' ' 15' ' ' CYS . 1.7 t70 -60.3 -43.95 95.85 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.584 179.286 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.481 HD21 HD11 ' B' ' 9' ' ' LEU . 1.8 mm? -67.49 -44.32 78.8 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.685 178.731 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 31.1 tp -55.87 -44.57 78.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.61 -179.327 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 21.7 m -60.55 -24.07 65.11 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.489 179.535 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 97.3 mt -85.14 -22.51 28.8 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.304 179.79 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 89.2 m . . . . . 0 C--N 1.326 -0.426 0 CA-C-O 121.112 0.482 . . . . 0.0 111.738 -179.419 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 7' ' ' GLU . . . . . 0.413 ' HG2' ' N ' ' B' ' 8' ' ' LYS . 55.2 tt0 . . . . . 0 N--CA 1.45 -0.45 0 CA-C-O 121.106 0.479 . . . . 0.0 110.792 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 8' ' ' LYS . . . . . 0.413 ' N ' ' HG2' ' B' ' 7' ' ' GLU . 41.3 mttm -87.63 96.47 10.43 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 108.031 -1.1 . . . . 0.0 108.031 177.528 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 9' ' ' LEU . . . . . 0.636 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 3.1 mm? -75.31 55.21 0.76 Allowed 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 -177.975 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 10' ' ' CYS . . . . . 0.432 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 73.4 m -76.24 121.8 23.44 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.697 179.018 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 55.26 -116.96 7.54 Favored Glycine 0 CA--C 1.52 0.4 0 CA-C-N 116.074 -0.512 . . . . 0.0 114.321 178.911 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 19.5 t-160 -50.89 -32.62 21.08 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 112.794 0.665 . . . . 0.0 112.794 -178.627 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 13' ' ' HIS . . . . . 0.635 ' HB3' ' HA ' ' B' ' 9' ' ' LEU . 20.7 m170 -59.48 -46.25 89.33 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.892 -179.273 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 14' ' ' PHE . . . . . . . . . . . . . 44.8 t80 -59.97 -40.88 90.59 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.076 0.465 . . . . 0.0 109.948 179.135 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 15' ' ' VAL . . . . . 0.471 ' O ' HG23 ' B' ' 19' ' ' VAL . 46.3 t -59.09 -55.35 24.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.46 -0.791 . . . . 0.0 111.439 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 16' ' ' ARG . . . . . 0.438 ' HG3' ' O ' ' B' ' 13' ' ' HIS . 2.8 ptm180 -63.18 -38.04 89.59 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.533 -179.484 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 17' ' ' ALA . . . . . 0.618 ' HB1' ' HG ' ' A' ' 20' ' ' LEU . . . -64.24 -47.46 79.54 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.714 0.293 . . . . 0.0 110.929 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 18' ' ' LEU . . . . . 0.443 HD23 ' HB2' ' B' ' 22' ' ' CYS . 1.5 tt -60.46 -51.43 69.51 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.688 -179.969 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 19' ' ' VAL . . . . . 0.471 HG23 ' O ' ' B' ' 15' ' ' VAL . 67.8 t -59.85 -38.19 75.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -179.511 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 20' ' ' ARG . . . . . 0.756 ' NE ' ' HA ' ' B' ' 20' ' ' ARG . 0.3 OUTLIER -83.24 -54.83 4.71 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -178.326 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 60.9 t -64.14 -50.72 75.66 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.554 -178.458 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 22' ' ' CYS . . . . . 0.443 ' HB2' HD23 ' B' ' 18' ' ' LEU . 60.8 m . . . . . 0 C--O 1.217 -0.616 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 178.541 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_exo . . . . . 0 CA--C 1.526 0.077 0 N-CA-C 113.203 0.424 . . . . 0.0 113.203 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.3 -44.45 95.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.395 0.617 . . . . 0.0 110.142 179.642 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.403 ' HA ' ' HD2' ' A' ' 8' ' ' ARG . 17.8 tpt180 -66.5 -48.86 68.48 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.617 179.091 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 23.6 t80 -55.52 -50.97 68.57 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 114.203 -1.362 . . . . 0.0 111.354 -179.695 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.694 ' O ' ' HA2' ' A' ' 14' ' ' GLY . 41.6 m -69.8 -16.04 63.22 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.796 179.99 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.432 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 24.0 t -85.3 -53.81 4.99 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.764 0.792 . . . . 0.0 109.605 178.821 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 98.6 mt -66.88 -60.38 2.71 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 114.635 -1.166 . . . . 0.0 111.642 -179.608 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 24.8 m -82.08 -42.42 19.23 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.425 -179.679 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.694 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 91.72 142.89 11.14 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.762 -0.732 . . . . 0.0 111.421 -178.959 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.623 ' HB2' ' CB ' ' A' ' 19' ' ' ASP . 29.9 p -141.06 151.5 44.08 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.579 0.228 . . . . 0.0 110.438 -179.117 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.504 ' O ' ' HB2' ' A' ' 19' ' ' ASP . 27.8 p -76.63 170.59 16.14 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.607 -179.278 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 84.9 mm-40 -62.15 -38.0 87.34 Favored 'General case' 0 C--O 1.234 0.245 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 178.509 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 90.7 mm-40 -62.78 -37.5 86.9 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 115.397 -0.82 . . . . 0.0 109.147 177.429 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.623 ' CB ' ' HB2' ' A' ' 15' ' ' CYS . 91.8 m-20 -59.67 -43.41 94.0 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.342 -0.844 . . . . 0.0 109.022 178.355 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.618 ' HG ' ' HB1' ' B' ' 17' ' ' ALA . 1.8 mm? -61.25 -42.13 98.1 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 177.299 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.569 ' HA ' ' SG ' ' A' ' 24' ' ' CYS . 32.1 tp -57.98 -40.46 80.73 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.54 179.76 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 3.9 m -63.12 -22.17 66.68 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.27 0.557 . . . . 0.0 110.823 179.233 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 93.4 mt -82.64 -21.4 35.06 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.45 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.569 ' SG ' ' HA ' ' A' ' 21' ' ' LEU . 3.1 m . . . . . 0 CA--C 1.53 0.18 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 7' ' ' GLU . . . . . 0.524 ' OE2' ' HG2' ' B' ' 8' ' ' LYS . 4.7 tp10 . . . . . 0 N--CA 1.44 -0.929 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 8' ' ' LYS . . . . . 0.524 ' HG2' ' OE2' ' B' ' 7' ' ' GLU . 11.7 mmtm -82.72 97.8 8.75 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-O 121.372 0.605 . . . . 0.0 110.811 -177.713 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 9' ' ' LEU . . . . . 0.748 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 3.3 mm? -83.37 58.29 4.43 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.573 179.545 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 10' ' ' CYS . . . . . 0.512 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 71.9 m -65.07 130.95 45.24 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.857 -0.611 . . . . 0.0 112.041 -179.701 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 53.94 -122.23 22.13 Favored Glycine 0 C--N 1.332 0.325 0 CA-C-N 115.772 -0.649 . . . . 0.0 114.461 178.178 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 17.2 t-160 -52.55 -29.28 24.68 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 123.005 0.522 . . . . 0.0 112.17 -178.931 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 13' ' ' HIS . . . . . 0.576 ' O ' ' HG3' ' B' ' 16' ' ' ARG . 29.4 m170 -59.58 -41.86 91.19 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.736 -0.211 . . . . 0.0 110.49 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 14' ' ' PHE . . . . . 0.507 ' CZ ' ' HB2' ' A' ' 6' ' ' PRO . 8.1 t80 -62.31 -47.51 83.94 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.091 0.472 . . . . 0.0 109.931 178.387 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 56.0 t -55.58 -53.31 37.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.634 -179.645 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 16' ' ' ARG . . . . . 0.576 ' HG3' ' O ' ' B' ' 13' ' ' HIS . 0.0 OUTLIER -63.48 -39.03 93.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.422 -179.525 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 17' ' ' ALA . . . . . 0.42 ' N ' ' HE ' ' B' ' 16' ' ' ARG . . . -65.66 -52.91 47.97 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.557 0.218 . . . . 0.0 111.517 -179.681 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 18' ' ' LEU . . . . . 0.641 HD13 HD23 ' A' ' 23' ' ' LEU . 38.0 tp -57.78 -53.75 54.67 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.825 -179.329 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 19' ' ' VAL . . . . . 0.527 HG12 ' NH1' ' B' ' 20' ' ' ARG . 85.0 t -60.35 -42.85 92.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 -178.997 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 20' ' ' ARG . . . . . 0.723 HH11 ' HA ' ' B' ' 20' ' ' ARG . 2.4 mmt-85 -72.0 -47.98 48.12 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 113.159 0.8 . . . . 0.0 113.159 -178.921 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 21' ' ' VAL . . . . . 0.43 HG11 ' O ' ' A' ' 17' ' ' GLN . 76.6 t -64.74 -46.81 91.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 N-CA-C 112.197 0.443 . . . . 0.0 112.197 -178.879 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 89.5 m . . . . . 0 C--N 1.328 -0.351 0 C-N-CA 120.941 -0.304 . . . . 0.0 111.555 -179.379 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.507 ' HB2' ' CZ ' ' B' ' 14' ' ' PHE . 23.4 Cg_exo . . . . . 0 N--CA 1.462 -0.356 0 N-CA-C 112.646 0.21 . . . . 0.0 112.646 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.19 -43.92 83.12 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.972 0.415 . . . . 0.0 110.75 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -67.87 -48.93 64.7 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.095 179.505 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 33.2 t80 -56.52 -52.99 62.68 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 114.936 -1.029 . . . . 0.0 111.306 -179.702 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.748 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 22.5 m -65.46 -23.9 67.03 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.036 -0.529 . . . . 0.0 112.32 -179.73 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.512 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 53.7 t -82.12 -52.89 6.55 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.413 0.625 . . . . 0.0 110.598 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 15.3 tp -69.71 -63.39 1.08 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.041 -0.982 . . . . 0.0 112.182 -178.902 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 36.3 t -81.3 -33.97 32.27 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.395 -178.682 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.687 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 88.6 158.47 33.82 Favored Glycine 0 N--CA 1.443 -0.887 0 C-N-CA 120.57 -0.824 . . . . 0.0 111.156 -178.541 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.5 ' SG ' HD23 ' B' ' 9' ' ' LEU . 26.5 p -151.04 166.8 29.61 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.818 0.309 . . . . 0.0 110.795 -179.204 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.449 ' H ' ' HB2' ' A' ' 19' ' ' ASP . 0.2 OUTLIER -121.95 -169.97 1.97 Allowed 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 116.444 -0.343 . . . . 0.0 111.323 -179.17 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.43 ' O ' HG11 ' B' ' 21' ' ' VAL . 23.8 pt20 -58.4 -51.71 68.67 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -178.399 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 95.4 mm-40 -63.18 -35.96 82.04 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.449 ' HB2' ' H ' ' A' ' 16' ' ' THR . 43.7 m-20 -58.68 -47.0 86.01 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.033 178.461 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -66.19 -44.68 83.28 Favored 'General case' 0 CA--C 1.522 -0.112 0 CA-C-O 120.878 0.37 . . . . 0.0 110.488 178.86 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 31.0 tp -55.36 -53.36 57.2 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.044 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 35.4 p -64.64 -12.05 41.84 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.093 -0.503 . . . . 0.0 112.24 179.919 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.641 HD23 HD13 ' B' ' 18' ' ' LEU . 24.6 tp -78.66 -28.74 45.44 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 179.688 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 93.2 m . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.672 179.563 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 77.4 tt0 . . . . . 0 C--O 1.238 0.48 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 8' ' ' LYS . . . . . 0.447 ' HA ' ' O ' ' A' ' 10' ' ' CYS . 24.5 mmtp -82.47 104.68 12.93 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 179.383 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 9' ' ' LEU . . . . . 0.769 ' HB2' ' SG ' ' A' ' 10' ' ' CYS . 6.5 mp -81.12 52.04 1.71 Allowed 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 -179.158 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 71.0 m -72.56 121.32 19.5 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.172 178.856 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 61.08 -120.94 24.89 Favored Glycine 0 CA--C 1.522 0.47 0 N-CA-C 114.417 0.527 . . . . 0.0 114.417 179.168 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 13.5 t-80 -50.18 -33.36 18.95 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 113.589 0.959 . . . . 0.0 113.589 -178.082 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 13' ' ' HIS . . . . . 0.604 ' HB3' ' HA ' ' B' ' 9' ' ' LEU . 24.3 m170 -58.34 -41.43 84.62 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.914 -0.315 . . . . 0.0 111.024 -179.117 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 14' ' ' PHE . . . . . 0.714 ' HA ' HD23 ' B' ' 9' ' ' LEU . 22.5 t80 -62.63 -45.09 94.44 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.014 0.435 . . . . 0.0 110.127 179.321 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 51.4 t -59.02 -58.78 5.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.407 -0.815 . . . . 0.0 112.119 -179.801 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 16' ' ' ARG . . . . . 0.402 HH21 HD11 ' B' ' 9' ' ' LEU . 0.0 OUTLIER -59.53 -39.79 85.08 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.872 -179.104 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.01 -43.27 88.17 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.967 -0.293 . . . . 0.0 111.069 -179.933 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 18' ' ' LEU . . . . . 0.44 ' HA ' HD23 ' B' ' 18' ' ' LEU . 9.7 mt -60.01 -56.3 23.43 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.826 179.802 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 7.8 t -65.93 -29.04 45.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -178.569 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 20' ' ' ARG . . . . . 0.571 ' HA ' ' NE ' ' B' ' 20' ' ' ARG . 3.3 tpm_? -80.12 -59.79 2.58 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 119.906 -0.718 . . . . 0.0 111.512 -179.828 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 60.2 t -65.19 -50.28 74.68 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 CA-C-N 115.209 -0.905 . . . . 0.0 111.739 -178.434 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 56.4 m . . . . . 0 C--N 1.322 -0.61 0 CA-C-O 120.926 0.393 . . . . 0.0 110.635 -179.669 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.417 ' HB2' ' CZ ' ' B' ' 14' ' ' PHE . 32.1 Cg_exo . . . . . 0 C--O 1.232 0.201 0 N-CA-C 113.631 0.589 . . . . 0.0 113.631 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.14 -43.32 95.8 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.347 0.594 . . . . 0.0 110.204 179.854 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.655 ' HA ' ' HE ' ' A' ' 8' ' ' ARG . 1.1 mmp_? -67.72 -47.59 68.92 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.956 179.147 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 9.7 t80 -58.04 -53.4 58.72 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.891 -179.88 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.769 ' SG ' ' HB2' ' B' ' 9' ' ' LEU . 9.3 t -69.42 -18.4 63.74 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 112.08 0.4 . . . . 0.0 112.08 -178.41 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 26.9 t -85.51 -51.28 6.62 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.798 0.808 . . . . 0.0 109.879 178.817 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 14.9 tp -66.06 -62.5 1.45 Allowed 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 114.559 -1.2 . . . . 0.0 111.284 -179.798 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 6.8 m -85.07 -45.3 12.23 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.39 -179.165 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.728 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 99.93 144.19 15.7 Favored Glycine 0 N--CA 1.452 -0.264 0 N-CA-C 111.2 -0.76 . . . . 0.0 111.2 -179.077 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.553 ' HB2' ' HB3' ' A' ' 19' ' ' ASP . 24.0 p -134.69 -151.03 0.41 Allowed 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 120.749 -0.38 . . . . 0.0 111.303 -178.475 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.553 ' H ' ' HB2' ' A' ' 19' ' ' ASP . 13.1 t -158.9 176.99 11.63 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -179.099 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 5.7 mp0 -56.62 -45.01 81.76 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 123.289 0.368 . . . . 0.0 110.823 -179.546 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -64.23 -41.61 96.93 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.965 0.412 . . . . 0.0 109.956 179.621 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.553 ' HB3' ' HB2' ' A' ' 15' ' ' CYS . 0.1 OUTLIER -58.73 -38.83 79.21 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.278 -0.873 . . . . 0.0 110.154 178.959 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.582 HD11 HD21 ' B' ' 9' ' ' LEU . 77.5 mt -75.7 -47.26 26.93 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.911 179.292 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 36.3 tp -52.08 -51.96 54.28 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.734 -0.666 . . . . 0.0 112.158 -178.581 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 15.3 t -63.48 -13.03 36.46 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 112.245 0.461 . . . . 0.0 112.245 -179.445 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 39.8 tp -102.73 -16.83 15.87 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.035 -179.824 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 87.4 m . . . . . 0 C--N 1.328 -0.346 0 CA-C-O 120.939 0.399 . . . . 0.0 112.046 -179.092 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 74.2 tt0 . . . . . 0 N--CA 1.444 -0.738 0 N-CA-C 108.374 -0.973 . . . . 0.0 108.374 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 18.0 mmtp -76.06 101.54 5.33 Favored 'General case' 0 C--N 1.315 -0.923 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 179.469 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 9' ' ' LEU . . . . . 1.023 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 8.4 mp -80.91 51.9 1.64 Allowed 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 112.57 0.581 . . . . 0.0 112.57 -178.772 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 73.5 m -70.67 120.21 15.95 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.061 178.645 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 61.65 -120.24 21.55 Favored Glycine 0 CA--C 1.523 0.545 0 N-CA-C 114.542 0.577 . . . . 0.0 114.542 179.207 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 13.3 t-80 -49.56 -33.99 16.39 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 113.751 1.019 . . . . 0.0 113.751 -177.952 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 13' ' ' HIS . . . . . 0.644 ' CB ' ' HA ' ' B' ' 9' ' ' LEU . 25.7 m170 -58.28 -41.27 84.02 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.795 -0.362 . . . . 0.0 110.949 -179.252 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 14' ' ' PHE . . . . . 0.992 ' HA ' HD23 ' B' ' 9' ' ' LEU . 31.7 t80 -62.51 -46.39 88.65 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.898 0.38 . . . . 0.0 110.074 178.866 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 62.1 t -55.5 -57.73 6.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.571 -0.741 . . . . 0.0 112.05 -179.663 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.08 -40.18 92.71 Favored 'General case' 0 N--CA 1.464 0.226 0 N-CA-C 112.342 0.497 . . . . 0.0 112.342 -178.93 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 17' ' ' ALA . . . . . 0.518 ' HB3' HD21 ' B' ' 9' ' ' LEU . . . -70.05 -46.82 64.19 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.612 -179.601 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 57.7 tp -56.76 -52.17 66.05 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.836 -179.877 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 89.7 t -62.47 -48.14 89.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.824 -0.625 . . . . 0.0 112.252 -179.659 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 20' ' ' ARG . . . . . 0.889 ' HE ' ' HA ' ' B' ' 20' ' ' ARG . 0.0 OUTLIER -70.52 -40.85 73.25 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 114.031 1.123 . . . . 0.0 114.031 -178.322 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 71.3 t -73.11 -46.77 50.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -178.233 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 80.6 m . . . . . 0 C--N 1.327 -0.403 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 -178.225 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.688 ' HB3' HD13 ' A' ' 23' ' ' LEU . 16.9 Cg_exo . . . . . 0 N--CA 1.465 -0.161 0 N-CA-C 113.179 0.415 . . . . 0.0 113.179 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.71 -42.07 78.51 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.051 0.453 . . . . 0.0 110.527 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 13.9 ttm180 -61.7 -54.45 42.41 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.012 179.367 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 35.3 t80 -57.57 -49.16 77.3 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.627 -1.17 . . . . 0.0 111.295 -179.705 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 1.023 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 54.3 m -65.23 -27.39 68.63 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.966 -0.561 . . . . 0.0 112.243 -179.365 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 52.2 t -80.83 -52.7 7.2 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.556 0.693 . . . . 0.0 110.23 179.516 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 90.8 mt -64.25 -57.9 8.1 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 114.891 -1.05 . . . . 0.0 112.44 -179.175 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 35.5 t -93.3 -44.35 8.35 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 111.725 0.269 . . . . 0.0 111.725 -179.006 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.652 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 105.26 157.82 22.94 Favored Glycine 0 N--CA 1.452 -0.26 0 N-CA-C 110.924 -0.87 . . . . 0.0 110.924 -178.814 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.533 ' HB2' ' CB ' ' A' ' 19' ' ' ASP . 25.7 p -151.28 159.75 44.18 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 117.343 0.571 . . . . 0.0 112.513 -178.295 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 48.2 p -106.73 -174.41 2.53 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.242 179.583 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 54.9 tt0 -57.42 -48.97 77.73 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 111.933 0.346 . . . . 0.0 111.933 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 60.9 tp60 -59.55 -41.96 91.29 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.109 0.481 . . . . 0.0 109.884 179.703 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.638 ' O ' ' HG ' ' A' ' 23' ' ' LEU . 34.2 m-20 -57.14 -44.94 83.88 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.274 -0.875 . . . . 0.0 109.629 179.061 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.667 HD13 HD12 ' A' ' 23' ' ' LEU . 3.6 mm? -59.65 -48.37 81.93 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-O 120.768 0.318 . . . . 0.0 110.527 178.228 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 8.9 tt -55.62 -47.46 76.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.68 179.472 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 8.3 m -60.59 -25.21 66.05 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.331 -0.85 . . . . 0.0 111.816 179.605 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.688 HD13 ' HB3' ' A' ' 6' ' ' PRO . 96.6 mt -73.09 -30.6 63.79 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.272 179.324 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 7.4 m . . . . . 0 C--N 1.326 -0.419 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.034 178.766 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.446 -0.635 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -80.31 86.4 5.68 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 179.365 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 9' ' ' LEU . . . . . 0.992 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 14.6 mt -74.11 55.1 0.56 Allowed 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 -176.891 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 10' ' ' CYS . . . . . 0.409 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 73.8 m -74.24 117.36 15.96 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 177.878 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 63.46 -121.76 24.92 Favored Glycine 0 CA--C 1.521 0.459 0 C-N-CA 121.157 -0.544 . . . . 0.0 113.78 179.813 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -51.79 -32.08 29.71 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 112.825 0.676 . . . . 0.0 112.825 -178.706 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 13' ' ' HIS . . . . . 0.701 ' CB ' ' HA ' ' B' ' 9' ' ' LEU . 52.0 m170 -57.57 -39.76 77.43 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 120.437 -0.505 . . . . 0.0 110.74 -179.387 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 14' ' ' PHE . . . . . 0.848 ' HA ' HD13 ' B' ' 9' ' ' LEU . 34.4 t80 -62.01 -44.34 96.92 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.331 0.586 . . . . 0.0 109.823 178.766 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 55.1 t -62.02 -49.23 84.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.121 -0.945 . . . . 0.0 111.76 179.867 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 16' ' ' ARG . . . . . 0.649 ' HG2' ' HA ' ' B' ' 13' ' ' HIS . 19.2 ptt180 -62.51 -44.99 95.02 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.731 -178.885 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 17' ' ' ALA . . . . . 0.517 ' N ' ' HG3' ' B' ' 16' ' ' ARG . . . -65.54 -41.28 93.2 Favored 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 120.925 -0.31 . . . . 0.0 111.021 -179.854 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 63.6 tp -59.35 -54.72 43.51 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.175 179.89 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 22.3 m -64.67 -28.11 44.08 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.187 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -179.387 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 20' ' ' ARG . . . . . 0.756 ' NE ' ' HA ' ' B' ' 20' ' ' ARG . 3.5 mmp_? -84.49 -48.93 9.09 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -179.41 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 21' ' ' VAL . . . . . 0.557 HG13 ' HG3' ' A' ' 17' ' ' GLN . 58.4 t -63.54 -47.21 92.56 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.781 -179.245 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 79.3 m . . . . . 0 C--N 1.325 -0.478 0 C-N-CA 120.412 -0.515 . . . . 0.0 111.753 -179.272 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo . . . . . 0 N--CA 1.473 0.301 0 N-CA-C 114.156 0.791 . . . . 0.0 114.156 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -58.83 -41.64 87.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.404 0.621 . . . . 0.0 110.401 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.421 ' HD3' ' HA ' ' A' ' 8' ' ' ARG . 13.4 mmt180 -66.21 -44.45 83.84 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.722 179.051 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 7.1 t80 -58.58 -46.77 86.24 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.093 0.473 . . . . 0.0 110.188 178.848 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.992 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 55.3 m -61.17 -29.42 69.79 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.446 -0.797 . . . . 0.0 112.134 -179.913 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.409 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 44.0 t -86.96 -53.59 4.81 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.552 0.692 . . . . 0.0 111.06 -179.945 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 9.0 mp -62.79 -40.64 97.97 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.857 -1.065 . . . . 0.0 113.433 -178.673 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 19.6 m -113.71 -42.01 3.5 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 121.074 0.464 . . . . 0.0 111.131 -178.876 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.608 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 105.99 144.13 12.04 Favored Glycine 0 N--CA 1.442 -0.929 0 C-N-CA 120.869 -0.681 . . . . 0.0 111.512 -179.073 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.693 ' HB2' ' CB ' ' A' ' 19' ' ' ASP . 31.0 p -139.04 149.58 44.79 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 -179.453 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.533 HG22 ' OD1' ' A' ' 19' ' ' ASP . 6.2 t -111.78 -167.37 1.17 Allowed 'General case' 0 C--N 1.327 -0.384 0 O-C-N 122.256 -0.277 . . . . 0.0 110.702 -179.037 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.557 ' HG3' HG13 ' B' ' 21' ' ' VAL . 53.7 tt0 -53.28 -46.28 69.24 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.199 -0.455 . . . . 0.0 112.067 -179.186 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.404 ' H ' HG23 ' A' ' 16' ' ' THR . 70.2 mt-30 -60.23 -44.33 95.3 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.691 -0.231 . . . . 0.0 110.819 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.693 ' CB ' ' HB2' ' A' ' 15' ' ' CYS . 1.6 m-20 -58.65 -44.62 90.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.237 -0.438 . . . . 0.0 109.918 179.276 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.555 HD21 HD11 ' B' ' 9' ' ' LEU . 3.9 mm? -66.95 -44.82 79.57 Favored 'General case' 0 CA--C 1.52 -0.2 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.787 179.376 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 19.6 tp -56.86 -48.53 77.89 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.912 -179.232 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 18.2 p -63.6 -15.96 59.56 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 179.786 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 45.3 tp -87.01 -24.76 24.55 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.572 179.611 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 79.9 m . . . . . 0 C--N 1.327 -0.381 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.257 -179.539 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 . . . . . 0 N--CA 1.45 -0.466 0 CA-C-O 121.074 0.464 . . . . 0.0 109.77 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 8' ' ' LYS . . . . . 0.452 ' HA ' ' O ' ' A' ' 10' ' ' CYS . 1.5 mppt? -78.85 97.71 6.07 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.546 179.622 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 9' ' ' LEU . . . . . 0.869 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 15.1 mt -76.25 52.48 0.75 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.417 -0.81 . . . . 0.0 112.49 -178.517 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 69.4 m -72.72 120.2 18.01 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 178.649 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 61.06 -118.07 13.79 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 121.244 -0.503 . . . . 0.0 113.891 179.599 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 18.1 t-160 -54.07 -31.68 52.47 Favored 'General case' 0 N--CA 1.465 0.306 0 N-CA-C 113.06 0.763 . . . . 0.0 113.06 -178.471 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 13' ' ' HIS . . . . . 0.632 ' CB ' ' HA ' ' B' ' 9' ' ' LEU . 26.8 m170 -61.22 -38.76 87.76 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 120.164 -0.614 . . . . 0.0 111.187 -178.668 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 14' ' ' PHE . . . . . 0.793 ' HA ' HD13 ' B' ' 9' ' ' LEU . 33.0 t80 -61.19 -45.0 96.4 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 178.567 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 56.4 t -62.01 -50.92 78.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 114.972 -1.013 . . . . 0.0 111.753 179.776 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 16' ' ' ARG . . . . . 0.615 ' HG3' ' O ' ' B' ' 13' ' ' HIS . 4.4 ppt_? -61.88 -42.83 99.53 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 112.258 0.466 . . . . 0.0 112.258 -178.414 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -70.33 -45.85 65.35 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 121.01 -0.276 . . . . 0.0 111.406 -179.446 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 18' ' ' LEU . . . . . 0.538 ' HB2' ' O ' ' B' ' 14' ' ' PHE . 0.4 OUTLIER -56.63 -54.41 46.41 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.647 -179.869 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 90.8 t -62.26 -48.25 89.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -178.819 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 24.6 mmm-85 -67.63 -45.06 76.47 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 114.245 1.202 . . . . 0.0 114.245 -178.23 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 99.4 t -76.2 -42.95 37.68 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 N-CA-C 113.01 0.745 . . . . 0.0 113.01 -177.671 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 99.0 m . . . . . 0 C--N 1.324 -0.531 0 N-CA-C 113.347 0.869 . . . . 0.0 113.347 -177.987 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_exo . . . . . 0 N--CA 1.469 0.061 0 N-CA-C 113.351 0.481 . . . . 0.0 113.351 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -58.8 -42.56 89.4 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.303 0.573 . . . . 0.0 110.296 179.822 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.433 ' HD3' ' HA ' ' A' ' 8' ' ' ARG . 14.4 tpp180 -64.96 -50.06 67.87 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.36 -0.836 . . . . 0.0 109.742 179.026 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 31.8 t80 -55.86 -49.58 72.96 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.573 -1.194 . . . . 0.0 111.214 179.806 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.869 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 56.5 m -68.11 -29.14 68.0 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.0 -0.545 . . . . 0.0 112.398 -179.323 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 44.7 t -79.16 -55.05 5.39 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.369 0.604 . . . . 0.0 110.902 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 11.2 mp -67.14 -47.34 71.36 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.266 -0.879 . . . . 0.0 112.562 -179.024 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.5 m -100.98 -52.67 3.23 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.931 0.396 . . . . 0.0 111.323 -179.223 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.626 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 115.29 161.67 13.23 Favored Glycine 0 N--CA 1.445 -0.754 0 C-N-CA 120.36 -0.924 . . . . 0.0 112.295 -179.898 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.439 ' HB2' ' HB2' ' A' ' 19' ' ' ASP . 21.4 p -155.1 153.58 31.07 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.899 0.38 . . . . 0.0 110.206 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 72.0 p -103.08 179.9 4.14 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.319 -179.373 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 5.9 mp0 -58.04 -39.76 79.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.245 179.295 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 10.8 mm100 -63.5 -40.88 98.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.3 179.215 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.439 ' HB2' ' HB2' ' A' ' 15' ' ' CYS . 51.4 m-20 -61.23 -42.79 99.23 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.457 178.934 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.734 HD21 HD11 ' B' ' 9' ' ' LEU . 3.6 mm? -66.11 -45.6 80.56 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.365 178.541 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 25.7 tp -56.84 -42.38 79.54 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.848 -179.619 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 19.7 m -65.65 -21.07 66.53 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.345 0.593 . . . . 0.0 111.327 179.676 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 33.8 tp -86.33 -1.28 57.38 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.946 179.852 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 74.3 m . . . . . 0 C--N 1.324 -0.513 0 CA-C-O 120.947 0.403 . . . . 0.0 111.451 -179.582 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 7' ' ' GLU . . . . . 0.555 ' HG3' HD23 ' B' ' 9' ' ' LEU . 11.8 tp10 . . . . . 0 N--CA 1.447 -0.614 0 CA-C-O 121.46 0.648 . . . . 0.0 110.309 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 8' ' ' LYS . . . . . 0.439 ' HD3' ' N ' ' B' ' 8' ' ' LYS . 0.7 OUTLIER -82.87 95.33 7.91 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 179.876 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 9' ' ' LEU . . . . . 0.787 HD13 ' HA ' ' B' ' 14' ' ' PHE . 18.8 mt -77.45 54.47 1.16 Allowed 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 -177.561 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 10' ' ' CYS . . . . . 0.413 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 74.4 m -72.51 121.06 19.02 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.039 178.307 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 57.97 -120.21 20.57 Favored Glycine 0 CA--C 1.52 0.392 0 C-N-CA 121.34 -0.457 . . . . 0.0 113.892 179.323 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -52.77 -30.71 34.42 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -178.988 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 13' ' ' HIS . . . . . 0.628 ' HA ' ' HG2' ' B' ' 16' ' ' ARG . 46.9 m170 -58.46 -41.84 86.08 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 120.438 -0.505 . . . . 0.0 110.682 -179.456 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 14' ' ' PHE . . . . . 0.787 ' HA ' HD13 ' B' ' 9' ' ' LEU . 34.3 t80 -60.88 -44.39 97.14 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.217 0.532 . . . . 0.0 109.753 178.766 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 46.9 t -61.15 -50.59 79.87 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.254 -0.885 . . . . 0.0 111.751 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 16' ' ' ARG . . . . . 0.628 ' HG2' ' HA ' ' B' ' 13' ' ' HIS . 18.5 ptt180 -62.05 -45.31 94.1 Favored 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -178.723 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 17' ' ' ALA . . . . . 0.537 ' N ' ' HG3' ' B' ' 16' ' ' ARG . . . -67.53 -43.43 80.8 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 111.76 0.281 . . . . 0.0 111.76 -179.216 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 18' ' ' LEU . . . . . 0.571 ' O ' ' HB2' ' B' ' 22' ' ' CYS . 3.7 tt -60.61 -55.38 34.04 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 110.118 -0.327 . . . . 0.0 110.118 -179.799 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 83.5 t -57.28 -41.43 78.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.166 -0.47 . . . . 0.0 112.217 -179.605 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 20' ' ' ARG . . . . . 0.593 ' NE ' ' HA ' ' B' ' 20' ' ' ARG . 4.0 tpm_? -78.95 -60.87 2.21 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 113.32 0.859 . . . . 0.0 113.32 -178.517 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 63.0 t -65.44 -45.68 92.22 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.85 0 N-CA-C 114.004 1.113 . . . . 0.0 114.004 -176.489 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 22' ' ' CYS . . . . . 0.571 ' HB2' ' O ' ' B' ' 18' ' ' LEU . 73.0 m . . . . . 0 C--N 1.327 -0.408 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -178.271 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo . . . . . 0 N--CA 1.472 0.216 0 N-CA-C 114.091 0.766 . . . . 0.0 114.091 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.86 -43.25 98.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.4 0.619 . . . . 0.0 110.169 179.79 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 26.1 ttm180 -66.28 -49.07 68.34 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.258 -0.883 . . . . 0.0 109.885 179.212 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 16.2 t80 -54.93 -50.76 68.05 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 114.452 -1.249 . . . . 0.0 111.33 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.656 ' SG ' ' HG ' ' B' ' 9' ' ' LEU . 35.5 t -73.01 -12.67 61.01 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.798 0.332 . . . . 0.0 111.713 -179.15 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.413 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 16.0 t -83.99 -53.55 5.48 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 121.723 0.773 . . . . 0.0 109.075 178.36 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.9 mp -69.81 -45.21 68.41 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.376 -1.283 . . . . 0.0 112.67 -179.73 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 8.3 m -98.36 -34.78 10.54 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 112.174 0.435 . . . . 0.0 112.174 -178.218 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.604 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 87.76 150.52 19.73 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.642 -0.79 . . . . 0.0 112.105 -179.026 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.62 ' HB2' ' CB ' ' A' ' 19' ' ' ASP . 32.1 p -148.28 148.73 30.77 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.845 0.355 . . . . 0.0 110.152 -179.216 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 65.1 p -94.13 -176.63 4.05 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.95 0.405 . . . . 0.0 111.448 -178.545 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.453 ' H ' ' CD ' ' A' ' 17' ' ' GLN . 0.3 OUTLIER -60.78 -40.2 91.71 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 115.956 -0.566 . . . . 0.0 109.785 178.321 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 37.2 tt0 -60.29 -45.04 94.72 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.25 -0.886 . . . . 0.0 109.531 178.498 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.62 ' CB ' ' HB2' ' A' ' 15' ' ' CYS . 12.3 m-20 -56.26 -45.84 79.9 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 114.997 -1.001 . . . . 0.0 109.762 178.897 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.638 HD21 HD11 ' B' ' 9' ' ' LEU . 3.2 mm? -63.96 -44.7 91.99 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.543 178.491 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 32.0 tp -56.7 -45.85 81.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.413 -179.284 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.0 p -66.19 -10.75 44.47 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -179.835 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.411 HD13 ' HA ' ' A' ' 23' ' ' LEU . 4.0 mm? -109.39 12.42 24.66 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.601 -0.272 . . . . 0.0 111.26 179.57 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 96.1 m . . . . . 0 C--N 1.328 -0.339 0 CA-C-O 121.192 0.52 . . . . 0.0 111.491 179.709 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.237 0.417 0 N-CA-C 109.533 -0.544 . . . . 0.0 109.533 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 8' ' ' LYS . . . . . 0.476 ' NZ ' ' HB2' ' B' ' 8' ' ' LYS . 4.8 mtmp? -73.17 96.29 2.21 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.293 179.943 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 9' ' ' LEU . . . . . 0.684 ' HB2' ' SG ' ' A' ' 10' ' ' CYS . 96.6 mt -88.01 58.9 5.05 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.4 0.619 . . . . 0.0 111.307 -179.723 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 10' ' ' CYS . . . . . 0.453 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 99.5 m -64.45 136.86 57.5 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.611 -0.722 . . . . 0.0 112.001 179.827 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 57.42 -125.05 37.96 Favored Glycine 0 CA--C 1.518 0.266 0 CA-C-N 115.644 -0.707 . . . . 0.0 114.809 177.96 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 15.4 t-160 -50.69 -31.45 16.46 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 123.325 0.65 . . . . 0.0 112.736 -178.228 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 13' ' ' HIS . . . . . 0.419 ' HB3' ' CD2' ' B' ' 9' ' ' LEU . 22.6 m170 -59.51 -43.68 93.31 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 121.216 -0.194 . . . . 0.0 111.134 -179.42 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 14' ' ' PHE . . . . . . . . . . . . . 34.6 t80 -64.05 -42.3 97.09 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.168 0.509 . . . . 0.0 109.86 178.927 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 15' ' ' VAL . . . . . 0.651 ' O ' HG23 ' B' ' 19' ' ' VAL . 39.3 t -58.84 -56.67 15.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.379 -179.935 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 16' ' ' ARG . . . . . 0.533 ' HD3' ' N ' ' B' ' 17' ' ' ALA . 0.0 OUTLIER -61.07 -35.06 75.95 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-O 120.754 0.311 . . . . 0.0 110.971 -179.676 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 17' ' ' ALA . . . . . 0.533 ' N ' ' HD3' ' B' ' 16' ' ' ARG . . . -64.15 -46.76 82.61 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.48 179.109 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 21.2 mt -60.51 -45.92 92.03 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.433 179.452 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 19' ' ' VAL . . . . . 0.651 HG23 ' O ' ' B' ' 15' ' ' VAL . 14.7 t -60.62 -39.55 81.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-O 120.939 0.4 . . . . 0.0 110.8 -179.737 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 31.4 tpt85 -74.27 -57.67 3.8 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.286 0.565 . . . . 0.0 112.081 -179.657 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 21' ' ' VAL . . . . . 0.672 HG22 ' HG3' ' A' ' 17' ' ' GLN . 65.2 t -65.9 -57.36 10.95 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.892 0 CA-C-N 114.706 -1.134 . . . . 0.0 113.502 -177.019 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 56.8 m . . . . . 0 C--N 1.324 -0.542 0 CA-C-O 120.883 0.373 . . . . 0.0 111.527 -178.219 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo . . . . . 0 C--O 1.235 0.338 0 N-CA-C 113.446 0.518 . . . . 0.0 113.446 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.31 -46.35 90.19 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.202 0.525 . . . . 0.0 110.64 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.442 ' HD3' ' HA ' ' A' ' 8' ' ' ARG . 3.6 mmt180 -68.8 -39.35 80.16 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.121 179.484 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 31.3 t80 -57.93 -53.43 58.34 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.081 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.684 ' SG ' ' HB2' ' B' ' 9' ' ' LEU . 49.0 t -69.46 -18.35 63.71 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.018 0.437 . . . . 0.0 111.487 -179.64 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.453 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 16.2 t -81.09 -53.02 6.76 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.474 0.654 . . . . 0.0 110.47 179.401 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 94.2 mt -75.37 -57.88 3.62 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.044 -0.98 . . . . 0.0 112.51 -179.131 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 14.2 m -81.98 -29.4 32.15 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.823 0.344 . . . . 0.0 111.72 -178.783 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.58 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 86.13 147.66 10.71 Favored Glycine 0 N--CA 1.447 -0.59 0 C-N-CA 120.533 -0.841 . . . . 0.0 111.648 -178.914 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 18.1 p -139.84 -160.03 1.02 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.885 0.342 . . . . 0.0 110.529 -179.885 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.615 ' CG2' ' HB2' ' A' ' 19' ' ' ASP . 2.8 t -160.19 -178.65 7.12 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 -179.086 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.672 ' HG3' HG22 ' B' ' 21' ' ' VAL . 38.1 tt0 -62.7 -54.5 38.33 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -179.341 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 36.0 tt0 -63.11 -34.17 77.02 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 179.985 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.615 ' HB2' ' CG2' ' A' ' 16' ' ' THR . 13.7 t70 -61.95 -45.77 92.2 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.949 179.076 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 53.2 mt -69.15 -42.72 75.57 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.523 179.498 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 32.4 tp -55.84 -52.48 63.88 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.349 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 16.1 p -65.37 -11.5 42.86 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.971 179.364 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 48.8 tp -93.6 -26.8 16.94 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.188 -0.46 . . . . 0.0 109.965 179.108 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 80.5 m . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.874 -179.868 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 . . . . . 0 N--CA 1.45 -0.461 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 8' ' ' LYS . . . . . 0.43 ' HE2' ' HB2' ' B' ' 8' ' ' LYS . 25.3 mtmm -67.91 97.44 0.66 Allowed 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.957 -178.981 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 9' ' ' LEU . . . . . 0.639 ' HB2' ' SG ' ' A' ' 10' ' ' CYS . 84.1 mt -88.9 53.24 2.63 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.275 0.559 . . . . 0.0 110.752 179.581 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 10' ' ' CYS . . . . . 0.405 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 96.6 m -60.18 138.72 57.86 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.788 -179.931 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 66.95 -133.88 31.73 Favored Glycine 0 N--CA 1.451 -0.327 0 CA-C-N 115.668 -0.696 . . . . 0.0 114.824 178.334 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 17.5 t-160 -52.47 -29.25 23.85 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 -178.077 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 13' ' ' HIS . . . . . 0.591 ' HB3' HD22 ' B' ' 9' ' ' LEU . 22.7 m170 -58.6 -46.11 87.71 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.471 0.177 . . . . 0.0 111.286 -179.147 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 14' ' ' PHE . . . . . 0.581 ' CZ ' ' HB2' ' A' ' 6' ' ' PRO . 54.0 t80 -63.22 -45.19 92.82 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 178.509 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 40.6 t -54.2 -54.56 20.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.473 -179.608 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 16' ' ' ARG . . . . . 0.58 ' HG3' ' O ' ' B' ' 13' ' ' HIS . 0.0 OUTLIER -61.75 -42.74 99.36 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.852 -0.339 . . . . 0.0 111.598 -179.481 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 17' ' ' ALA . . . . . 0.509 ' N ' ' HE ' ' B' ' 16' ' ' ARG . . . -63.68 -52.39 60.88 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 -179.953 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 18' ' ' LEU . . . . . 0.503 HD22 ' CZ ' ' B' ' 14' ' ' PHE . 16.2 tp -64.57 -53.84 41.59 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.264 -179.044 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 83.1 t -58.31 -40.31 77.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -178.295 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 20' ' ' ARG . . . . . 0.999 ' HA ' ' HE ' ' B' ' 20' ' ' ARG . 1.0 OUTLIER -82.29 -46.53 13.53 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 114.183 1.179 . . . . 0.0 114.183 -178.658 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 21' ' ' VAL . . . . . 0.489 HG21 ' HB3' ' A' ' 17' ' ' GLN . 72.8 t -73.83 -45.49 49.53 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 N-CA-C 113.447 0.906 . . . . 0.0 113.447 -177.778 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 22' ' ' CYS . . . . . 0.44 ' SG ' HD12 ' B' ' 18' ' ' LEU . 63.6 m . . . . . 0 C--N 1.328 -0.355 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 -178.4 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.581 ' HB2' ' CZ ' ' B' ' 14' ' ' PHE . 24.0 Cg_exo . . . . . 0 N--CA 1.463 -0.266 0 N-CA-C 112.853 0.29 . . . . 0.0 112.853 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.94 -47.12 83.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.212 0.529 . . . . 0.0 110.527 179.885 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.409 ' HA ' ' HD2' ' A' ' 8' ' ' ARG . 14.0 tpt85 -66.73 -48.07 70.33 Favored 'General case' 0 CA--C 1.511 -0.532 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.698 179.222 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 10.5 t80 -52.23 -57.07 10.8 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 114.33 -1.305 . . . . 0.0 112.0 -179.518 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.65 ' O ' ' HA2' ' A' ' 14' ' ' GLY . 18.1 t -66.25 -19.83 65.94 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -178.535 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.405 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 14.4 t -84.89 -53.08 5.55 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.641 0.734 . . . . 0.0 110.427 179.453 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 15.0 tp -72.28 -62.52 1.41 Allowed 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 114.89 -1.05 . . . . 0.0 111.923 -179.138 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 14.7 m -79.86 -28.25 40.02 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.339 -178.829 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.65 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 85.7 152.52 19.28 Favored Glycine 0 N--CA 1.445 -0.714 0 C-N-CA 120.669 -0.777 . . . . 0.0 111.84 -179.267 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 9.1 p -151.57 -163.05 1.66 Allowed 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 179.451 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.612 HG22 ' HB2' ' A' ' 19' ' ' ASP . 13.4 t -153.33 168.52 25.78 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 108.37 -0.974 . . . . 0.0 108.37 179.493 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.49 ' NE2' ' H ' ' A' ' 17' ' ' GLN . 0.0 OUTLIER -55.25 -48.27 74.21 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.616 0.246 . . . . 0.0 111.39 -178.858 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 8.7 mp0 -62.78 -38.07 89.15 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.475 179.712 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.612 ' HB2' HG22 ' A' ' 16' ' ' THR . 30.3 t70 -61.5 -44.03 97.8 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.782 179.371 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 67.9 mt -68.1 -39.91 82.72 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.258 178.687 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 49.9 tp -57.93 -43.55 86.35 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.704 179.469 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 36.3 p -69.61 0.77 4.9 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 120.964 0.411 . . . . 0.0 111.865 179.762 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 89.1 mt -117.01 9.92 13.82 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.007 179.241 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 75.4 m . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.331 -179.221 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 7' ' ' GLU . . . . . 0.4 ' HG2' ' N ' ' B' ' 8' ' ' LYS . 22.3 tt0 . . . . . 0 N--CA 1.448 -0.565 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 8' ' ' LYS . . . . . 0.444 ' HA ' ' O ' ' A' ' 10' ' ' CYS . 55.2 mttm -86.8 95.52 9.87 Favored 'General case' 0 C--N 1.312 -1.065 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 178.447 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 9' ' ' LEU . . . . . 0.739 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 2.8 mm? -76.65 57.08 1.21 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.81 -0.632 . . . . 0.0 112.249 -178.472 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 10' ' ' CYS . . . . . 0.442 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 93.7 m -74.26 124.91 27.3 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.158 179.313 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 52.25 -115.04 3.77 Favored Glycine 0 CA--C 1.519 0.304 0 CA-C-N 115.897 -0.592 . . . . 0.0 114.326 178.617 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 12' ' ' HIS . . . . . 0.424 ' O ' ' HG3' ' B' ' 16' ' ' ARG . 15.6 t-160 -51.29 -31.69 22.27 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 123.131 0.573 . . . . 0.0 112.396 -178.97 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 13' ' ' HIS . . . . . 0.672 ' HB3' ' HA ' ' B' ' 9' ' ' LEU . 27.0 m170 -62.39 -42.82 99.72 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 120.695 -0.402 . . . . 0.0 110.589 -179.67 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 14' ' ' PHE . . . . . . . . . . . . . 19.3 t80 -60.49 -38.85 85.61 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 178.996 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 15' ' ' VAL . . . . . 0.417 ' O ' HG23 ' B' ' 19' ' ' VAL . 65.1 t -60.97 -57.5 11.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.386 -0.825 . . . . 0.0 111.4 179.497 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 16' ' ' ARG . . . . . 0.492 ' HD3' ' N ' ' B' ' 17' ' ' ALA . 0.0 OUTLIER -63.85 -28.54 69.92 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 120.964 -0.295 . . . . 0.0 111.322 179.93 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 17' ' ' ALA . . . . . 0.698 ' HB1' HD13 ' A' ' 20' ' ' LEU . . . -63.75 -53.08 56.65 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.29 179.188 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 100.0 mt -60.77 -46.79 89.09 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.732 179.285 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 19' ' ' VAL . . . . . 0.645 HG12 ' HE ' ' B' ' 20' ' ' ARG . 71.8 t -58.43 -38.51 70.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.621 -0.718 . . . . 0.0 112.825 -179.35 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 20' ' ' ARG . . . . . 0.645 ' HE ' HG12 ' B' ' 19' ' ' VAL . 0.0 OUTLIER -93.27 -43.75 8.65 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 -178.171 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 94.7 t -70.7 -40.82 77.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -178.75 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 52.5 m . . . . . 0 C--N 1.323 -0.558 0 C-N-CA 120.907 -0.317 . . . . 0.0 111.538 -179.126 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.565 ' HB3' HD13 ' A' ' 23' ' ' LEU . 27.8 Cg_exo . . . . . 0 CA--C 1.527 0.136 0 N-CA-C 113.487 0.533 . . . . 0.0 113.487 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -58.73 -44.86 90.57 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.402 0.62 . . . . 0.0 110.408 179.781 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.455 ' HD3' ' HA ' ' A' ' 8' ' ' ARG . 12.0 mmt85 -67.47 -45.48 75.81 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.698 178.991 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 26.9 t80 -58.44 -48.73 79.76 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.088 179.784 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.739 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 61.9 m -65.9 -23.42 66.63 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.968 -179.811 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.442 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 37.6 t -88.2 -59.58 2.2 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.433 0.635 . . . . 0.0 110.475 179.531 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 13.0 tp -55.3 -54.2 46.5 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.848 -1.069 . . . . 0.0 111.083 -179.629 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 14.3 m -96.48 -59.52 1.81 Allowed 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.977 -179.913 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.696 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 121.48 156.14 9.67 Favored Glycine 0 N--CA 1.452 -0.29 0 N-CA-C 110.82 -0.912 . . . . 0.0 110.82 -179.692 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.683 ' SG ' HD23 ' B' ' 9' ' ' LEU . 31.3 p -150.56 155.75 40.05 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 117.546 0.673 . . . . 0.0 111.574 -178.985 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 72.8 p -91.01 -173.28 3.61 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.017 -179.495 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 88.9 mt-30 -69.14 -40.13 78.43 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 177.979 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 62.6 mt-30 -65.79 -39.55 91.07 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.535 178.674 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.589 ' CB ' ' HB2' ' A' ' 15' ' ' CYS . 38.5 m-20 -59.51 -47.19 86.48 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 178.212 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.698 HD13 ' HB1' ' B' ' 17' ' ' ALA . 30.6 mt -63.8 -45.99 87.19 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.804 179.026 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -55.04 -45.14 75.19 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.237 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 23.9 m -60.93 -25.04 66.49 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.557 179.658 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.565 HD13 ' HB3' ' A' ' 6' ' ' PRO . 85.2 mt -79.48 -24.64 42.22 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.593 179.301 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 56.5 m . . . . . 0 C--N 1.325 -0.481 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.126 -179.623 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 1' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo . . . . . 0 N--CA 1.478 0.612 0 N-CA-C 110.435 -0.64 . . . . 0.0 110.435 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 2' ' ' THR . . . . . 0.653 ' O ' ' HG2' ' B' ' 4' ' ' GLU . 0.2 OUTLIER -152.55 176.12 2.57 Favored Pre-proline 0 C--N 1.32 -0.702 0 CA-C-N 115.171 -0.922 . . . . 0.0 108.958 -178.761 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 3' ' ' PRO . . . . . 0.567 ' HD2' ' HB ' ' B' ' 2' ' ' THR . 57.0 Cg_endo -69.91 53.34 1.13 Allowed 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 122.645 2.23 . . . . 0.0 111.69 179.214 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 4' ' ' GLU . . . . . 0.653 ' HG2' ' O ' ' B' ' 2' ' ' THR . 5.9 pt-20 -79.22 142.27 36.39 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 114.175 -1.375 . . . . 0.0 111.817 -178.824 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 5' ' ' MET . . . . . . . . . . . . . 59.5 ttp -84.8 129.45 34.82 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.683 179.234 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 6' ' ' ARG . . . . . 0.646 ' HG2' HG23 ' A' ' 16' ' ' THR . 52.5 mtt180 -64.15 122.6 16.99 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.186 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 -88.46 133.07 34.23 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 179.384 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 65.5 mttm -72.97 97.15 2.24 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.643 0.735 . . . . 0.0 109.324 179.261 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 9' ' ' LEU . . . . . 0.769 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 61.1 mt -79.1 56.22 1.97 Allowed 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 114.85 -1.068 . . . . 0.0 113.295 -177.407 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 10' ' ' CYS . . . . . 0.496 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 88.8 m -74.06 125.09 27.54 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.266 178.42 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 61.05 -126.47 40.65 Favored Glycine 0 N--CA 1.452 -0.296 0 CA-C-N 116.075 -0.511 . . . . 0.0 113.697 179.601 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 12' ' ' HIS . . . . . 0.597 ' O ' ' HG2' ' B' ' 16' ' ' ARG . 3.5 t60 -55.01 -25.73 32.22 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -179.117 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 13' ' ' HIS . . . . . 0.603 ' HB3' ' HA ' ' B' ' 9' ' ' LEU . 51.6 m170 -56.12 -42.16 76.43 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.908 -0.317 . . . . 0.0 111.03 -179.255 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 14' ' ' PHE . . . . . 0.583 ' HA ' ' HB3' ' B' ' 9' ' ' LEU . 36.0 t80 -60.18 -45.83 91.79 Favored 'General case' 0 C--N 1.328 -0.34 0 O-C-N 123.43 0.456 . . . . 0.0 110.235 178.975 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 15' ' ' VAL . . . . . 0.563 ' O ' HG23 ' B' ' 19' ' ' VAL . 93.1 t -59.12 -56.89 14.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.496 -0.774 . . . . 0.0 112.228 -179.777 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 16' ' ' ARG . . . . . 0.597 ' HG2' ' O ' ' B' ' 12' ' ' HIS . 1.9 ptm180 -60.0 -38.56 82.97 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 120.736 0.303 . . . . 0.0 111.603 -179.727 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 17' ' ' ALA . . . . . 0.817 ' HA ' ' HE ' ' B' ' 20' ' ' ARG . . . -66.43 -41.57 88.99 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.823 0.344 . . . . 0.0 110.381 179.31 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 18' ' ' LEU . . . . . 0.898 ' HG ' ' HE1' ' B' ' 27' ' ' TRP . 53.0 tp -58.02 -45.44 86.89 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.727 179.056 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 19' ' ' VAL . . . . . 0.563 HG23 ' O ' ' B' ' 15' ' ' VAL . 40.6 t -62.39 -44.77 99.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.609 178.885 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 20' ' ' ARG . . . . . 0.817 ' HE ' ' HA ' ' B' ' 17' ' ' ALA . 81.5 mtm180 -57.0 -50.18 73.5 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.67 -0.696 . . . . 0.0 112.801 -179.309 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 21' ' ' VAL . . . . . 0.54 HG22 ' HG3' ' A' ' 17' ' ' GLN . 74.2 t -76.84 -53.19 15.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 N-CA-C 113.888 1.07 . . . . 0.0 113.888 -177.131 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 81.9 m -65.61 -43.53 89.36 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 111.94 0.348 . . . . 0.0 111.94 -178.103 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 144.97 125.4 1.8 Allowed Glycine 0 N--CA 1.446 -0.668 0 C-N-CA 120.177 -1.011 . . . . 0.0 112.755 179.755 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -63.86 -58.92 9.46 Favored Glycine 0 CA--C 1.522 0.492 0 C-N-CA 121.128 -0.558 . . . . 0.0 112.668 179.66 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_exo -72.04 57.57 2.68 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 123.052 2.501 . . . . 0.0 112.799 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -166.26 -34.06 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.339 179.582 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 27' ' ' TRP . . . . . 0.898 ' HE1' ' HG ' ' B' ' 18' ' ' LEU . 0.1 OUTLIER -75.41 58.67 1.01 Allowed 'General case' 0 CA--C 1.507 -0.688 0 CA-C-O 122.837 1.303 . . . . 0.0 111.032 -179.701 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 23.0 t -93.66 23.99 4.36 Favored 'General case' 0 C--N 1.3 -1.555 0 CA-C-N 112.622 -2.081 . . . . 0.0 110.636 -179.371 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 11.4 t -178.55 -33.0 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.08 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -86.46 32.04 0.65 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.71 -178.852 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 31' ' ' ALA . . . . . 0.52 ' HB2' ' CD1' ' B' ' 27' ' ' TRP . . . . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.578 -0.725 . . . . 0.0 109.863 -179.623 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.138 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -69.36 148.6 49.45 Favored 'General case' 0 C--N 1.328 -0.343 0 O-C-N 123.171 0.294 . . . . 0.0 110.607 179.423 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -168.24 122.31 0.92 Allowed 'General case' 0 N--CA 1.45 -0.425 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.6 m -75.29 54.72 0.73 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.859 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -173.73 116.11 0.35 Allowed Pre-proline 0 C--N 1.325 -0.467 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 -179.419 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -57.08 -48.36 18.52 Favored 'Trans proline' 0 CA--C 1.528 0.181 0 C-N-CA 123.132 2.555 . . . . 0.0 113.473 -178.509 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -59.3 -42.78 92.13 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.309 0.576 . . . . 0.0 110.456 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 5.7 tpt85 -67.89 -45.8 73.43 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.973 179.273 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 32.0 t80 -57.39 -47.46 81.62 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 114.78 -1.1 . . . . 0.0 110.78 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.769 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 89.3 m -65.45 -30.8 71.63 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.139 179.813 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.496 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 26.7 t -75.87 -57.18 4.03 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.583 0.706 . . . . 0.0 110.706 179.63 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 92.8 mt -59.91 -55.93 28.01 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 114.932 -1.031 . . . . 0.0 112.1 -179.3 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.2 m -92.02 -63.65 1.21 Allowed 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.194 -179.373 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.571 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 133.85 158.07 8.48 Favored Glycine 0 N--CA 1.451 -0.345 0 N-CA-C 110.686 -0.966 . . . . 0.0 110.686 -179.521 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 93.2 m -140.33 145.16 36.84 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 117.43 0.615 . . . . 0.0 111.79 -179.449 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.646 HG23 ' HG2' ' B' ' 6' ' ' ARG . 63.5 p -100.89 -168.64 1.59 Allowed 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.544 179.702 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.54 ' HG3' HG22 ' B' ' 21' ' ' VAL . 49.8 tt0 -69.78 -41.4 75.18 Favored 'General case' 0 CA--C 1.512 -0.487 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 177.979 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 66.7 tp60 -62.96 -45.92 90.15 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.801 179.197 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 63.1 m-20 -57.04 -46.72 82.2 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.326 -0.852 . . . . 0.0 109.9 179.177 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.534 HD11 ' HB1' ' B' ' 17' ' ' ALA . 54.7 mt -69.11 -39.81 78.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.925 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 30.3 tp -58.42 -39.45 79.8 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.99 0.424 . . . . 0.0 110.539 -179.649 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.6 m -63.99 -21.38 66.47 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.062 179.408 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -97.69 -4.43 37.31 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.685 179.729 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.433 ' HA ' ' HD3' ' A' ' 25' ' ' PRO . 93.1 m -72.51 132.77 83.38 Favored Pre-proline 0 C--N 1.33 -0.251 0 CA-C-O 121.075 0.465 . . . . 0.0 110.831 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 24' ' ' CYS . 73.0 Cg_endo -93.72 -160.72 0.08 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.136 0 C-N-CA 123.474 2.783 . . . . 0.0 112.28 179.777 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 3.2 p90 . . . . . 0 C--O 1.247 0.95 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.995 178.844 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 1' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo . . . . . 0 N--CA 1.483 0.866 0 N-CA-C 110.699 -0.539 . . . . 0.0 110.699 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 2' ' ' THR . . . . . 0.422 ' HA ' ' HD3' ' B' ' 3' ' ' PRO . 11.1 m -90.4 134.82 30.41 Favored Pre-proline 0 C--N 1.318 -0.764 0 CA-C-N 115.3 -0.864 . . . . 0.0 110.144 179.832 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 3' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' B' ' 2' ' ' THR . 32.8 Cg_exo -58.64 115.2 2.38 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.646 2.231 . . . . 0.0 111.922 -179.633 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 4' ' ' GLU . . . . . 0.719 ' HG2' ' H ' ' B' ' 5' ' ' MET . 35.1 tt0 -176.28 -169.04 0.28 Allowed 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 -179.281 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 5' ' ' MET . . . . . 0.719 ' H ' ' HG2' ' B' ' 4' ' ' GLU . 26.4 ttt -82.98 112.92 20.19 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 178.661 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 6' ' ' ARG . . . . . 0.992 ' HG2' HG23 ' A' ' 16' ' ' THR . 40.2 mtp85 -86.81 111.16 20.48 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.951 -0.388 . . . . 0.0 109.951 179.863 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -88.32 129.73 35.31 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.287 -0.635 . . . . 0.0 109.287 179.326 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 8' ' ' LYS . . . . . 0.447 ' HA ' ' O ' ' A' ' 10' ' ' CYS . 65.6 mttm -73.98 94.82 2.4 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 178.818 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 9' ' ' LEU . . . . . 0.729 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 28.7 mt -76.18 55.33 0.94 Allowed 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 114.794 -1.093 . . . . 0.0 113.93 -176.643 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 10' ' ' CYS . . . . . 0.445 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 75.1 m -74.87 117.69 17.0 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 177.99 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 61.18 -121.64 27.02 Favored Glycine 0 CA--C 1.521 0.411 0 C-N-CA 121.09 -0.576 . . . . 0.0 113.695 179.811 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 14.8 t-160 -53.47 -28.67 31.79 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -178.911 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 13' ' ' HIS . . . . . 0.624 ' CB ' ' HA ' ' B' ' 9' ' ' LEU . 49.6 m170 -58.37 -40.71 83.04 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.766 -0.373 . . . . 0.0 110.707 -179.288 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 14' ' ' PHE . . . . . 0.653 ' HA ' HD13 ' B' ' 9' ' ' LEU . 21.4 t80 -58.55 -45.79 88.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.347 0.594 . . . . 0.0 109.8 178.897 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 15' ' ' VAL . . . . . 0.541 ' O ' HG23 ' B' ' 19' ' ' VAL . 94.6 t -63.04 -53.76 42.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.892 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 16' ' ' ARG . . . . . 0.605 ' O ' ' HG3' ' B' ' 20' ' ' ARG . 0.0 OUTLIER -61.27 -40.35 93.76 Favored 'General case' 0 N--CA 1.462 0.154 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 -179.038 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.41 -41.05 89.85 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 121.027 -0.269 . . . . 0.0 110.436 179.41 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 10.7 mt -56.45 -49.81 73.53 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.342 178.933 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 19' ' ' VAL . . . . . 0.541 HG23 ' O ' ' B' ' 15' ' ' VAL . 11.5 t -64.95 -38.07 81.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.748 179.691 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 20' ' ' ARG . . . . . 0.605 ' HG3' ' O ' ' B' ' 16' ' ' ARG . 33.4 mtm105 -62.07 -51.99 65.73 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 49.1 t -73.46 -53.95 16.72 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 -177.295 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 60.3 m -63.63 -52.34 61.26 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 121.182 -0.207 . . . . 0.0 110.918 -178.605 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 49.46 -132.55 25.95 Favored Glycine 0 C--N 1.333 0.411 0 CA-C-N 116.137 -0.483 . . . . 0.0 113.714 178.702 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 64.87 -150.91 51.47 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 121.618 -0.325 . . . . 0.0 112.716 179.846 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -76.76 -31.8 3.86 Favored 'Trans proline' 0 N--CA 1.464 -0.241 0 C-N-CA 122.652 2.234 . . . . 0.0 111.886 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 26' ' ' ARG . . . . . 0.471 ' HB2' ' C ' ' B' ' 31' ' ' ALA . 7.5 ptm180 -171.93 178.51 2.97 Favored 'General case' 0 N--CA 1.443 -0.807 0 N-CA-C 107.842 -1.169 . . . . 0.0 107.842 179.778 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 27' ' ' TRP . . . . . 0.654 ' HD1' ' HD2' ' A' ' 25' ' ' PRO . 0.0 OUTLIER -154.28 -18.93 0.13 Allowed 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 -178.142 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 84.2 p -157.58 -146.2 0.16 Allowed 'General case' 0 C--N 1.318 -0.786 0 C-N-CA 119.304 -0.958 . . . . 0.0 113.308 -177.398 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -83.42 -33.66 25.66 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 114.879 -1.055 . . . . 0.0 109.501 -179.878 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 6.6 mp0 -67.84 -29.54 68.71 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 114.623 -1.172 . . . . 0.0 109.519 179.352 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 31' ' ' ALA . . . . . 0.471 ' C ' ' HB2' ' B' ' 26' ' ' ARG . . . . . . . . 0 C--O 1.25 1.082 0 CA-C-N 114.694 -1.139 . . . . 0.0 108.917 179.486 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.057 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -159.53 135.17 8.5 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 123.365 0.416 . . . . 0.0 110.268 -179.723 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -161.17 55.21 0.29 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.243 0.545 . . . . 0.0 110.13 -179.696 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.5 m -73.83 60.64 0.73 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.307 -0.86 . . . . 0.0 111.185 -179.74 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -170.09 116.05 0.5 Allowed Pre-proline 0 C--N 1.323 -0.55 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 -179.68 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -57.12 -47.86 20.76 Favored 'Trans proline' 0 C--O 1.226 -0.116 0 C-N-CA 123.205 2.603 . . . . 0.0 113.262 -178.625 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -58.07 -40.98 82.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.169 0.509 . . . . 0.0 110.116 179.491 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 43.6 ttt85 -64.61 -54.69 27.93 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.134 178.911 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 26.7 t80 -56.04 -48.44 75.99 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 114.162 -1.381 . . . . 0.0 111.284 -179.583 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.729 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 91.0 m -64.6 -30.03 71.05 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.551 -179.834 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.445 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 35.5 t -77.83 -57.87 3.57 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.336 0.588 . . . . 0.0 110.641 179.708 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 88.6 mt -57.13 -58.69 7.09 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 114.94 -1.027 . . . . 0.0 111.976 -179.117 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 34.6 t -92.56 -63.21 1.26 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 120.927 0.394 . . . . 0.0 110.672 -179.785 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.628 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 132.01 155.73 8.1 Favored Glycine 0 N--CA 1.446 -0.691 0 N-CA-C 110.56 -1.016 . . . . 0.0 110.56 -179.454 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 90.8 m -131.85 135.48 46.74 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 117.191 0.495 . . . . 0.0 111.097 -179.186 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.992 HG23 ' HG2' ' B' ' 6' ' ' ARG . 31.4 p -80.6 170.07 16.81 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.054 179.372 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 23.2 mt-30 -66.62 -40.49 88.83 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 178.243 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.458 ' HG2' ' OE1' ' B' ' 4' ' ' GLU . 77.6 mm-40 -63.16 -43.53 98.05 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 178.593 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -58.82 -43.5 90.63 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.947 178.826 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.683 HD11 HD11 ' B' ' 9' ' ' LEU . 96.9 mt -69.41 -41.75 75.98 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.275 179.464 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 40.8 tp -57.55 -44.04 84.88 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.216 0.531 . . . . 0.0 110.55 -179.727 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.1 m -64.49 -16.63 62.83 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.219 179.615 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 23.8 tp -113.61 16.61 18.64 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.321 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.462 ' HA ' ' HD3' ' A' ' 25' ' ' PRO . 43.5 m -76.34 129.02 81.21 Favored Pre-proline 0 C--N 1.332 -0.191 0 C-N-CA 120.208 -0.597 . . . . 0.0 111.015 179.375 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.654 ' HD2' ' HD1' ' B' ' 27' ' ' TRP . 55.6 Cg_endo -90.29 -157.43 0.06 OUTLIER 'Trans proline' 0 N--CA 1.451 -1.029 0 C-N-CA 123.798 2.999 . . . . 0.0 111.402 178.806 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 5.1 t80 . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.167 -0.92 . . . . 0.0 109.672 179.09 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 1' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo . . . . . 0 N--CA 1.484 0.928 0 N-CA-C 110.394 -0.656 . . . . 0.0 110.394 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -149.69 153.68 36.79 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.483 -179.166 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -71.71 55.13 2.12 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.849 2.366 . . . . 0.0 113.665 -179.004 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -91.96 138.27 31.68 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.9 179.148 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 5' ' ' MET . . . . . . . . . . . . . 70.1 mtm -82.37 -169.51 2.47 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.055 0.455 . . . . 0.0 110.957 -179.797 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 6' ' ' ARG . . . . . 0.597 ' HA ' ' HB ' ' A' ' 16' ' ' THR . 0.2 OUTLIER -70.11 135.17 48.93 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.108 179.327 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 7' ' ' GLU . . . . . 0.42 ' HG2' ' N ' ' B' ' 8' ' ' LYS . 26.3 tt0 -148.99 150.92 33.65 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.037 0.446 . . . . 0.0 111.028 -178.699 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 8' ' ' LYS . . . . . 0.42 ' N ' ' HG2' ' B' ' 7' ' ' GLU . 47.3 mttm -79.48 98.22 6.73 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 177.572 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 9' ' ' LEU . . . . . 0.918 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 38.6 mt -78.89 57.45 2.14 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 112.805 0.669 . . . . 0.0 112.805 -177.889 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 10' ' ' CYS . . . . . 0.438 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 80.1 m -72.66 124.22 24.85 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.03 178.638 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 61.28 -124.3 34.66 Favored Glycine 0 CA--C 1.52 0.382 0 C-N-CA 121.334 -0.46 . . . . 0.0 114.077 179.272 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -51.99 -31.2 28.33 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 123.233 0.613 . . . . 0.0 112.634 -178.734 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 13' ' ' HIS . . . . . 0.616 ' HB3' ' HA ' ' B' ' 9' ' ' LEU . 43.2 m170 -57.09 -42.64 81.09 Favored 'General case' 0 C--N 1.32 -0.712 0 C-N-CA 120.714 -0.395 . . . . 0.0 110.793 -179.339 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 14' ' ' PHE . . . . . 0.566 ' HA ' HD13 ' B' ' 9' ' ' LEU . 54.7 t80 -61.39 -46.26 90.9 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.183 0.516 . . . . 0.0 109.866 178.61 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 15' ' ' VAL . . . . . 0.468 ' O ' HG23 ' B' ' 19' ' ' VAL . 40.5 t -59.82 -52.35 62.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.276 -0.874 . . . . 0.0 111.674 -179.754 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 16' ' ' ARG . . . . . 0.681 ' HG3' ' N ' ' B' ' 17' ' ' ALA . 0.1 OUTLIER -58.65 -45.29 89.65 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.084 -178.936 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 17' ' ' ALA . . . . . 0.681 ' N ' ' HG3' ' B' ' 16' ' ' ARG . . . -68.41 -42.94 78.25 Favored 'General case' 0 C--O 1.218 -0.589 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.445 -179.453 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 50.2 tp -55.09 -51.1 67.45 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.731 0.301 . . . . 0.0 110.455 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 19' ' ' VAL . . . . . 0.468 HG23 ' O ' ' B' ' 15' ' ' VAL . 59.2 t -60.75 -44.82 98.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.048 179.337 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 65.7 mtp85 -66.33 -47.93 71.92 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 -179.344 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 21' ' ' VAL . . . . . 0.542 HG23 ' O ' ' B' ' 17' ' ' ALA . 95.5 t -62.01 -61.13 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 -178.882 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 68.2 m -90.4 41.16 1.04 Allowed 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.153 0.501 . . . . 0.0 111.424 -178.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 169.62 -122.22 0.98 Allowed Glycine 0 N--CA 1.443 -0.872 0 C-N-CA 120.889 -0.672 . . . . 0.0 112.039 179.831 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 178.04 -117.41 0.58 Allowed Glycine 0 N--CA 1.446 -0.645 0 N-CA-C 110.965 -0.854 . . . . 0.0 110.965 179.813 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -79.5 17.81 1.19 Allowed 'Trans proline' 0 CA--C 1.528 0.188 0 C-N-CA 122.651 2.234 . . . . 0.0 111.796 178.98 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 26' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' B' ' 26' ' ' ARG . 8.8 mmm180 -155.49 140.43 17.28 Favored 'General case' 0 CA--C 1.499 -0.983 0 CA-C-N 115.156 -0.929 . . . . 0.0 109.992 179.829 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 27' ' ' TRP . . . . . 0.716 ' HA ' ' CE3' ' B' ' 27' ' ' TRP . 0.0 OUTLIER -98.03 49.92 1.02 Allowed 'General case' 0 C--N 1.305 -1.329 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 177.596 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 1.9 p -63.56 62.97 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 114.929 -1.032 . . . . 0.0 113.284 -178.77 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 48.5 m -169.84 -37.61 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.71 0 C-N-CA 124.034 0.934 . . . . 0.0 108.585 179.805 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 30' ' ' GLU . . . . . 0.501 ' HB3' ' NE1' ' B' ' 27' ' ' TRP . 35.9 tt0 -127.77 -31.09 2.46 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 114.975 -1.011 . . . . 0.0 111.315 -178.534 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 31' ' ' ALA . . . . . 0.557 ' HB3' ' HB3' ' B' ' 27' ' ' TRP . . . . . . . . 0 C--O 1.251 1.182 0 CA-C-O 118.727 -0.654 . . . . 0.0 111.268 -179.064 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.095 0 N-CA-C 110.381 -0.229 . . . . 0.0 110.381 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -72.13 143.37 49.0 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.318 179.743 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.607 ' HB1' ' HD3' ' A' ' 8' ' ' ARG . . . -168.62 122.75 0.88 Allowed 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 120.824 0.345 . . . . 0.0 110.216 -179.812 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.7 m -74.23 60.66 0.83 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.649 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -169.14 117.14 0.57 Allowed Pre-proline 0 C--N 1.324 -0.54 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 -179.174 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_exo -55.3 -49.14 17.25 Favored 'Trans proline' 0 CA--C 1.528 0.203 0 C-N-CA 123.37 2.713 . . . . 0.0 113.666 -178.399 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -59.27 -42.77 91.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.401 0.619 . . . . 0.0 110.303 179.671 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.607 ' HD3' ' HB1' ' A' ' 3' ' ' ALA . 25.0 ttt85 -65.74 -49.08 69.7 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.188 -0.915 . . . . 0.0 109.944 179.178 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 13.6 t80 -55.85 -48.17 75.99 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.833 -1.076 . . . . 0.0 110.889 179.534 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.918 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 69.0 m -63.69 -27.73 69.41 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.789 -0.641 . . . . 0.0 112.083 -179.748 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.438 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 52.7 t -86.56 -59.71 2.2 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.311 0.577 . . . . 0.0 110.792 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 53.2 mt -54.66 -51.6 64.96 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.158 -0.928 . . . . 0.0 111.785 -179.64 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 9.7 m -99.68 -63.07 1.16 Allowed 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 120.989 0.423 . . . . 0.0 110.546 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.634 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 127.67 149.62 7.17 Favored Glycine 0 N--CA 1.448 -0.503 0 N-CA-C 110.216 -1.154 . . . . 0.0 110.216 -179.403 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.684 ' HB2' ' CB ' ' A' ' 19' ' ' ASP . 28.3 p -144.07 -157.93 0.83 Allowed 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 117.485 0.642 . . . . 0.0 110.292 -179.01 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.631 ' H ' ' HB2' ' A' ' 19' ' ' ASP . 14.3 t -171.32 -162.77 0.25 Allowed 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 110.321 -0.251 . . . . 0.0 110.321 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.489 ' CD ' HG22 ' B' ' 21' ' ' VAL . 53.2 mm-40 -57.55 -50.29 73.57 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.674 -179.25 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 11.4 mm100 -62.02 -43.65 98.39 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.853 0.359 . . . . 0.0 110.852 -179.523 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.684 ' CB ' ' HB2' ' A' ' 15' ' ' CYS . 2.9 m-20 -58.16 -41.6 84.16 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.459 179.443 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.452 HD12 HG21 ' B' ' 21' ' ' VAL . 69.0 mt -78.78 -40.36 33.36 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 -179.376 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 21.2 tp -56.59 -44.29 80.94 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.561 -179.456 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 19.1 m -60.34 -22.93 63.81 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.597 179.716 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 94.2 mt -80.6 -26.79 37.63 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.157 179.702 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.445 ' HA ' ' HD3' ' A' ' 25' ' ' PRO . 97.9 m -86.96 139.5 32.72 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-O 121.082 0.468 . . . . 0.0 111.159 -179.62 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' A' ' 24' ' ' CYS . 40.0 Cg_endo -85.68 137.54 5.76 Favored 'Trans proline' 0 N--CA 1.45 -1.056 0 C-N-CA 123.257 2.638 . . . . 0.0 112.604 -179.584 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.247 0.922 0 CA-C-N 114.979 -1.01 . . . . 0.0 109.255 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 1' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo . . . . . 0 N--CA 1.481 0.757 0 N-CA-C 110.078 -0.778 . . . . 0.0 110.078 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -72.96 132.65 82.61 Favored Pre-proline 0 C--N 1.323 -0.582 0 O-C-N 123.389 0.431 . . . . 0.0 111.104 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -71.1 137.29 31.28 Favored 'Trans proline' 0 C--O 1.233 0.245 0 C-N-CA 122.585 2.19 . . . . 0.0 112.086 -179.845 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 4' ' ' GLU . . . . . 0.668 ' OE1' ' HB ' ' A' ' 16' ' ' THR . 1.4 mm-40 -71.88 143.66 49.29 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.201 0.524 . . . . 0.0 111.385 179.764 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 5' ' ' MET . . . . . 0.404 ' O ' ' HA ' ' A' ' 16' ' ' THR . 13.0 tpt -164.49 128.49 2.55 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 114.974 -1.012 . . . . 0.0 109.858 179.854 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 6' ' ' ARG . . . . . 0.649 ' NH1' ' HA ' ' A' ' 15' ' ' CYS . 54.0 ttm-85 -89.51 101.83 14.51 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 179.72 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 78.5 tt0 -98.71 144.65 27.73 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-O 121.304 0.573 . . . . 0.0 110.75 -179.123 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 21.8 mmmt -78.48 91.95 4.59 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 177.914 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 9' ' ' LEU . . . . . 1.02 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 16.5 mt -75.56 57.74 0.98 Allowed 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 113.722 1.008 . . . . 0.0 113.722 -176.926 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 10' ' ' CYS . . . . . 0.424 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 87.8 m -77.18 123.11 25.96 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 178.028 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 64.11 -125.26 31.82 Favored Glycine 0 CA--C 1.521 0.451 0 C-N-CA 121.204 -0.522 . . . . 0.0 113.865 179.629 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -52.24 -32.03 35.03 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 112.779 0.659 . . . . 0.0 112.779 -178.574 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 13' ' ' HIS . . . . . 0.621 ' HB3' ' HA ' ' B' ' 9' ' ' LEU . 41.0 m170 -56.41 -43.06 78.98 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 120.766 -0.374 . . . . 0.0 110.996 -179.312 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 14' ' ' PHE . . . . . 0.828 ' HA ' HD13 ' B' ' 9' ' ' LEU . 35.4 t80 -61.21 -45.73 93.38 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.176 0.513 . . . . 0.0 109.987 178.867 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 43.4 t -59.87 -51.52 71.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 115.292 -0.867 . . . . 0.0 111.866 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 16' ' ' ARG . . . . . 0.581 ' HG3' ' N ' ' B' ' 17' ' ' ALA . 10.7 ptt180 -62.22 -45.19 94.46 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.303 0.483 . . . . 0.0 112.303 -178.361 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 17' ' ' ALA . . . . . 0.581 ' N ' ' HG3' ' B' ' 16' ' ' ARG . . . -67.95 -48.27 66.34 Favored 'General case' 0 C--O 1.223 -0.324 0 N-CA-C 111.749 0.277 . . . . 0.0 111.749 -178.838 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 39.0 tp -57.01 -50.83 71.53 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.078 0.466 . . . . 0.0 110.898 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 19' ' ' VAL . . . . . 0.56 ' HA ' ' CZ2' ' B' ' 27' ' ' TRP . 46.5 t -60.56 -48.29 89.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.698 -0.683 . . . . 0.0 112.635 -179.565 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 20' ' ' ARG . . . . . 0.485 ' CZ ' ' HA ' ' B' ' 20' ' ' ARG . 0.1 OUTLIER -75.0 -39.3 61.31 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 113.956 1.095 . . . . 0.0 113.956 -178.145 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 21' ' ' VAL . . . . . 0.442 HG11 ' O ' ' A' ' 17' ' ' GLN . 70.0 t -71.12 -46.04 68.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -178.436 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 91.9 m -64.45 -67.26 0.45 Allowed 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.332 -0.547 . . . . 0.0 111.519 -179.041 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.62 -52.6 0.49 Allowed Glycine 0 CA--C 1.528 0.881 0 N-CA-C 114.564 0.586 . . . . 0.0 114.564 178.934 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -54.45 -61.15 7.55 Favored Glycine 0 C--N 1.333 0.369 0 CA-C-O 119.961 -0.355 . . . . 0.0 113.251 -179.304 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 25' ' ' PRO . . . . . 0.645 ' HG3' ' HB3' ' A' ' 24' ' ' CYS . 37.2 Cg_endo -66.53 157.76 59.04 Favored 'Trans proline' 0 N--CA 1.457 -0.654 0 C-N-CA 122.049 1.833 . . . . 0.0 110.853 178.907 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 26' ' ' ARG . . . . . 0.85 ' HB3' ' HA ' ' B' ' 31' ' ' ALA . 22.5 mmm180 -122.62 128.18 50.32 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 -179.934 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 27' ' ' TRP . . . . . 0.56 ' CZ2' ' HA ' ' B' ' 19' ' ' VAL . 13.2 p90 -158.62 -45.35 0.06 Allowed 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -178.183 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 9.8 t -105.92 -138.76 0.37 Allowed 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.881 -178.543 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 5.0 t -56.47 -31.1 63.69 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.531 -0.915 . . . . 0.0 108.531 178.128 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 30' ' ' GLU . . . . . 0.565 ' O ' ' HA ' ' B' ' 26' ' ' ARG . 30.2 mm-40 -84.28 70.63 10.62 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 114.708 -1.133 . . . . 0.0 108.432 176.719 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 31' ' ' ALA . . . . . 0.85 ' HA ' ' HB3' ' B' ' 26' ' ' ARG . . . . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.104 -0.95 . . . . 0.0 109.87 -179.422 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.078 0 N-CA-C 110.163 -0.31 . . . . 0.0 110.163 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -71.79 130.84 42.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.445 0.164 . . . . 0.0 110.582 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -173.62 129.5 0.42 Allowed 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 116.231 -0.44 . . . . 0.0 109.874 -179.762 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 10.2 t -62.64 -23.43 67.08 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.567 179.596 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -158.7 105.63 1.62 Allowed Pre-proline 0 C--N 1.323 -0.554 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 178.774 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.509 ' HB3' HD13 ' A' ' 23' ' ' LEU . 35.3 Cg_exo -58.72 -44.19 38.44 Favored 'Trans proline' 0 C--N 1.334 -0.22 0 C-N-CA 123.67 2.913 . . . . 0.0 113.693 -178.256 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.45 -45.22 85.0 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.225 0.536 . . . . 0.0 110.733 -179.804 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.427 ' HD2' ' HA ' ' A' ' 8' ' ' ARG . 10.3 tpt85 -70.01 -48.38 58.3 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.333 179.541 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 19.7 t80 -54.86 -52.53 62.49 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.945 -1.025 . . . . 0.0 111.52 -179.481 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 1.02 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 33.5 m -63.47 -32.47 73.93 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.049 -0.523 . . . . 0.0 112.198 -179.497 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.424 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 37.4 t -77.14 -57.06 4.05 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.453 0.644 . . . . 0.0 111.015 179.867 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 14.0 tp -62.48 -60.9 2.89 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 114.938 -1.028 . . . . 0.0 112.139 -178.905 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 9.2 m -86.02 -50.52 6.99 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.851 -178.495 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.597 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 111.16 155.41 13.63 Favored Glycine 0 N--CA 1.451 -0.35 0 N-CA-C 110.036 -1.226 . . . . 0.0 110.036 -178.543 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.703 ' HB2' ' HB3' ' A' ' 19' ' ' ASP . 18.3 p -146.0 153.92 41.31 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 118.255 1.027 . . . . 0.0 112.859 -178.806 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.668 ' HB ' ' OE1' ' B' ' 4' ' ' GLU . 59.7 p -95.97 -179.46 4.7 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.693 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.61 ' HG2' ' OE1' ' B' ' 4' ' ' GLU . 19.8 pt20 -61.59 -44.91 96.14 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 120.679 0.276 . . . . 0.0 110.983 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 55.6 mt-30 -63.06 -36.87 85.01 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.475 0.655 . . . . 0.0 109.697 179.072 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.703 ' HB3' ' HB2' ' A' ' 15' ' ' CYS . 5.5 t0 -61.6 -42.48 98.93 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.809 -1.087 . . . . 0.0 109.481 179.416 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.695 HD21 HD11 ' B' ' 9' ' ' LEU . 1.6 mm? -67.67 -46.26 72.88 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 121.055 0.455 . . . . 0.0 110.513 177.964 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 26.3 tp -55.39 -47.4 75.91 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.406 -178.746 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.8 p -65.01 -9.95 25.76 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 -179.755 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.523 ' HG ' ' O ' ' A' ' 19' ' ' ASP . 95.7 mt -85.32 -24.76 27.52 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.79 0.329 . . . . 0.0 110.459 179.164 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.645 ' HB3' ' HG3' ' B' ' 25' ' ' PRO . 51.4 m -85.59 139.31 35.63 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-O 120.874 0.369 . . . . 0.0 111.475 -179.94 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.474 ' HD3' ' HA ' ' A' ' 24' ' ' CYS . 10.6 Cg_endo -84.96 132.21 4.58 Favored 'Trans proline' 0 N--CA 1.448 -1.191 0 C-N-CA 123.274 2.649 . . . . 0.0 111.912 179.512 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.251 1.138 0 CA-C-O 117.393 -1.289 . . . . 0.0 109.351 179.866 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 1' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo . . . . . 0 N--CA 1.481 0.765 0 N-CA-C 110.666 -0.552 . . . . 0.0 110.666 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 2' ' ' THR . . . . . 0.541 ' HB ' ' HD2' ' B' ' 3' ' ' PRO . 0.7 OUTLIER -157.67 170.75 8.42 Favored Pre-proline 0 C--N 1.319 -0.726 0 CA-C-N 115.194 -0.912 . . . . 0.0 109.147 -179.027 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 3' ' ' PRO . . . . . 0.541 ' HD2' ' HB ' ' B' ' 2' ' ' THR . 58.6 Cg_endo -71.35 57.52 2.26 Favored 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 122.636 2.224 . . . . 0.0 111.383 179.077 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -65.58 133.91 52.19 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 114.187 -1.37 . . . . 0.0 111.8 -178.732 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 5' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.23 136.63 32.86 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.06 178.473 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 6' ' ' ARG . . . . . 0.685 ' HD2' HG23 ' A' ' 16' ' ' THR . 26.2 mmm180 -70.14 104.25 2.55 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 7' ' ' GLU . . . . . 0.414 ' CD ' HH21 ' B' ' 16' ' ' ARG . 40.0 tt0 -84.67 132.89 34.42 Favored 'General case' 0 CA--C 1.508 -0.643 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 -179.906 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -74.93 93.25 2.65 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 178.753 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 9' ' ' LEU . . . . . 0.908 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 2.5 mp -75.41 53.55 0.68 Allowed 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.627 -0.715 . . . . 0.0 112.906 -177.683 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 80.6 m -75.31 124.6 27.37 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.007 178.472 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 60.08 -120.87 24.66 Favored Glycine 0 CA--C 1.52 0.404 0 C-N-CA 121.301 -0.476 . . . . 0.0 114.089 179.167 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 2.1 t60 -51.41 -35.22 38.15 Favored 'General case' 0 N--CA 1.467 0.376 0 N-CA-C 113.18 0.808 . . . . 0.0 113.18 -178.422 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 13' ' ' HIS . . . . . 0.666 ' C ' ' HG ' ' B' ' 9' ' ' LEU . 36.6 m170 -56.32 -43.01 78.57 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 120.435 -0.506 . . . . 0.0 110.581 -179.092 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 14' ' ' PHE . . . . . 0.75 ' HA ' HD23 ' B' ' 9' ' ' LEU . 27.8 t80 -61.27 -47.47 85.85 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 178.956 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 20.5 t -58.21 -52.24 61.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.93 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 16' ' ' ARG . . . . . 0.539 ' HG3' ' N ' ' B' ' 17' ' ' ALA . 15.6 ptt180 -61.84 -46.21 90.45 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -178.206 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 17' ' ' ALA . . . . . 0.773 ' HB3' HD21 ' B' ' 9' ' ' LEU . . . -68.56 -44.29 74.77 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 111.788 0.292 . . . . 0.0 111.788 -179.027 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 18' ' ' LEU . . . . . 0.628 ' HG ' ' CZ2' ' B' ' 27' ' ' TRP . 20.0 tp -59.77 -51.88 67.86 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.087 -179.452 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 84.6 t -63.3 -41.19 91.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 120.662 0.268 . . . . 0.0 111.606 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 20' ' ' ARG . . . . . 0.923 ' HE ' ' HA ' ' B' ' 20' ' ' ARG . 0.4 OUTLIER -70.87 -48.17 55.27 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -179.071 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 87.3 t -66.3 -41.05 88.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 120.538 0.208 . . . . 0.0 111.247 -179.363 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 79.2 m -79.05 36.82 0.29 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.158 0.504 . . . . 0.0 111.567 179.767 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.85 -67.88 1.65 Allowed Glycine 0 N--CA 1.449 -0.447 0 CA-C-N 115.745 -0.662 . . . . 0.0 113.954 178.712 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 24' ' ' GLY . . . . . 0.427 ' O ' ' HB2' ' B' ' 27' ' ' TRP . . . 126.3 -67.72 0.53 Allowed Glycine 0 N--CA 1.449 -0.481 0 N-CA-C 111.465 -0.654 . . . . 0.0 111.465 -178.965 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -63.03 -36.03 61.95 Favored 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 122.274 1.983 . . . . 0.0 111.732 179.302 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 18.5 mmm-85 -94.21 36.87 1.11 Allowed 'General case' 0 CA--C 1.505 -0.777 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.256 179.164 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 27' ' ' TRP . . . . . 0.798 ' HA ' ' CE3' ' B' ' 27' ' ' TRP . 0.0 OUTLIER -80.01 51.08 1.3 Allowed 'General case' 0 C--N 1.3 -1.562 0 CA-C-O 121.584 0.707 . . . . 0.0 110.657 -179.83 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 23.7 m -69.49 60.06 0.14 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 114.432 -1.258 . . . . 0.0 112.023 179.609 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 29' ' ' THR . . . . . 0.529 ' HB ' ' CZ3' ' B' ' 27' ' ' TRP . 75.0 m -164.71 -46.41 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 179.741 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 30' ' ' GLU . . . . . 0.549 ' HB3' ' NE1' ' B' ' 27' ' ' TRP . 87.9 tt0 -110.9 18.5 19.46 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.029 -1.1 . . . . 0.0 108.029 178.643 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.907 0 CA-C-N 114.277 -1.329 . . . . 0.0 108.66 -179.709 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.015 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -68.0 133.44 49.04 Favored 'General case' 0 C--N 1.331 -0.206 0 O-C-N 123.04 0.212 . . . . 0.0 110.449 179.328 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -175.42 135.5 0.33 Allowed 'General case' 0 N--CA 1.444 -0.726 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 -179.552 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 2.9 p -60.18 -30.21 69.2 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.761 179.528 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 24.3 t-20 -147.16 102.73 3.81 Favored Pre-proline 0 C--N 1.32 -0.697 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.046 178.583 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_exo -58.0 -43.11 51.29 Favored 'Trans proline' 0 C--N 1.333 -0.262 0 C-N-CA 123.845 3.03 . . . . 0.0 113.416 -178.336 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.76 -43.95 85.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.136 0.493 . . . . 0.0 110.581 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.428 ' HD2' ' HA ' ' A' ' 8' ' ' ARG . 14.4 tpt180 -68.24 -51.27 47.15 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.283 179.52 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 47.0 t80 -55.57 -51.64 66.42 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 114.757 -1.11 . . . . 0.0 111.282 -179.584 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.908 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 14.1 m -62.48 -35.3 78.92 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.96 -179.725 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 38.2 t -72.43 -59.41 2.74 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.239 0.542 . . . . 0.0 111.562 -179.646 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.413 HD13 ' HA ' ' A' ' 12' ' ' LEU . 4.0 mm? -68.84 -56.6 7.46 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 113.005 0.743 . . . . 0.0 113.005 -178.416 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 13.9 m -81.74 -43.21 18.71 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 111.777 0.288 . . . . 0.0 111.777 -178.539 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.572 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 99.8 148.36 22.67 Favored Glycine 0 N--CA 1.45 -0.404 0 N-CA-C 110.875 -0.89 . . . . 0.0 110.875 -178.977 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.649 ' SG ' HD22 ' B' ' 9' ' ' LEU . 24.3 p -142.63 163.45 32.8 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 117.018 0.409 . . . . 0.0 111.897 -178.361 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.685 HG23 ' HD2' ' B' ' 6' ' ' ARG . 63.3 p -114.89 -172.88 2.21 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.812 -179.389 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -57.64 -42.5 83.56 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 120.611 0.244 . . . . 0.0 111.01 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -60.8 -41.67 96.09 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.181 0.515 . . . . 0.0 110.213 179.287 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.607 ' CB ' ' HB2' ' A' ' 15' ' ' CYS . 0.5 OUTLIER -61.99 -39.76 93.34 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.92 179.696 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.411 HD21 ' CD2' ' B' ' 9' ' ' LEU . 3.4 mm? -71.67 -39.34 70.35 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.751 -0.462 . . . . 0.0 109.751 178.057 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -57.7 -41.36 81.55 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.879 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 30.9 p -65.83 -5.39 8.86 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 71.6 mt -105.7 -10.5 16.74 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.009 0.433 . . . . 0.0 110.303 179.581 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 62.9 m -79.22 145.92 65.75 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.754 -179.368 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.588 ' HD3' ' HZ3' ' B' ' 27' ' ' TRP . 86.4 Cg_endo -88.77 -157.12 0.06 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.716 0 C-N-CA 123.376 2.718 . . . . 0.0 112.24 179.418 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 23.3 t80 . . . . . 0 C--O 1.25 1.095 0 CA-C-O 117.991 -1.004 . . . . 0.0 109.258 179.364 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 1' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_exo . . . . . 0 CA--C 1.511 -0.641 0 N-CA-C 110.911 -0.457 . . . . 0.0 110.911 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 5.8 m -54.46 132.63 62.92 Favored Pre-proline 0 C--N 1.32 -0.687 0 O-C-N 124.051 0.844 . . . . 0.0 109.278 179.346 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_exo -22.92 86.77 0.0 OUTLIER 'Trans proline' 0 C--N 1.358 1.04 1 C-N-CA 125.624 4.216 . . . . 0.0 115.38 -178.566 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 4' ' ' GLU . . . . . 0.543 ' HB2' HG21 ' A' ' 16' ' ' THR . 5.6 mp0 -77.05 141.71 40.17 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.012 -0.995 . . . . 0.0 109.878 -179.787 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 5' ' ' MET . . . . . . . . . . . . . 96.7 mmm -53.34 114.49 1.51 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.13 0.49 . . . . 0.0 110.907 -179.685 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 6' ' ' ARG . . . . . 0.711 ' HD2' ' HA ' ' A' ' 15' ' ' CYS . 57.8 mmt-85 -92.89 125.44 37.49 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.825 -179.473 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -104.4 135.74 45.27 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 178.89 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 8' ' ' LYS . . . . . 0.518 ' HA ' ' O ' ' A' ' 10' ' ' CYS . 65.7 mttm -77.55 95.01 4.43 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.579 0.704 . . . . 0.0 110.285 -179.643 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 9' ' ' LEU . . . . . 1.108 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 7.9 mp -75.02 52.02 0.54 Allowed 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 114.961 -1.018 . . . . 0.0 112.369 -179.106 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 67.5 m -73.08 123.13 22.96 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.222 -0.444 . . . . 0.0 109.94 178.579 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 59.24 -118.36 14.01 Favored Glycine 0 CA--C 1.52 0.383 0 C-N-CA 121.259 -0.496 . . . . 0.0 113.826 179.359 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 11.1 t-160 -54.14 -32.11 54.35 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 -178.661 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 13' ' ' HIS . . . . . 0.664 ' CB ' ' HA ' ' B' ' 9' ' ' LEU . 30.3 m170 -60.75 -36.94 80.17 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 120.109 -0.637 . . . . 0.0 110.815 -178.751 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 14' ' ' PHE . . . . . 0.877 ' HA ' HD23 ' B' ' 9' ' ' LEU . 15.9 t80 -62.13 -45.36 93.81 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 178.524 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 47.9 t -63.72 -52.94 50.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.087 -0.96 . . . . 0.0 111.9 179.699 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 16' ' ' ARG . . . . . 0.546 ' HG3' ' O ' ' B' ' 13' ' ' HIS . 3.7 ppt_? -59.68 -44.4 93.63 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.896 -0.593 . . . . 0.0 112.066 -178.442 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 17' ' ' ALA . . . . . 0.734 ' HB3' HD21 ' B' ' 9' ' ' LEU . . . -69.62 -41.8 75.18 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 121.146 -0.222 . . . . 0.0 111.115 -179.373 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 18' ' ' LEU . . . . . 0.564 HD22 ' HE1' ' B' ' 27' ' ' TRP . 7.2 mt -56.85 -55.61 32.24 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.836 0.35 . . . . 0.0 111.259 179.502 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 41.7 t -64.26 -38.44 82.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.995 -0.548 . . . . 0.0 112.315 -178.94 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 20' ' ' ARG . . . . . 0.739 ' NE ' ' HA ' ' B' ' 20' ' ' ARG . 0.1 OUTLIER -77.06 -54.5 6.46 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.125 -0.63 . . . . 0.0 112.592 -178.563 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 21' ' ' VAL . . . . . 0.634 HG13 ' HG3' ' A' ' 17' ' ' GLN . 78.3 t -63.46 -45.73 97.11 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 CA-C-N 115.734 -0.666 . . . . 0.0 112.164 -178.502 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 22' ' ' CYS . . . . . 0.806 ' HB3' ' HB2' ' B' ' 27' ' ' TRP . 88.1 m -86.48 42.25 0.99 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.337 0.589 . . . . 0.0 112.043 -179.225 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.32 -75.72 1.74 Allowed Glycine 0 C--O 1.236 0.271 0 CA-C-N 115.797 -0.638 . . . . 0.0 114.355 178.183 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 132.63 -58.96 0.69 Allowed Glycine 0 CA--C 1.522 0.51 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.885 -179.044 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_exo -60.84 -20.95 68.75 Favored 'Trans proline' 0 C--N 1.356 0.958 0 C-N-CA 122.842 2.361 . . . . 0.0 112.545 -179.945 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 19.4 ttt85 -166.1 140.87 4.55 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.262 179.278 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 27' ' ' TRP . . . . . 0.806 ' HB2' ' HB3' ' B' ' 22' ' ' CYS . 0.3 OUTLIER -173.52 -15.55 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.578 0 O-C-N 123.831 0.707 . . . . 0.0 112.775 -179.918 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 93.8 p -151.59 -130.65 0.04 OUTLIER 'General case' 0 N--CA 1.441 -0.882 0 CA-C-O 121.739 0.78 . . . . 0.0 112.594 -177.201 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -95.45 -36.22 11.41 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 114.436 -1.256 . . . . 0.0 109.429 -178.84 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -65.65 -32.87 74.68 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 114.284 -1.326 . . . . 0.0 110.176 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.124 0 CA-C-O 117.836 -1.078 . . . . 0.0 109.117 179.837 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.977 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -73.38 125.47 27.93 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 110.372 -0.232 . . . . 0.0 110.372 179.404 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -173.68 127.67 0.4 Allowed 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 2.4 p -64.47 -27.59 69.09 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.836 179.485 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 33.5 t-20 -151.79 105.89 2.87 Favored Pre-proline 0 C--N 1.321 -0.667 0 CA-C-N 115.164 -0.925 . . . . 0.0 108.772 178.965 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_exo -57.88 -48.64 15.69 Favored 'Trans proline' 0 C--N 1.331 -0.353 0 C-N-CA 123.67 2.913 . . . . 0.0 113.431 -178.499 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.6 -44.32 81.0 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.313 0.578 . . . . 0.0 110.587 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 17.3 mmm180 -67.62 -50.24 59.09 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.073 179.296 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -57.34 -49.09 77.24 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.794 179.629 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 1.108 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 65.0 m -61.88 -38.67 89.2 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.723 -0.672 . . . . 0.0 112.074 -179.66 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 47.7 t -74.46 -59.66 2.63 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.245 0.545 . . . . 0.0 111.664 -179.398 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -61.99 -56.56 17.89 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.541 -0.754 . . . . 0.0 112.629 -178.518 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 12.5 m -91.22 -59.26 2.2 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.932 0.396 . . . . 0.0 111.144 -179.234 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.592 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 123.57 144.46 6.55 Favored Glycine 0 N--CA 1.446 -0.675 0 N-CA-C 110.894 -0.883 . . . . 0.0 110.894 -179.513 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.711 ' HA ' ' HD2' ' B' ' 6' ' ' ARG . 20.8 p -130.3 153.51 48.57 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 117.162 0.481 . . . . 0.0 110.789 -179.783 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.543 HG21 ' HB2' ' B' ' 4' ' ' GLU . 10.1 t -107.02 -176.86 3.2 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.638 -178.75 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.634 ' HG3' HG13 ' B' ' 21' ' ' VAL . 34.1 tt0 -59.0 -53.08 62.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.68 -179.737 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 8.8 mm100 -60.69 -38.43 84.93 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.392 0.615 . . . . 0.0 110.432 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.528 ' HB2' HG22 ' A' ' 16' ' ' THR . 3.0 t0 -62.12 -41.64 98.44 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.176 -0.92 . . . . 0.0 109.818 179.362 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 77.8 mt -72.81 -41.36 65.01 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.014 179.131 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 45.8 tp -56.35 -45.88 80.21 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.88 -179.486 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 11.0 p -64.27 -9.98 20.87 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 179.85 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 98.4 mt -96.59 -20.77 18.08 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.032 179.422 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.514 ' SG ' ' HD1' ' B' ' 27' ' ' TRP . 76.5 m -99.06 133.1 22.43 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-O 121.181 0.515 . . . . 0.0 111.872 -179.026 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.5 ' HD3' ' HA ' ' A' ' 24' ' ' CYS . 63.6 Cg_endo -92.49 -158.41 0.06 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.975 0 C-N-CA 123.578 2.852 . . . . 0.0 111.941 179.197 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 37.5 m-85 . . . . . 0 C--O 1.247 0.929 0 CA-C-O 118.701 -0.666 . . . . 0.0 109.6 179.209 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 1' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_endo . . . . . 0 N--CA 1.48 0.729 0 N-CA-C 111.178 -0.354 . . . . 0.0 111.178 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 2' ' ' THR . . . . . 0.636 ' OG1' ' HD2' ' B' ' 3' ' ' PRO . 0.6 OUTLIER -175.73 167.9 1.63 Allowed Pre-proline 0 C--N 1.325 -0.478 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 -179.137 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 3' ' ' PRO . . . . . 0.636 ' HD2' ' OG1' ' B' ' 2' ' ' THR . 40.5 Cg_endo -67.86 65.09 0.92 Allowed 'Trans proline' 0 C--N 1.356 0.937 0 C-N-CA 122.677 2.251 . . . . 0.0 112.202 -179.765 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 4' ' ' GLU . . . . . 0.559 ' OE1' ' HB ' ' A' ' 16' ' ' THR . 18.6 mt-10 -66.83 145.57 55.34 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 114.35 -1.296 . . . . 0.0 111.179 -179.084 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 5' ' ' MET . . . . . . . . . . . . . 48.5 ttm -78.1 136.23 37.85 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 178.721 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 6' ' ' ARG . . . . . 0.864 ' HD2' HG23 ' A' ' 16' ' ' THR . 27.3 mmm180 -65.25 110.41 2.57 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 179.796 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 7' ' ' GLU . . . . . 0.548 ' O ' HD22 ' B' ' 9' ' ' LEU . 8.8 tp10 -84.13 133.2 34.63 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-O 121.468 0.652 . . . . 0.0 109.475 179.821 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 6.0 mtmm -83.06 86.51 6.99 Favored 'General case' 0 C--N 1.308 -1.2 0 CA-C-N 115.331 -0.85 . . . . 0.0 109.555 -179.225 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 9' ' ' LEU . . . . . 0.638 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 1.6 mm? -74.73 54.44 0.62 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.653 -0.703 . . . . 0.0 112.878 -178.653 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 10' ' ' CYS . . . . . 0.488 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 81.2 m -71.28 119.66 15.74 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.608 178.78 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 53.47 -116.57 5.98 Favored Glycine 0 C--N 1.331 0.29 0 CA-C-N 116.161 -0.472 . . . . 0.0 113.583 179.213 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -51.28 -34.04 31.19 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 122.978 0.511 . . . . 0.0 111.909 -179.634 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 13' ' ' HIS . . . . . 0.589 ' O ' HD12 ' B' ' 9' ' ' LEU . 46.7 m170 -55.16 -44.57 75.29 Favored 'General case' 0 C--N 1.32 -0.696 0 C-N-CA 120.495 -0.482 . . . . 0.0 110.48 -179.362 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 14' ' ' PHE . . . . . 0.461 ' CA ' ' HB3' ' B' ' 9' ' ' LEU . 25.7 t80 -62.64 -48.0 81.24 Favored 'General case' 0 C--N 1.329 -0.318 0 O-C-N 123.382 0.426 . . . . 0.0 110.229 178.945 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 13.0 t -56.43 -50.58 71.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.753 179.616 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.96 -45.08 96.17 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.016 -0.993 . . . . 0.0 112.061 -179.359 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.17 -44.56 83.7 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.769 0.319 . . . . 0.0 111.524 -179.797 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 29.4 tp -61.05 -51.53 68.79 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.607 -179.346 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 19' ' ' VAL . . . . . 0.419 HG12 ' CD1' ' B' ' 27' ' ' TRP . 21.1 m -64.36 -33.89 65.69 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 -179.448 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 20' ' ' ARG . . . . . 0.534 ' NE ' ' HA ' ' B' ' 20' ' ' ARG . 13.9 mmp_? -77.38 -52.33 9.33 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 112.395 0.517 . . . . 0.0 112.395 -179.376 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 91.1 t -71.13 -52.75 24.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -178.545 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 83.6 m -97.7 47.6 1.02 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.772 0.32 . . . . 0.0 111.282 -179.309 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -172.4 -38.71 0.03 OUTLIER Glycine 0 N--CA 1.444 -0.784 0 C-N-CA 119.986 -1.102 . . . . 0.0 112.831 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 74.23 -113.88 4.29 Favored Glycine 0 N--CA 1.445 -0.705 0 N-CA-C 110.663 -0.975 . . . . 0.0 110.663 -178.97 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_exo -60.4 -39.02 70.23 Favored 'Trans proline' 0 CA--C 1.531 0.351 0 C-N-CA 122.742 2.295 . . . . 0.0 112.237 179.375 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 26' ' ' ARG . . . . . 0.608 ' NH1' ' HB3' ' B' ' 26' ' ' ARG . 9.3 mtp-105 -152.95 156.08 38.19 Favored 'General case' 0 CA--C 1.495 -1.156 0 CA-C-O 121.597 0.713 . . . . 0.0 111.091 179.664 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 27' ' ' TRP . . . . . 0.734 ' HB3' ' HB3' ' B' ' 31' ' ' ALA . 0.0 OUTLIER -86.59 52.29 2.46 Favored 'General case' 0 C--N 1.305 -1.337 0 CA-C-N 113.972 -1.467 . . . . 0.0 107.349 176.032 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 63.6 m -61.37 63.47 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 114.827 -1.079 . . . . 0.0 113.709 -178.218 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 29' ' ' THR . . . . . 0.5 ' HB ' ' CZ3' ' B' ' 27' ' ' TRP . 59.0 m -169.32 -38.77 0.02 OUTLIER 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 179.239 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 30' ' ' GLU . . . . . 0.494 ' HB3' ' NE1' ' B' ' 27' ' ' TRP . 39.7 tt0 -125.25 -31.08 3.1 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 114.862 -1.063 . . . . 0.0 110.872 -179.312 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 31' ' ' ALA . . . . . 0.734 ' HB3' ' HB3' ' B' ' 27' ' ' TRP . . . . . . . . 0 C--O 1.25 1.129 0 CA-C-O 118.733 -0.651 . . . . 0.0 111.128 -179.385 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ALA . . . . . 0.432 ' H1 ' ' CG ' ' A' ' 19' ' ' ASP . . . . . . . . 0 N--CA 1.479 1.019 0 N-CA-C 110.299 -0.26 . . . . 0.0 110.299 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -156.05 132.93 10.48 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.639 -0.255 . . . . 0.0 110.329 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -83.0 59.61 5.01 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.401 -179.679 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 4.7 p -141.18 -62.25 0.47 Allowed 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.413 0.625 . . . . 0.0 110.501 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 30.1 t-20 -170.93 109.76 0.42 Allowed Pre-proline 0 C--N 1.317 -0.821 0 CA-C-N 115.002 -0.999 . . . . 0.0 109.123 179.258 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -60.83 -46.81 14.99 Favored 'Trans proline' 0 C--N 1.333 -0.282 0 C-N-CA 123.21 2.607 . . . . 0.0 113.416 -178.737 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -58.66 -43.35 89.83 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.024 0.44 . . . . 0.0 110.925 -179.747 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.404 ' HA ' ' HD3' ' A' ' 8' ' ' ARG . 3.0 mmt85 -73.25 -43.87 60.36 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.498 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 32.3 t80 -62.7 -51.42 67.27 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.115 -179.714 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.667 ' O ' ' HA2' ' A' ' 14' ' ' GLY . 86.6 m -67.32 -17.54 64.8 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.883 -179.577 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.488 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 28.8 t -82.95 -57.28 3.36 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.298 0.571 . . . . 0.0 110.341 178.986 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 97.2 mt -69.49 -57.85 4.71 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.885 -1.052 . . . . 0.0 112.555 -178.866 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 14.1 m -84.36 -29.68 26.07 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.085 0.469 . . . . 0.0 111.446 -178.787 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.667 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 83.62 151.31 11.41 Favored Glycine 0 N--CA 1.446 -0.672 0 C-N-CA 120.779 -0.724 . . . . 0.0 111.493 -178.861 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.541 ' HA ' ' NH2' ' B' ' 6' ' ' ARG . 82.9 m -134.79 143.79 47.29 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.933 0.396 . . . . 0.0 111.046 -179.162 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.864 HG23 ' HD2' ' B' ' 6' ' ' ARG . 39.7 p -80.64 167.34 20.15 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 178.559 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 4.6 pp0? -61.73 -37.64 84.97 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 179.373 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 66.9 tp60 -63.63 -43.42 96.87 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.199 178.678 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.432 ' CG ' ' H1 ' ' A' ' 1' ' ' ALA . 24.5 t0 -59.7 -44.18 93.78 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.464 179.654 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.509 HD11 HD21 ' B' ' 9' ' ' LEU . 81.2 mt -65.23 -46.32 81.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.344 178.723 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 30.9 tp -57.31 -41.11 79.27 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.808 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 21.2 m -62.62 -24.16 67.44 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.36 179.864 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 96.6 mt -77.65 -23.19 49.74 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.487 179.244 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.482 ' HA ' ' HD3' ' A' ' 25' ' ' PRO . 43.2 m -83.5 132.94 48.03 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.251 -179.541 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.482 ' HD3' ' HA ' ' A' ' 24' ' ' CYS . 3.7 Cg_exo -78.23 132.08 11.19 Favored 'Trans proline' 0 N--CA 1.455 -0.748 0 C-N-CA 123.117 2.545 . . . . 0.0 112.307 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.247 0.923 0 CA-C-N 115.176 -0.92 . . . . 0.0 109.434 179.314 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 1' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo . . . . . 0 N--CA 1.481 0.767 0 N-CA-C 110.019 -0.8 . . . . 0.0 110.019 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 6.3 m -71.81 127.13 91.17 Favored Pre-proline 0 C--N 1.324 -0.541 0 O-C-N 123.4 0.437 . . . . 0.0 110.703 -179.581 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -70.97 135.36 27.4 Favored 'Trans proline' 0 N--CA 1.463 -0.268 0 C-N-CA 122.419 2.08 . . . . 0.0 111.861 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -69.0 132.83 47.29 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.247 0.546 . . . . 0.0 111.168 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 5' ' ' MET . . . . . 0.4 ' O ' ' HA ' ' A' ' 16' ' ' THR . 53.1 ttm -79.38 68.43 5.39 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.653 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 6' ' ' ARG . . . . . 0.588 ' HA ' ' HA ' ' A' ' 16' ' ' THR . 51.2 ttm-85 -76.14 118.7 19.15 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.638 -0.505 . . . . 0.0 109.638 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -120.35 144.88 47.63 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.817 -178.398 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 25.0 mtpp -71.8 98.04 1.9 Allowed 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 107.555 -1.276 . . . . 0.0 107.555 177.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 9' ' ' LEU . . . . . 0.811 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 32.5 mt -77.97 59.21 2.1 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 113.974 1.102 . . . . 0.0 113.974 -176.485 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 10' ' ' CYS . . . . . 0.424 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 93.2 m -80.99 122.83 27.78 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 177.759 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 63.08 -123.28 29.64 Favored Glycine 0 CA--C 1.52 0.35 0 C-N-CA 121.107 -0.568 . . . . 0.0 113.569 179.799 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -53.41 -31.03 43.24 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 112.707 0.632 . . . . 0.0 112.707 -178.788 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 13' ' ' HIS . . . . . 0.641 ' CB ' ' HA ' ' B' ' 9' ' ' LEU . 51.4 m170 -56.5 -43.44 79.74 Favored 'General case' 0 C--N 1.321 -0.668 0 C-N-CA 120.665 -0.414 . . . . 0.0 111.26 -179.035 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 14' ' ' PHE . . . . . 0.713 ' HA ' HD13 ' B' ' 9' ' ' LEU . 45.8 t80 -61.44 -45.64 93.43 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.257 0.551 . . . . 0.0 109.666 178.691 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 23.7 t -60.45 -49.4 84.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.023 -0.989 . . . . 0.0 111.588 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 16' ' ' ARG . . . . . 0.623 ' HG3' ' N ' ' B' ' 17' ' ' ALA . 12.5 ptt85 -61.03 -43.22 99.21 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.706 -0.224 . . . . 0.0 111.549 -178.587 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 17' ' ' ALA . . . . . 0.623 ' N ' ' HG3' ' B' ' 16' ' ' ARG . . . -66.41 -51.25 58.93 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.805 0.336 . . . . 0.0 111.43 -179.176 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 29.9 tp -60.37 -54.59 43.79 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.714 -179.394 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 19' ' ' VAL . . . . . 0.537 HG22 ' HZ2' ' B' ' 27' ' ' TRP . 77.8 t -59.9 -45.36 95.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -178.698 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 20' ' ' ARG . . . . . 0.491 ' HD2' ' HA ' ' B' ' 20' ' ' ARG . 23.6 tpt85 -71.71 -56.18 6.28 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -178.107 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 21' ' ' VAL . . . . . 0.466 HG11 ' O ' ' A' ' 17' ' ' GLN . 89.2 t -61.83 -45.97 97.52 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.844 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 -176.965 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 74.4 m -71.63 -23.05 61.63 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 -178.89 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 165.84 -102.92 0.2 Allowed Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.013 -1.089 . . . . 0.0 112.908 -179.893 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 24' ' ' GLY . . . . . 0.402 ' HA3' ' HD3' ' B' ' 25' ' ' PRO . . . -177.92 -99.06 0.12 Allowed Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 121.028 -0.605 . . . . 0.0 112.27 -179.863 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 25' ' ' PRO . . . . . 0.402 ' HD3' ' HA3' ' B' ' 24' ' ' GLY . 36.3 Cg_exo -60.76 -31.44 91.87 Favored 'Trans proline' 0 CA--C 1.529 0.256 0 C-N-CA 123.164 2.576 . . . . 0.0 113.038 -179.548 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 26' ' ' ARG . . . . . 0.566 ' HB2' ' CZ ' ' B' ' 26' ' ' ARG . 0.2 OUTLIER -163.82 152.49 13.63 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 109.562 -0.532 . . . . 0.0 109.562 179.905 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 27' ' ' TRP . . . . . 0.558 ' CZ3' ' HB2' ' B' ' 30' ' ' GLU . 0.0 OUTLIER -147.29 -90.26 0.09 Allowed 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.378 -179.33 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 28' ' ' SER . . . . . 0.406 ' HB2' ' HD2' ' A' ' 25' ' ' PRO . 39.6 m -166.68 58.76 0.09 Allowed 'General case' 0 C--N 1.326 -0.43 0 O-C-N 123.315 0.384 . . . . 0.0 111.714 -179.647 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 29' ' ' THR . . . . . 0.699 HG23 ' H ' ' B' ' 30' ' ' GLU . 1.6 t -166.73 -90.4 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 179.074 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 30' ' ' GLU . . . . . 0.699 ' H ' HG23 ' B' ' 29' ' ' THR . 2.0 mp0 -63.22 -27.66 69.51 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 177.812 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 31' ' ' ALA . . . . . 0.409 ' H ' ' HZ3' ' B' ' 27' ' ' TRP . . . . . . . . 0 C--O 1.253 1.261 0 CA-C-N 114.716 -1.129 . . . . 0.0 109.126 179.449 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 0.906 0 N-CA-C 109.95 -0.389 . . . . 0.0 109.95 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -66.29 130.87 44.69 Favored 'General case' 0 C--N 1.331 -0.208 0 O-C-N 123.024 0.203 . . . . 0.0 110.504 179.48 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -178.12 142.53 0.28 Allowed 'General case' 0 N--CA 1.443 -0.778 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 -179.582 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 10.0 t -59.3 -23.07 62.13 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.154 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 34.2 t-20 -148.94 103.01 3.38 Favored Pre-proline 0 C--N 1.325 -0.485 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 178.789 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_exo -59.11 -47.23 18.37 Favored 'Trans proline' 0 C--N 1.331 -0.354 0 C-N-CA 123.742 2.961 . . . . 0.0 113.093 -178.681 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.86 -41.88 78.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.271 0.557 . . . . 0.0 110.666 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.452 ' HD3' ' HA ' ' A' ' 8' ' ' ARG . 30.4 mmt-85 -70.35 -49.38 49.82 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.56 -0.746 . . . . 0.0 111.184 179.335 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 28.0 t80 -59.03 -49.12 79.12 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.657 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.811 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 95.0 m -63.31 -30.48 71.61 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.65 -179.416 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.424 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 36.0 t -77.04 -56.0 4.96 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.207 0.527 . . . . 0.0 110.063 178.97 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 85.5 mt -55.23 -55.08 35.33 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.078 -0.964 . . . . 0.0 110.723 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.403 ' HB2' ' H ' ' A' ' 14' ' ' GLY . 15.2 m -95.14 -92.88 0.19 Allowed 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.925 -0.579 . . . . 0.0 109.775 178.87 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.403 ' H ' ' HB2' ' A' ' 13' ' ' SER . . . 165.65 149.97 6.08 Favored Glycine 0 N--CA 1.448 -0.515 0 N-CA-C 111.221 -0.751 . . . . 0.0 111.221 179.649 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.504 ' HA ' ' NH1' ' B' ' 6' ' ' ARG . 73.9 m -134.99 134.41 40.46 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 117.191 0.495 . . . . 0.0 111.027 -179.969 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.818 HG23 ' H ' ' A' ' 19' ' ' ASP . 6.4 t -81.52 160.89 23.8 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 179.212 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.466 ' O ' HG11 ' B' ' 21' ' ' VAL . 68.2 mm-40 -56.96 -40.09 75.83 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.234 0.54 . . . . 0.0 109.753 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 38.4 tt0 -62.59 -38.92 92.04 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.46 -0.791 . . . . 0.0 109.83 178.113 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.818 ' H ' HG23 ' A' ' 16' ' ' THR . 11.3 t0 -57.33 -47.49 81.42 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.006 -0.997 . . . . 0.0 109.183 178.848 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.718 HD21 HD11 ' B' ' 9' ' ' LEU . 4.4 mm? -62.18 -43.19 99.39 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.303 178.605 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.468 ' HG ' ' HE2' ' A' ' 26' ' ' TYR . 39.4 tp -54.71 -51.47 65.47 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.663 179.816 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 6.8 p -62.83 -16.02 56.68 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.546 ' HG ' ' O ' ' A' ' 19' ' ' ASP . 89.2 mt -80.26 -27.43 38.63 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.948 0.404 . . . . 0.0 110.235 179.08 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.481 ' HA ' ' HD3' ' A' ' 25' ' ' PRO . 88.6 m -92.01 138.37 24.69 Favored Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.187 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.481 ' HD3' ' HA ' ' A' ' 24' ' ' CYS . 8.3 Cg_exo -71.11 139.28 35.28 Favored 'Trans proline' 0 N--CA 1.458 -0.601 0 C-N-CA 123.077 2.518 . . . . 0.0 112.1 179.83 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.468 ' HE2' ' HG ' ' A' ' 21' ' ' LEU . 0.5 OUTLIER . . . . . 0 C--O 1.252 1.22 0 CA-C-O 117.407 -1.282 . . . . 0.0 109.322 179.396 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 1' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo . . . . . 0 N--CA 1.482 0.799 0 N-CA-C 110.854 -0.479 . . . . 0.0 110.854 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 2' ' ' THR . . . . . 0.553 ' HB ' ' HD2' ' B' ' 3' ' ' PRO . 0.2 OUTLIER -155.6 174.65 3.74 Favored Pre-proline 0 C--N 1.319 -0.721 0 CA-C-N 115.377 -0.829 . . . . 0.0 108.778 -179.224 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 3' ' ' PRO . . . . . 0.553 ' HD2' ' HB ' ' B' ' 2' ' ' THR . 44.6 Cg_endo -67.82 59.94 0.87 Allowed 'Trans proline' 0 C--N 1.354 0.86 0 C-N-CA 122.872 2.382 . . . . 0.0 112.247 179.862 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 4' ' ' GLU . . . . . 0.508 ' OE1' ' HG3' ' A' ' 18' ' ' GLN . 22.0 mt-10 -81.32 140.71 34.63 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 114.308 -1.314 . . . . 0.0 111.155 -179.025 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 5' ' ' MET . . . . . . . . . . . . . 13.6 tpt -117.1 142.47 46.96 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.481 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 6' ' ' ARG . . . . . 0.769 ' NH1' ' HA ' ' A' ' 15' ' ' CYS . 14.1 tpp180 -73.98 122.82 23.2 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 178.96 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 62.2 tt0 -132.51 145.04 50.85 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-O 121.087 0.47 . . . . 0.0 111.123 -178.68 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 10.1 mmtp -81.61 96.17 7.4 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 177.88 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 9' ' ' LEU . . . . . 0.996 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 21.5 mt -76.41 56.42 1.08 Allowed 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 112.848 0.684 . . . . 0.0 112.848 -178.079 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 99.4 m -75.94 121.45 22.7 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.164 -0.471 . . . . 0.0 109.807 178.351 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 62.35 -123.64 31.48 Favored Glycine 0 CA--C 1.521 0.462 0 C-N-CA 121.262 -0.494 . . . . 0.0 114.015 179.382 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 12' ' ' HIS . . . . . 0.485 ' O ' ' HG2' ' B' ' 16' ' ' ARG . 20.7 t-160 -51.44 -32.37 26.56 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 112.894 0.701 . . . . 0.0 112.894 -178.526 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 13' ' ' HIS . . . . . 0.628 ' HB3' ' HA ' ' B' ' 9' ' ' LEU . 28.7 m170 -57.75 -42.9 84.89 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 120.905 -0.318 . . . . 0.0 110.799 -179.433 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 14' ' ' PHE . . . . . 0.683 ' HA ' HD13 ' B' ' 9' ' ' LEU . 43.3 t80 -61.42 -45.9 92.39 Favored 'General case' 0 C--N 1.327 -0.396 0 O-C-N 123.418 0.449 . . . . 0.0 110.0 178.995 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 59.3 t -55.7 -56.61 11.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.568 -0.742 . . . . 0.0 112.108 -179.62 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 16' ' ' ARG . . . . . 0.485 ' HG2' ' O ' ' B' ' 12' ' ' HIS . 2.5 ptm180 -59.91 -47.71 84.68 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -179.147 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.79 -43.76 83.06 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.146 0.425 . . . . 0.0 112.146 -178.818 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 36.9 tp -59.34 -48.76 80.42 Favored 'General case' 0 C--N 1.327 -0.406 0 O-C-N 123.156 0.285 . . . . 0.0 110.698 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 19' ' ' VAL . . . . . 0.474 HG13 ' HA ' ' B' ' 26' ' ' ARG . 72.7 t -61.31 -44.16 97.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.744 179.728 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.5 -47.07 86.94 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.595 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 21' ' ' VAL . . . . . 0.445 HG21 ' HA ' ' A' ' 17' ' ' GLN . 69.1 t -76.08 -45.95 35.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 N-CA-C 113.013 0.746 . . . . 0.0 113.013 -177.815 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 95.6 m -77.66 27.79 0.17 Allowed 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 -178.464 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 154.94 -53.65 0.43 Allowed Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 119.853 -1.165 . . . . 0.0 113.346 178.738 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 122.21 -83.86 0.36 Allowed Glycine 0 N--CA 1.45 -0.409 0 N-CA-C 110.981 -0.848 . . . . 0.0 110.981 -178.953 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -67.74 -37.84 15.19 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.42 2.08 . . . . 0.0 110.615 178.585 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 26' ' ' ARG . . . . . 0.474 ' HA ' HG13 ' B' ' 19' ' ' VAL . 53.1 mtp180 -152.7 -150.26 0.33 Allowed 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 107.577 -1.268 . . . . 0.0 107.577 178.098 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 27' ' ' TRP . . . . . 0.571 ' CH2' ' HB2' ' B' ' 30' ' ' GLU . 0.0 OUTLIER -163.31 -34.67 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.886 0.374 . . . . 0.0 110.855 178.595 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 32.3 t -160.56 -147.98 0.16 Allowed 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.317 -179.497 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 29' ' ' THR . . . . . 0.419 HG22 ' H ' ' B' ' 29' ' ' THR . 3.0 t -84.07 -33.55 24.39 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.456 179.966 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 30' ' ' GLU . . . . . 0.571 ' HB2' ' CH2' ' B' ' 27' ' ' TRP . 3.8 mp0 -59.02 -44.91 91.78 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.751 -0.658 . . . . 0.0 110.927 -179.559 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 31' ' ' ALA . . . . . 0.56 ' HB3' ' CZ3' ' B' ' 27' ' ' TRP . . . . . . . . 0 C--O 1.251 1.163 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.582 179.795 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.033 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -161.78 147.44 13.51 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 123.459 0.474 . . . . 0.0 109.939 -179.643 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -82.52 50.17 1.6 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.369 0.604 . . . . 0.0 111.058 -179.777 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 4.8 p -83.9 51.18 1.98 Allowed 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.774 179.54 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 23.3 t-20 -171.48 116.66 0.43 Allowed Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.135 -179.403 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.64 ' HB3' HD13 ' A' ' 23' ' ' LEU . 33.5 Cg_exo -56.88 -48.3 19.14 Favored 'Trans proline' 0 N--CA 1.47 0.125 0 C-N-CA 123.288 2.659 . . . . 0.0 113.448 -178.819 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.53 -39.42 87.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.499 0.666 . . . . 0.0 110.35 179.637 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.45 ' HA ' ' NE ' ' A' ' 8' ' ' ARG . 0.4 OUTLIER -67.93 -49.92 59.01 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.262 -0.881 . . . . 0.0 109.809 179.317 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 17.0 t80 -56.34 -51.59 67.7 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.031 -0.986 . . . . 0.0 111.1 179.684 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.996 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 57.6 m -61.92 -28.56 69.61 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.124 -179.588 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 42.3 t -82.52 -55.3 4.56 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.375 0.607 . . . . 0.0 111.124 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 91.6 mt -64.22 -58.73 5.74 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.157 -0.929 . . . . 0.0 112.417 -178.917 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 8.9 m -89.98 -43.75 10.34 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.999 0.428 . . . . 0.0 111.194 -179.17 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.688 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 103.81 149.46 20.47 Favored Glycine 0 N--CA 1.446 -0.635 0 N-CA-C 110.86 -0.896 . . . . 0.0 110.86 -178.98 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.769 ' HA ' ' NH1' ' B' ' 6' ' ' ARG . 28.2 p -139.95 -161.44 1.2 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 117.443 0.622 . . . . 0.0 110.944 -179.513 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.693 ' H ' ' HB2' ' A' ' 19' ' ' ASP . 6.9 t -160.1 -166.47 1.71 Allowed 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 -179.757 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.445 ' HA ' HG21 ' B' ' 21' ' ' VAL . 36.4 tt0 -59.0 -53.8 54.35 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.176 0.435 . . . . 0.0 112.176 -179.008 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.508 ' HG3' ' OE1' ' B' ' 4' ' ' GLU . 23.4 mt-30 -57.34 -45.85 83.87 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.819 0.343 . . . . 0.0 110.591 179.549 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.693 ' HB2' ' H ' ' A' ' 16' ' ' THR . 1.1 m-20 -56.53 -43.39 79.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.312 179.122 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.519 HD11 HD11 ' B' ' 9' ' ' LEU . 84.2 mt -72.04 -37.54 69.69 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.1 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 6.1 tt -57.13 -46.08 82.98 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.951 -179.76 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.5 p -64.98 -13.8 58.53 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.95 0.405 . . . . 0.0 111.73 179.076 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.64 HD13 ' HB3' ' A' ' 6' ' ' PRO . 90.5 mt -94.19 -18.24 21.92 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.822 179.435 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.46 ' HA ' ' HD3' ' A' ' 25' ' ' PRO . 69.9 m -67.39 135.89 93.29 Favored Pre-proline 0 C--N 1.333 -0.149 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.886 -179.538 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' A' ' 24' ' ' CYS . 4.4 Cg_exo -74.2 124.81 9.29 Favored 'Trans proline' 0 N--CA 1.459 -0.549 0 C-N-CA 122.924 2.416 . . . . 0.0 112.317 -179.798 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.247 0.965 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.41 179.345 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 1' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo . . . . . 0 N--CA 1.481 0.752 0 N-CA-C 110.004 -0.806 . . . . 0.0 110.004 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 2' ' ' THR . . . . . 0.59 ' HB ' ' HD2' ' B' ' 3' ' ' PRO . 0.2 OUTLIER -158.33 176.28 2.72 Favored Pre-proline 0 C--N 1.316 -0.887 0 N-CA-C 107.11 -1.441 . . . . 0.0 107.11 -178.782 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 3' ' ' PRO . . . . . 0.59 ' HD2' ' HB ' ' B' ' 2' ' ' THR . 13.9 Cg_endo -58.99 90.86 0.07 OUTLIER 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 121.417 1.411 . . . . 0.0 110.188 179.086 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 4' ' ' GLU . . . . . 0.434 ' HG2' ' O ' ' B' ' 2' ' ' THR . 41.5 mm-40 -73.19 49.84 0.27 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.466 -0.788 . . . . 0.0 112.767 -176.933 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 5' ' ' MET . . . . . . . . . . . . . 19.8 ptp -79.54 60.06 3.16 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-O 121.948 0.88 . . . . 0.0 109.103 178.17 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 86.1 mtt-85 -76.26 123.75 26.39 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.769 -1.105 . . . . 0.0 111.929 -178.103 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 69.1 tt0 -99.98 145.28 28.05 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 115.524 -0.762 . . . . 0.0 109.19 178.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 11.5 mmmm -76.23 93.01 3.33 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 178.894 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 9' ' ' LEU . . . . . 0.964 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 34.1 mt -78.2 57.47 1.86 Allowed 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 113.057 0.762 . . . . 0.0 113.057 -177.714 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 10' ' ' CYS . . . . . 0.405 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 87.4 m -73.43 121.6 20.78 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.192 178.413 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 58.65 -119.75 19.07 Favored Glycine 0 CA--C 1.52 0.391 0 N-CA-C 114.38 0.512 . . . . 0.0 114.38 179.22 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 12' ' ' HIS . . . . . 0.518 ' O ' ' HG3' ' B' ' 16' ' ' ARG . 16.5 t-160 -50.06 -32.46 15.6 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 -178.33 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 13' ' ' HIS . . . . . 0.644 ' HB3' ' HA ' ' B' ' 9' ' ' LEU . 23.6 m170 -59.36 -41.38 89.12 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 120.875 -0.33 . . . . 0.0 111.026 -179.267 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 14' ' ' PHE . . . . . 0.627 ' HA ' HD13 ' B' ' 9' ' ' LEU . 22.7 t80 -60.91 -44.42 97.19 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.171 0.51 . . . . 0.0 109.688 178.995 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 15' ' ' VAL . . . . . 0.463 ' O ' HG23 ' B' ' 19' ' ' VAL . 60.0 t -58.55 -58.65 5.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.162 -0.926 . . . . 0.0 112.508 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 16' ' ' ARG . . . . . 0.624 ' HD3' ' N ' ' B' ' 17' ' ' ALA . 0.0 OUTLIER -62.5 -31.92 72.75 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 120.732 -0.387 . . . . 0.0 111.916 -179.123 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 17' ' ' ALA . . . . . 0.624 ' N ' ' HD3' ' B' ' 16' ' ' ARG . . . -65.77 -47.56 74.79 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.545 179.329 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 18' ' ' LEU . . . . . 0.401 ' O ' ' HB2' ' B' ' 22' ' ' CYS . 57.9 mt -61.19 -49.6 76.52 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.838 179.302 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 19' ' ' VAL . . . . . 0.463 HG23 ' O ' ' B' ' 15' ' ' VAL . 87.1 t -57.33 -40.98 77.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.789 -179.813 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 20' ' ' ARG . . . . . 0.573 ' NE ' ' HA ' ' B' ' 20' ' ' ARG . 4.5 tpm_? -80.55 -59.78 2.56 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 -178.737 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 92.2 t -61.14 -44.22 97.88 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 CA-C-N 115.085 -0.962 . . . . 0.0 113.295 -177.132 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 22' ' ' CYS . . . . . 0.401 ' HB2' ' O ' ' B' ' 18' ' ' LEU . 75.9 m -80.67 44.29 0.72 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.83 0.824 . . . . 0.0 111.684 -179.07 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.57 -66.68 3.47 Favored Glycine 0 N--CA 1.447 -0.593 0 CA-C-N 114.916 -1.038 . . . . 0.0 114.172 178.341 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 24' ' ' GLY . . . . . 0.4 ' HA2' ' O ' ' B' ' 19' ' ' VAL . . . 126.17 -70.17 0.49 Allowed Glycine 0 N--CA 1.449 -0.452 0 N-CA-C 111.173 -0.771 . . . . 0.0 111.173 -178.644 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_exo -61.13 -20.99 70.24 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 122.777 2.318 . . . . 0.0 111.471 178.768 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 26' ' ' ARG . . . . . 0.588 ' HD3' ' O ' ' B' ' 26' ' ' ARG . 1.7 tmt_? -66.59 -19.95 65.89 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.863 179.306 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 27' ' ' TRP . . . . . 0.744 ' HA ' ' CE3' ' B' ' 27' ' ' TRP . 0.0 OUTLIER -76.93 51.34 0.78 Allowed 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 122.61 1.195 . . . . 0.0 111.523 179.502 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 12.0 t -108.46 29.23 7.57 Favored 'General case' 0 C--N 1.301 -1.511 0 CA-C-N 113.048 -1.887 . . . . 0.0 108.241 179.474 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 29' ' ' THR . . . . . 0.58 HG23 ' OE1' ' B' ' 30' ' ' GLU . 0.0 OUTLIER -166.18 -61.47 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 114.824 -1.08 . . . . 0.0 110.602 -178.02 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 30' ' ' GLU . . . . . 0.58 ' OE1' HG23 ' B' ' 29' ' ' THR . 34.3 mp0 -92.79 -162.42 0.93 Allowed 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 178.632 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 31' ' ' ALA . . . . . 0.575 ' HA ' ' CD1' ' B' ' 27' ' ' TRP . . . . . . . . 0 C--O 1.249 1.062 0 CA-C-O 117.752 -1.118 . . . . 0.0 109.901 179.202 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.966 0 N-CA-C 110.218 -0.29 . . . . 0.0 110.218 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -151.81 129.53 11.58 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 110.311 -0.255 . . . . 0.0 110.311 179.864 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -79.84 61.53 3.8 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.92 -179.428 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -153.65 -53.33 0.1 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.223 0.535 . . . . 0.0 110.622 179.335 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.423 ' HA ' ' HD3' ' A' ' 6' ' ' PRO . 23.4 t-20 -176.02 112.88 0.26 Allowed Pre-proline 0 C--N 1.32 -0.69 0 CA-C-N 115.184 -0.916 . . . . 0.0 109.478 179.417 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 5' ' ' ASN . 23.3 Cg_exo -61.92 -46.17 14.26 Favored 'Trans proline' 0 C--N 1.334 -0.194 0 C-N-CA 123.443 2.762 . . . . 0.0 113.265 -178.887 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.59 -44.25 85.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.104 0.478 . . . . 0.0 110.424 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 35.6 ttp180 -63.31 -52.2 62.91 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.431 -0.804 . . . . 0.0 109.807 179.085 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 60.8 t80 -55.22 -49.56 71.67 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.369 -1.287 . . . . 0.0 111.27 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.964 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 72.4 m -64.64 -31.95 73.4 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.986 -0.552 . . . . 0.0 112.173 -179.323 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.405 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 42.6 t -76.89 -54.17 6.93 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.301 0.572 . . . . 0.0 110.952 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 11.0 mp -69.84 -59.61 2.83 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.296 -0.866 . . . . 0.0 112.547 -178.833 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.2 m -86.06 -45.6 11.27 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.767 0.318 . . . . 0.0 111.827 -178.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.607 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 104.72 149.71 19.69 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.841 -0.695 . . . . 0.0 111.421 -179.349 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.519 ' SG ' HD12 ' B' ' 9' ' ' LEU . 27.0 p -143.29 145.07 32.4 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.137 0.494 . . . . 0.0 111.509 -179.044 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 8.8 t -94.95 168.57 10.7 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.43 -179.261 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 5.6 mp0 -49.61 -45.31 48.02 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 122.772 0.429 . . . . 0.0 111.464 -179.537 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 4.2 tp60 -61.14 -40.01 92.2 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.254 0.55 . . . . 0.0 110.14 179.508 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.494 ' HB3' ' HB2' ' A' ' 15' ' ' CYS . 1.7 t70 -60.3 -43.95 95.85 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.584 179.286 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.481 HD21 HD11 ' B' ' 9' ' ' LEU . 1.8 mm? -67.49 -44.32 78.8 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.685 178.731 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 31.1 tp -55.87 -44.57 78.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.61 -179.327 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 21.7 m -60.55 -24.07 65.11 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.489 179.535 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 97.3 mt -85.14 -22.51 28.8 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.304 179.79 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.464 ' HA ' ' HD3' ' A' ' 25' ' ' PRO . 89.2 m -97.29 138.06 21.18 Favored Pre-proline 0 C--N 1.326 -0.426 0 CA-C-O 121.112 0.482 . . . . 0.0 111.738 -179.419 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.464 ' HD3' ' HA ' ' A' ' 24' ' ' CYS . 52.4 Cg_endo -91.33 -175.63 0.77 Allowed 'Trans proline' 0 N--CA 1.446 -1.302 0 C-N-CA 123.084 2.522 . . . . 0.0 111.882 179.525 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 23.7 t80 . . . . . 0 C--O 1.25 1.112 0 CA-C-O 117.915 -1.041 . . . . 0.0 109.549 179.065 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 1' ' ' PRO . . . . . 0.418 ' HG2' HG21 ' A' ' 22' ' ' THR . 11.6 Cg_exo . . . . . 0 N--CA 1.474 0.351 0 N-CA-C 110.915 -0.456 . . . . 0.0 110.915 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 23.9 m -149.15 129.94 6.98 Favored Pre-proline 0 C--N 1.323 -0.552 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.354 -179.371 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -60.28 124.85 16.04 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.553 2.169 . . . . 0.0 111.565 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 4' ' ' GLU . . . . . 0.67 ' HB3' ' HB ' ' A' ' 16' ' ' THR . 2.0 tt0 -170.85 -149.74 0.07 Allowed 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 -178.894 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 5' ' ' MET . . . . . 0.565 ' H ' ' CG ' ' B' ' 4' ' ' GLU . 60.8 mtt -79.26 88.22 4.93 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.871 0.367 . . . . 0.0 110.227 179.187 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 65.8 ttt180 -67.13 127.67 33.48 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.179 -0.464 . . . . 0.0 109.931 -179.557 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 7' ' ' GLU . . . . . 0.413 ' HG2' ' N ' ' B' ' 8' ' ' LYS . 55.2 tt0 -131.5 150.0 52.31 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.106 0.479 . . . . 0.0 110.792 -178.798 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 8' ' ' LYS . . . . . 0.413 ' N ' ' HG2' ' B' ' 7' ' ' GLU . 41.3 mttm -87.63 96.47 10.43 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 108.031 -1.1 . . . . 0.0 108.031 177.528 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 9' ' ' LEU . . . . . 0.636 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 3.1 mm? -75.31 55.21 0.76 Allowed 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 -177.975 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 10' ' ' CYS . . . . . 0.432 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 73.4 m -76.24 121.8 23.44 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.697 179.018 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 55.26 -116.96 7.54 Favored Glycine 0 CA--C 1.52 0.4 0 CA-C-N 116.074 -0.512 . . . . 0.0 114.321 178.911 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 19.5 t-160 -50.89 -32.62 21.08 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 112.794 0.665 . . . . 0.0 112.794 -178.627 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 13' ' ' HIS . . . . . 0.635 ' HB3' ' HA ' ' B' ' 9' ' ' LEU . 20.7 m170 -59.48 -46.25 89.33 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.892 -179.273 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 14' ' ' PHE . . . . . . . . . . . . . 44.8 t80 -59.97 -40.88 90.59 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.076 0.465 . . . . 0.0 109.948 179.135 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 15' ' ' VAL . . . . . 0.471 ' O ' HG23 ' B' ' 19' ' ' VAL . 46.3 t -59.09 -55.35 24.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.46 -0.791 . . . . 0.0 111.439 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 16' ' ' ARG . . . . . 0.438 ' HG3' ' O ' ' B' ' 13' ' ' HIS . 2.8 ptm180 -63.18 -38.04 89.59 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.533 -179.484 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 17' ' ' ALA . . . . . 0.618 ' HB1' ' HG ' ' A' ' 20' ' ' LEU . . . -64.24 -47.46 79.54 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.714 0.293 . . . . 0.0 110.929 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 18' ' ' LEU . . . . . 0.443 HD23 ' HB2' ' B' ' 22' ' ' CYS . 1.5 tt -60.46 -51.43 69.51 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.688 -179.969 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 19' ' ' VAL . . . . . 0.715 HG22 ' HD1' ' B' ' 27' ' ' TRP . 67.8 t -59.85 -38.19 75.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -179.511 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 20' ' ' ARG . . . . . 0.756 ' NE ' ' HA ' ' B' ' 20' ' ' ARG . 0.3 OUTLIER -83.24 -54.83 4.71 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -178.326 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 60.9 t -64.14 -50.72 75.66 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.554 -178.458 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 22' ' ' CYS . . . . . 0.537 ' HB3' ' OG ' ' B' ' 28' ' ' SER . 60.8 m -86.11 43.1 1.03 Allowed 'General case' 0 C--O 1.217 -0.616 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 178.541 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -69.76 135.97 27.13 Favored Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.428 -0.891 . . . . 0.0 114.179 -178.198 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -169.23 -132.71 1.48 Allowed Glycine 0 N--CA 1.449 -0.482 0 N-CA-C 109.726 -1.349 . . . . 0.0 109.726 179.305 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -59.99 -39.49 70.23 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.282 1.988 . . . . 0.0 109.801 177.952 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 26' ' ' ARG . . . . . 0.679 ' HG3' ' HB3' ' B' ' 31' ' ' ALA . 6.8 mmm-85 -138.76 -62.75 0.55 Allowed 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 107.286 -1.375 . . . . 0.0 107.286 177.505 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 27' ' ' TRP . . . . . 0.715 ' HD1' HG22 ' B' ' 19' ' ' VAL . 0.0 OUTLIER -168.57 -105.83 0.01 OUTLIER 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.336 177.172 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 28' ' ' SER . . . . . 0.859 ' HB3' ' HD2' ' A' ' 25' ' ' PRO . 58.6 m -164.11 49.73 0.13 Allowed 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 113.063 0.764 . . . . 0.0 113.063 179.805 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 2.5 p -146.97 12.93 1.12 Allowed 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 120.986 0.422 . . . . 0.0 111.121 179.063 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 30' ' ' GLU . . . . . 0.475 ' HB3' ' CH2' ' B' ' 27' ' ' TRP . 4.1 tt0 178.37 -41.71 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 107.353 -1.351 . . . . 0.0 107.353 -179.766 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 31' ' ' ALA . . . . . 0.679 ' HB3' ' HG3' ' B' ' 26' ' ' ARG . . . . . . . . 0 N--CA 1.442 -0.834 0 CA-C-N 113.173 -1.83 . . . . 0.0 107.621 179.418 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' ALA . . . . . 0.795 ' HB3' ' HE1' ' A' ' 9' ' ' TYR . . . . . . . . 0 N--CA 1.48 1.074 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -153.83 133.92 13.26 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 179.575 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -173.32 122.26 0.37 Allowed 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 -179.867 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -76.23 47.96 0.49 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.138 0.494 . . . . 0.0 111.507 -179.378 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -176.42 113.17 0.25 Allowed Pre-proline 0 C--N 1.327 -0.398 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_exo -61.01 -42.17 38.8 Favored 'Trans proline' 0 CA--C 1.526 0.077 0 C-N-CA 123.306 2.671 . . . . 0.0 113.203 -178.778 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.3 -44.45 95.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.395 0.617 . . . . 0.0 110.142 179.642 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.403 ' HA ' ' HD2' ' A' ' 8' ' ' ARG . 17.8 tpt180 -66.5 -48.86 68.48 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.617 179.091 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' TYR . . . . . 0.795 ' HE1' ' HB3' ' A' ' 1' ' ' ALA . 23.6 t80 -55.52 -50.97 68.57 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 114.203 -1.362 . . . . 0.0 111.354 -179.695 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.694 ' O ' ' HA2' ' A' ' 14' ' ' GLY . 41.6 m -69.8 -16.04 63.22 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.796 179.99 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.432 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 24.0 t -85.3 -53.81 4.99 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.764 0.792 . . . . 0.0 109.605 178.821 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 98.6 mt -66.88 -60.38 2.71 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 114.635 -1.166 . . . . 0.0 111.642 -179.608 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 24.8 m -82.08 -42.42 19.23 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.425 -179.679 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.694 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 91.72 142.89 11.14 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.762 -0.732 . . . . 0.0 111.421 -178.959 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.623 ' HB2' ' CB ' ' A' ' 19' ' ' ASP . 29.9 p -141.06 151.5 44.08 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.579 0.228 . . . . 0.0 110.438 -179.117 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.67 ' HB ' ' HB3' ' B' ' 4' ' ' GLU . 27.8 p -76.63 170.59 16.14 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.607 -179.278 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 84.9 mm-40 -62.15 -38.0 87.34 Favored 'General case' 0 C--O 1.234 0.245 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 178.509 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 90.7 mm-40 -62.78 -37.5 86.9 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 115.397 -0.82 . . . . 0.0 109.147 177.429 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.623 ' CB ' ' HB2' ' A' ' 15' ' ' CYS . 91.8 m-20 -59.67 -43.41 94.0 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.342 -0.844 . . . . 0.0 109.022 178.355 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.618 ' HG ' ' HB1' ' B' ' 17' ' ' ALA . 1.8 mm? -61.25 -42.13 98.1 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 177.299 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.569 ' HA ' ' SG ' ' A' ' 24' ' ' CYS . 32.1 tp -57.98 -40.46 80.73 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.54 179.76 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.418 HG21 ' HG2' ' B' ' 1' ' ' PRO . 3.9 m -63.12 -22.17 66.68 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.27 0.557 . . . . 0.0 110.823 179.233 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 93.4 mt -82.64 -21.4 35.06 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.45 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.569 ' SG ' ' HA ' ' A' ' 21' ' ' LEU . 3.1 m -69.31 122.99 87.36 Favored Pre-proline 0 CA--C 1.53 0.18 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 -179.947 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.859 ' HD2' ' HB3' ' B' ' 28' ' ' SER . 6.3 Cg_exo -73.58 121.07 6.81 Favored 'Trans proline' 0 N--CA 1.459 -0.508 0 C-N-CA 122.885 2.39 . . . . 0.0 112.12 -179.781 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.408 ' CE2' ' HB2' ' A' ' 24' ' ' CYS . 0.2 OUTLIER . . . . . 0 C--O 1.251 1.175 0 CA-C-O 117.457 -1.258 . . . . 0.0 109.533 179.467 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 1' ' ' PRO . . . . . 0.478 ' HD2' ' OG1' ' A' ' 22' ' ' THR . 5.1 Cg_exo . . . . . 0 N--CA 1.479 0.635 0 N-CA-C 110.75 -0.519 . . . . 0.0 110.75 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 2' ' ' THR . . . . . 0.566 ' HB ' ' HG3' ' B' ' 4' ' ' GLU . 1.3 p -119.52 136.63 24.77 Favored Pre-proline 0 C--N 1.322 -0.619 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.336 -179.582 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -82.47 49.45 3.11 Favored 'Trans proline' 0 N--CA 1.461 -0.41 0 C-N-CA 122.945 2.43 . . . . 0.0 112.54 -179.807 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 4' ' ' GLU . . . . . 0.69 ' HB2' HG21 ' A' ' 16' ' ' THR . 25.7 mt-10 -85.18 -158.23 0.36 Allowed 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.029 -0.987 . . . . 0.0 109.685 179.344 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 5' ' ' MET . . . . . . . . . . . . . 16.9 tpt -82.23 67.41 8.23 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 177.647 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 42.0 mtt180 -56.62 118.26 4.68 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.525 -0.762 . . . . 0.0 111.855 -178.396 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 7' ' ' GLU . . . . . 0.524 ' OE2' ' HG2' ' B' ' 8' ' ' LYS . 4.7 tp10 -107.9 158.93 16.92 Favored 'General case' 0 N--CA 1.44 -0.929 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 178.767 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 8' ' ' LYS . . . . . 0.524 ' HG2' ' OE2' ' B' ' 7' ' ' GLU . 11.7 mmtm -82.72 97.8 8.75 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-O 121.372 0.605 . . . . 0.0 110.811 -177.713 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 9' ' ' LEU . . . . . 0.748 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 3.3 mm? -83.37 58.29 4.43 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.573 179.545 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 10' ' ' CYS . . . . . 0.512 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 71.9 m -65.07 130.95 45.24 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.857 -0.611 . . . . 0.0 112.041 -179.701 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 53.94 -122.23 22.13 Favored Glycine 0 C--N 1.332 0.325 0 CA-C-N 115.772 -0.649 . . . . 0.0 114.461 178.178 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 17.2 t-160 -52.55 -29.28 24.68 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 123.005 0.522 . . . . 0.0 112.17 -178.931 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 13' ' ' HIS . . . . . 0.576 ' O ' ' HG3' ' B' ' 16' ' ' ARG . 29.4 m170 -59.58 -41.86 91.19 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.736 -0.211 . . . . 0.0 110.49 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 14' ' ' PHE . . . . . 0.507 ' CZ ' ' HB2' ' A' ' 6' ' ' PRO . 8.1 t80 -62.31 -47.51 83.94 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.091 0.472 . . . . 0.0 109.931 178.387 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 56.0 t -55.58 -53.31 37.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.634 -179.645 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 16' ' ' ARG . . . . . 0.576 ' HG3' ' O ' ' B' ' 13' ' ' HIS . 0.0 OUTLIER -63.48 -39.03 93.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.422 -179.525 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 17' ' ' ALA . . . . . 0.42 ' N ' ' HE ' ' B' ' 16' ' ' ARG . . . -65.66 -52.91 47.97 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.557 0.218 . . . . 0.0 111.517 -179.681 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 18' ' ' LEU . . . . . 0.641 HD13 HD23 ' A' ' 23' ' ' LEU . 38.0 tp -57.78 -53.75 54.67 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.825 -179.329 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 19' ' ' VAL . . . . . 0.527 HG12 ' NH1' ' B' ' 20' ' ' ARG . 85.0 t -60.35 -42.85 92.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 -178.997 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 20' ' ' ARG . . . . . 0.723 HH11 ' HA ' ' B' ' 20' ' ' ARG . 2.4 mmt-85 -72.0 -47.98 48.12 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 113.159 0.8 . . . . 0.0 113.159 -178.921 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 21' ' ' VAL . . . . . 0.43 HG11 ' O ' ' A' ' 17' ' ' GLN . 76.6 t -64.74 -46.81 91.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 N-CA-C 112.197 0.443 . . . . 0.0 112.197 -178.879 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 89.5 m -69.34 -40.54 77.48 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.941 -0.304 . . . . 0.0 111.555 -179.379 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 119.78 157.36 10.25 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 119.979 -1.105 . . . . 0.0 113.259 179.243 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 94.49 154.92 31.31 Favored Glycine 0 N--CA 1.446 -0.635 0 C-N-CA 120.916 -0.659 . . . . 0.0 112.788 179.596 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -59.7 -34.46 96.21 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.723 2.282 . . . . 0.0 110.854 179.563 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 49.5 mtp180 -141.12 -172.49 3.5 Favored 'General case' 0 CA--C 1.498 -1.053 0 CA-C-N 115.009 -0.996 . . . . 0.0 108.426 178.335 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 27' ' ' TRP . . . . . 1.023 ' HB3' ' HB3' ' B' ' 31' ' ' ALA . 0.0 OUTLIER -88.27 54.52 3.09 Favored 'General case' 0 N--CA 1.432 -1.342 0 N-CA-C 107.575 -1.269 . . . . 0.0 107.575 176.791 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 40.2 m -63.42 59.35 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 114.729 -1.123 . . . . 0.0 112.99 -178.607 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 29' ' ' THR . . . . . 0.439 ' HB ' ' CZ3' ' B' ' 27' ' ' TRP . 97.4 m -168.31 -36.54 0.02 OUTLIER 'General case' 0 C--N 1.318 -0.793 0 C-N-CA 124.369 1.068 . . . . 0.0 108.298 179.566 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -134.51 15.75 3.7 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.333 -0.848 . . . . 0.0 111.134 -179.395 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 31' ' ' ALA . . . . . 1.023 ' HB3' ' HB3' ' B' ' 27' ' ' TRP . . . . . . . . 0 C--O 1.247 0.95 0 CA-C-O 118.234 -0.889 . . . . 0.0 109.833 -179.401 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' ALA . . . . . 0.566 ' HA ' ' O ' ' A' ' 23' ' ' LEU . . . . . . . . 0 N--CA 1.476 0.833 0 N-CA-C 110.265 -0.272 . . . . 0.0 110.265 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -82.31 56.11 3.12 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.157 -179.807 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -174.0 133.63 0.44 Allowed 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 3.6 p -56.36 -40.3 74.29 Favored 'General case' 0 C--N 1.319 -0.726 0 O-C-N 123.809 0.693 . . . . 0.0 111.374 -179.858 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -151.51 85.66 4.85 Favored Pre-proline 0 C--N 1.319 -0.74 0 CA-C-O 122.288 1.042 . . . . 0.0 109.517 178.451 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.507 ' HB2' ' CZ ' ' B' ' 14' ' ' PHE . 23.4 Cg_exo -59.24 -38.97 82.54 Favored 'Trans proline' 0 C--N 1.328 -0.525 0 C-N-CA 123.999 3.132 . . . . 0.0 112.646 -179.061 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.19 -43.92 83.12 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.972 0.415 . . . . 0.0 110.75 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -67.87 -48.93 64.7 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.095 179.505 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 33.2 t80 -56.52 -52.99 62.68 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 114.936 -1.029 . . . . 0.0 111.306 -179.702 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.748 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 22.5 m -65.46 -23.9 67.03 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.036 -0.529 . . . . 0.0 112.32 -179.73 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.512 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 53.7 t -82.12 -52.89 6.55 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.413 0.625 . . . . 0.0 110.598 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 15.3 tp -69.71 -63.39 1.08 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.041 -0.982 . . . . 0.0 112.182 -178.902 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 36.3 t -81.3 -33.97 32.27 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.395 -178.682 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.687 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 88.6 158.47 33.82 Favored Glycine 0 N--CA 1.443 -0.887 0 C-N-CA 120.57 -0.824 . . . . 0.0 111.156 -178.541 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.5 ' SG ' HD23 ' B' ' 9' ' ' LEU . 26.5 p -151.04 166.8 29.61 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.818 0.309 . . . . 0.0 110.795 -179.204 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.69 HG21 ' HB2' ' B' ' 4' ' ' GLU . 0.2 OUTLIER -121.95 -169.97 1.97 Allowed 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 116.444 -0.343 . . . . 0.0 111.323 -179.17 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.43 ' O ' HG11 ' B' ' 21' ' ' VAL . 23.8 pt20 -58.4 -51.71 68.67 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -178.399 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.535 ' HB2' ' OG1' ' B' ' 2' ' ' THR . 95.4 mm-40 -63.18 -35.96 82.04 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.449 ' HB2' ' H ' ' A' ' 16' ' ' THR . 43.7 m-20 -58.68 -47.0 86.01 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.033 178.461 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -66.19 -44.68 83.28 Favored 'General case' 0 CA--C 1.522 -0.112 0 CA-C-O 120.878 0.37 . . . . 0.0 110.488 178.86 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 31.0 tp -55.36 -53.36 57.2 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.044 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.478 ' OG1' ' HD2' ' B' ' 1' ' ' PRO . 35.4 p -64.64 -12.05 41.84 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.093 -0.503 . . . . 0.0 112.24 179.919 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.641 HD23 HD13 ' B' ' 18' ' ' LEU . 24.6 tp -78.66 -28.74 45.44 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 179.688 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.424 ' HA ' ' HD3' ' A' ' 25' ' ' PRO . 93.2 m -84.34 139.18 38.79 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.672 179.563 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' A' ' 24' ' ' CYS . 16.0 Cg_exo -67.99 127.65 16.4 Favored 'Trans proline' 0 N--CA 1.461 -0.437 0 C-N-CA 123.017 2.478 . . . . 0.0 111.882 -179.855 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 23.0 t80 . . . . . 0 C--O 1.248 1.011 0 CA-C-N 115.334 -0.848 . . . . 0.0 108.806 179.941 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 1' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo . . . . . 0 N--CA 1.481 0.781 0 N-CA-C 109.615 -0.956 . . . . 0.0 109.615 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 2' ' ' THR . . . . . 0.597 ' HB ' ' HD2' ' B' ' 3' ' ' PRO . 0.1 OUTLIER -153.89 179.04 1.39 Allowed Pre-proline 0 C--N 1.314 -0.963 0 CA-C-N 114.159 -1.382 . . . . 0.0 107.636 -178.385 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 3' ' ' PRO . . . . . 0.597 ' HD2' ' HB ' ' B' ' 2' ' ' THR . 30.2 Cg_endo -64.74 73.97 0.21 Allowed 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 121.953 1.769 . . . . 0.0 111.531 179.508 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 4' ' ' GLU . . . . . 0.401 ' N ' ' O ' ' B' ' 2' ' ' THR . 0.5 OUTLIER -70.57 36.33 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 124.233 1.013 . . . . 0.0 112.439 -178.637 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 5' ' ' MET . . . . . 0.441 ' H ' ' C ' ' B' ' 3' ' ' PRO . 21.9 ptm -64.23 115.35 4.93 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.289 179.548 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 6' ' ' ARG . . . . . 0.628 ' HA ' ' O ' ' A' ' 15' ' ' CYS . 19.8 mmm180 -85.38 125.96 33.39 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.82 -179.387 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 77.4 tt0 -129.58 144.94 51.49 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 178.961 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 8' ' ' LYS . . . . . 0.447 ' HA ' ' O ' ' A' ' 10' ' ' CYS . 24.5 mmtp -82.47 104.68 12.93 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 179.383 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 9' ' ' LEU . . . . . 0.769 ' HB2' ' SG ' ' A' ' 10' ' ' CYS . 6.5 mp -81.12 52.04 1.71 Allowed 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 -179.158 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 71.0 m -72.56 121.32 19.5 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.172 178.856 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 61.08 -120.94 24.89 Favored Glycine 0 CA--C 1.522 0.47 0 N-CA-C 114.417 0.527 . . . . 0.0 114.417 179.168 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 13.5 t-80 -50.18 -33.36 18.95 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 113.589 0.959 . . . . 0.0 113.589 -178.082 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 13' ' ' HIS . . . . . 0.604 ' HB3' ' HA ' ' B' ' 9' ' ' LEU . 24.3 m170 -58.34 -41.43 84.62 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.914 -0.315 . . . . 0.0 111.024 -179.117 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 14' ' ' PHE . . . . . 0.714 ' HA ' HD23 ' B' ' 9' ' ' LEU . 22.5 t80 -62.63 -45.09 94.44 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.014 0.435 . . . . 0.0 110.127 179.321 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 51.4 t -59.02 -58.78 5.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.407 -0.815 . . . . 0.0 112.119 -179.801 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 16' ' ' ARG . . . . . 0.402 HH21 HD11 ' B' ' 9' ' ' LEU . 0.0 OUTLIER -59.53 -39.79 85.08 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.872 -179.104 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.01 -43.27 88.17 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.967 -0.293 . . . . 0.0 111.069 -179.933 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 18' ' ' LEU . . . . . 0.495 HD22 ' CH2' ' B' ' 27' ' ' TRP . 9.7 mt -60.01 -56.3 23.43 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.826 179.802 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 19' ' ' VAL . . . . . 0.661 ' O ' ' HA3' ' B' ' 23' ' ' GLY . 7.8 t -65.93 -29.04 45.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -178.569 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 20' ' ' ARG . . . . . 0.571 ' NE ' ' HA ' ' B' ' 20' ' ' ARG . 3.3 tpm_? -80.12 -59.79 2.58 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 119.906 -0.718 . . . . 0.0 111.512 -179.828 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 60.2 t -65.19 -50.28 74.68 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 CA-C-N 115.209 -0.905 . . . . 0.0 111.739 -178.434 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 56.4 m -101.97 37.28 1.88 Allowed 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.926 0.393 . . . . 0.0 110.635 -179.669 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 23' ' ' GLY . . . . . 0.661 ' HA3' ' O ' ' B' ' 19' ' ' VAL . . . -127.65 121.32 3.77 Favored Glycine 0 N--CA 1.445 -0.716 0 C-N-CA 120.486 -0.864 . . . . 0.0 112.076 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 166.02 -111.76 0.47 Allowed Glycine 0 N--CA 1.443 -0.898 0 N-CA-C 110.86 -0.896 . . . . 0.0 110.86 -179.635 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -63.07 -31.47 76.0 Favored 'Trans proline' 0 N--CA 1.465 -0.194 0 C-N-CA 122.574 2.182 . . . . 0.0 111.939 179.145 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 11.9 mmm180 -144.82 149.56 35.63 Favored 'General case' 0 CA--C 1.498 -1.033 0 CA-C-O 121.739 0.78 . . . . 0.0 111.034 179.741 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 27' ' ' TRP . . . . . 0.883 ' HB3' ' HB3' ' B' ' 31' ' ' ALA . 0.0 OUTLIER -159.18 52.22 0.38 Allowed 'General case' 0 C--N 1.305 -1.344 0 CA-C-N 113.365 -1.743 . . . . 0.0 108.06 178.837 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 73.8 m -58.2 68.48 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 114.056 1.132 . . . . 0.0 114.056 -178.833 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 29' ' ' THR . . . . . 0.414 ' N ' ' O ' ' B' ' 27' ' ' TRP . 97.0 m -173.55 -38.95 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 179.17 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 30' ' ' GLU . . . . . 0.554 ' HB3' ' CD1' ' B' ' 27' ' ' TRP . 40.6 tt0 -119.65 -31.3 4.59 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 113.765 -1.562 . . . . 0.0 110.422 -179.492 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 31' ' ' ALA . . . . . 0.883 ' HB3' ' HB3' ' B' ' 27' ' ' TRP . . . . . . . . 0 C--O 1.248 0.995 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.813 -178.933 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.067 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -157.51 146.1 19.44 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 179.685 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.472 ' HB1' ' HB2' ' A' ' 9' ' ' TYR . . . -79.92 60.01 3.37 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.055 0.455 . . . . 0.0 111.104 -179.811 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 7.4 p -77.37 50.8 0.81 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.597 -179.884 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.502 ' HB3' ' HB2' ' A' ' 8' ' ' ARG . 32.0 t-20 -171.64 111.83 0.4 Allowed Pre-proline 0 C--N 1.328 -0.363 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.417 ' HB2' ' CZ ' ' B' ' 14' ' ' PHE . 32.1 Cg_exo -59.28 -47.39 17.37 Favored 'Trans proline' 0 C--N 1.334 -0.207 0 C-N-CA 123.371 2.714 . . . . 0.0 113.631 -178.675 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.14 -43.32 95.8 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.347 0.594 . . . . 0.0 110.204 179.854 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.655 ' HE ' ' HA ' ' A' ' 8' ' ' ARG . 1.1 mmp_? -67.72 -47.59 68.92 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.956 179.147 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' TYR . . . . . 0.472 ' HB2' ' HB1' ' A' ' 3' ' ' ALA . 9.7 t80 -58.04 -53.4 58.72 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.891 -179.88 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.769 ' SG ' ' HB2' ' B' ' 9' ' ' LEU . 9.3 t -69.42 -18.4 63.74 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 112.08 0.4 . . . . 0.0 112.08 -178.41 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 26.9 t -85.51 -51.28 6.62 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.798 0.808 . . . . 0.0 109.879 178.817 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 14.9 tp -66.06 -62.5 1.45 Allowed 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 114.559 -1.2 . . . . 0.0 111.284 -179.798 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 6.8 m -85.07 -45.3 12.23 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.39 -179.165 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.728 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 99.93 144.19 15.7 Favored Glycine 0 N--CA 1.452 -0.264 0 N-CA-C 111.2 -0.76 . . . . 0.0 111.2 -179.077 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.628 ' O ' ' HA ' ' B' ' 6' ' ' ARG . 24.0 p -134.69 -151.03 0.41 Allowed 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 120.749 -0.38 . . . . 0.0 111.303 -178.475 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.553 ' H ' ' HB2' ' A' ' 19' ' ' ASP . 13.1 t -158.9 176.99 11.63 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -179.099 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 5.7 mp0 -56.62 -45.01 81.76 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 123.289 0.368 . . . . 0.0 110.823 -179.546 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -64.23 -41.61 96.93 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.965 0.412 . . . . 0.0 109.956 179.621 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.553 ' HB2' ' H ' ' A' ' 16' ' ' THR . 0.1 OUTLIER -58.73 -38.83 79.21 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.278 -0.873 . . . . 0.0 110.154 178.959 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.582 HD11 HD21 ' B' ' 9' ' ' LEU . 77.5 mt -75.7 -47.26 26.93 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.911 179.292 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 36.3 tp -52.08 -51.96 54.28 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.734 -0.666 . . . . 0.0 112.158 -178.581 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 15.3 t -63.48 -13.03 36.46 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 112.245 0.461 . . . . 0.0 112.245 -179.445 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 39.8 tp -102.73 -16.83 15.87 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.035 -179.824 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.515 ' HA ' ' HD3' ' A' ' 25' ' ' PRO . 87.4 m -80.59 135.0 53.35 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 120.939 0.399 . . . . 0.0 112.046 -179.092 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.515 ' HD3' ' HA ' ' A' ' 24' ' ' CYS . 4.5 Cg_endo -82.84 134.02 7.08 Favored 'Trans proline' 0 N--CA 1.449 -1.116 0 C-N-CA 123.204 2.603 . . . . 0.0 111.361 178.969 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 22.4 t80 . . . . . 0 C--O 1.247 0.947 0 CA-C-O 118.14 -0.933 . . . . 0.0 109.802 179.648 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 1' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo . . . . . 0 N--CA 1.486 1.071 0 N-CA-C 110.482 -0.622 . . . . 0.0 110.482 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 2' ' ' THR . . . . . 0.572 ' HB ' ' HD2' ' B' ' 3' ' ' PRO . 0.1 OUTLIER -168.93 177.73 1.14 Allowed Pre-proline 0 C--N 1.316 -0.861 0 N-CA-C 106.256 -1.757 . . . . 0.0 106.256 -178.761 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 3' ' ' PRO . . . . . 0.572 ' HD2' ' HB ' ' B' ' 2' ' ' THR . 7.2 Cg_endo -53.09 96.89 0.04 OUTLIER 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 121.408 1.405 . . . . 0.0 108.76 178.689 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -58.77 127.35 31.77 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-O 122.615 1.198 . . . . 0.0 113.525 -175.006 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 5' ' ' MET . . . . . . . . . . . . . 22.1 ptt? -169.84 46.15 0.03 OUTLIER 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 112.457 -2.156 . . . . 0.0 105.786 179.464 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 21.2 mtp85 -56.38 118.62 4.94 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 113.08 -1.873 . . . . 0.0 112.082 -177.137 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 74.2 tt0 -94.15 142.08 27.81 Favored 'General case' 0 N--CA 1.444 -0.738 0 N-CA-C 108.374 -0.973 . . . . 0.0 108.374 178.151 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 18.0 mmtp -76.06 101.54 5.33 Favored 'General case' 0 C--N 1.315 -0.923 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 179.469 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 9' ' ' LEU . . . . . 1.023 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 8.4 mp -80.91 51.9 1.64 Allowed 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 112.57 0.581 . . . . 0.0 112.57 -178.772 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 73.5 m -70.67 120.21 15.95 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.061 178.645 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 61.65 -120.24 21.55 Favored Glycine 0 CA--C 1.523 0.545 0 N-CA-C 114.542 0.577 . . . . 0.0 114.542 179.207 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 13.3 t-80 -49.56 -33.99 16.39 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 113.751 1.019 . . . . 0.0 113.751 -177.952 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 13' ' ' HIS . . . . . 0.644 ' CB ' ' HA ' ' B' ' 9' ' ' LEU . 25.7 m170 -58.28 -41.27 84.02 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.795 -0.362 . . . . 0.0 110.949 -179.252 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 14' ' ' PHE . . . . . 0.992 ' HA ' HD23 ' B' ' 9' ' ' LEU . 31.7 t80 -62.51 -46.39 88.65 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.898 0.38 . . . . 0.0 110.074 178.866 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 62.1 t -55.5 -57.73 6.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.571 -0.741 . . . . 0.0 112.05 -179.663 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.08 -40.18 92.71 Favored 'General case' 0 N--CA 1.464 0.226 0 N-CA-C 112.342 0.497 . . . . 0.0 112.342 -178.93 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 17' ' ' ALA . . . . . 0.518 ' HB3' HD21 ' B' ' 9' ' ' LEU . . . -70.05 -46.82 64.19 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.612 -179.601 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 18' ' ' LEU . . . . . 0.474 ' HG ' ' CD1' ' B' ' 27' ' ' TRP . 57.7 tp -56.76 -52.17 66.05 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.836 -179.877 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 19' ' ' VAL . . . . . 0.53 ' HA ' ' O ' ' B' ' 26' ' ' ARG . 89.7 t -62.47 -48.14 89.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.824 -0.625 . . . . 0.0 112.252 -179.659 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 20' ' ' ARG . . . . . 0.889 ' HE ' ' HA ' ' B' ' 20' ' ' ARG . 0.0 OUTLIER -70.52 -40.85 73.25 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 114.031 1.123 . . . . 0.0 114.031 -178.322 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 71.3 t -73.11 -46.77 50.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -178.233 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 22' ' ' CYS . . . . . 0.41 ' HB3' ' OG ' ' B' ' 28' ' ' SER . 80.6 m -75.99 -36.04 59.35 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 -178.225 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -161.33 -127.24 0.87 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 119.294 -1.431 . . . . 0.0 113.993 -179.243 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -146.11 -64.49 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 121.179 -0.534 . . . . 0.0 112.143 -179.465 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 25' ' ' PRO . . . . . 0.849 ' HB2' ' HB1' ' B' ' 31' ' ' ALA . 23.9 Cg_exo -63.15 -41.95 25.45 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 122.181 1.921 . . . . 0.0 110.515 179.053 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 26' ' ' ARG . . . . . 0.643 ' HB2' ' HB3' ' B' ' 31' ' ' ALA . 12.0 mmt85 -140.25 -90.92 0.17 Allowed 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 115.195 -0.911 . . . . 0.0 109.376 177.723 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 27' ' ' TRP . . . . . 0.474 ' CD1' ' HG ' ' B' ' 18' ' ' LEU . 0.0 OUTLIER -156.25 -86.62 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 118.316 0.507 . . . . 0.0 111.93 179.731 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 28' ' ' SER . . . . . 0.41 ' OG ' ' HB3' ' B' ' 22' ' ' CYS . 55.7 m -154.56 58.15 0.69 Allowed 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 113.551 0.945 . . . . 0.0 113.551 -178.251 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 29' ' ' THR . . . . . 0.407 HG23 ' HZ3' ' B' ' 27' ' ' TRP . 4.3 t 179.9 -54.72 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.361 0 O-C-N 122.424 -0.172 . . . . 0.0 111.122 177.696 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -85.73 -39.23 17.4 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 178.485 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 31' ' ' ALA . . . . . 0.849 ' HB1' ' HB2' ' B' ' 25' ' ' PRO . . . . . . . . 0 C--O 1.252 1.204 0 CA-C-O 116.739 -1.601 . . . . 0.0 107.221 179.563 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.03 0 N-CA-C 110.416 -0.216 . . . . 0.0 110.416 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -70.42 144.71 51.44 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.706 179.832 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -164.78 128.6 2.44 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 5.7 t -56.44 -33.13 65.57 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.361 -179.48 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -178.0 108.68 0.22 Allowed Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.663 178.719 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.688 ' HB3' HD13 ' A' ' 23' ' ' LEU . 16.9 Cg_exo -64.33 -44.88 10.68 Favored 'Trans proline' 0 C--N 1.333 -0.283 0 C-N-CA 123.421 2.747 . . . . 0.0 113.179 -179.053 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.71 -42.07 78.51 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.051 0.453 . . . . 0.0 110.527 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 13.9 ttm180 -61.7 -54.45 42.41 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.012 179.367 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 35.3 t80 -57.57 -49.16 77.3 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.627 -1.17 . . . . 0.0 111.295 -179.705 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 1.023 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 54.3 m -65.23 -27.39 68.63 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.966 -0.561 . . . . 0.0 112.243 -179.365 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 52.2 t -80.83 -52.7 7.2 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.556 0.693 . . . . 0.0 110.23 179.516 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 90.8 mt -64.25 -57.9 8.1 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 114.891 -1.05 . . . . 0.0 112.44 -179.175 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 35.5 t -93.3 -44.35 8.35 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 111.725 0.269 . . . . 0.0 111.725 -179.006 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.652 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 105.26 157.82 22.94 Favored Glycine 0 N--CA 1.452 -0.26 0 N-CA-C 110.924 -0.87 . . . . 0.0 110.924 -178.814 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.533 ' HB2' ' CB ' ' A' ' 19' ' ' ASP . 25.7 p -151.28 159.75 44.18 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 117.343 0.571 . . . . 0.0 112.513 -178.295 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 48.2 p -106.73 -174.41 2.53 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.242 179.583 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 54.9 tt0 -57.42 -48.97 77.73 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 111.933 0.346 . . . . 0.0 111.933 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 60.9 tp60 -59.55 -41.96 91.29 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.109 0.481 . . . . 0.0 109.884 179.703 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.638 ' O ' ' HG ' ' A' ' 23' ' ' LEU . 34.2 m-20 -57.14 -44.94 83.88 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.274 -0.875 . . . . 0.0 109.629 179.061 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.667 HD13 HD12 ' A' ' 23' ' ' LEU . 3.6 mm? -59.65 -48.37 81.93 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-O 120.768 0.318 . . . . 0.0 110.527 178.228 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 8.9 tt -55.62 -47.46 76.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.68 179.472 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 8.3 m -60.59 -25.21 66.05 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.331 -0.85 . . . . 0.0 111.816 179.605 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.688 HD13 ' HB3' ' A' ' 6' ' ' PRO . 96.6 mt -73.09 -30.6 63.79 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.272 179.324 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 7.4 m -74.74 165.76 51.05 Favored Pre-proline 0 C--N 1.326 -0.419 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.034 178.766 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -47.87 112.07 0.52 Allowed 'Trans proline' 0 C--N 1.353 0.763 0 C-N-CA 122.669 2.246 . . . . 0.0 112.594 -178.796 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 24.3 t80 . . . . . 0 C--O 1.243 0.715 0 N-CA-C 107.713 -1.217 . . . . 0.0 107.713 -179.427 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 1' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo . . . . . 0 N--CA 1.485 0.98 0 N-CA-C 110.688 -0.543 . . . . 0.0 110.688 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 2' ' ' THR . . . . . 0.567 ' HB ' ' HD2' ' B' ' 3' ' ' PRO . 0.6 OUTLIER -155.72 173.33 4.99 Favored Pre-proline 0 C--N 1.318 -0.782 0 CA-C-N 115.084 -0.962 . . . . 0.0 108.671 -178.905 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 3' ' ' PRO . . . . . 0.567 ' HD2' ' HB ' ' B' ' 2' ' ' THR . 56.6 Cg_endo -70.62 56.05 1.71 Allowed 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.389 2.059 . . . . 0.0 112.588 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 4' ' ' GLU . . . . . 0.574 ' HB2' HH12 ' B' ' 6' ' ' ARG . 2.7 mp0 -68.07 131.43 45.41 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.18 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 5' ' ' MET . . . . . . . . . . . . . 49.6 ttm -66.07 112.99 4.15 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.924 0.392 . . . . 0.0 109.964 179.255 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 6' ' ' ARG . . . . . 0.747 ' HD2' ' HA ' ' A' ' 15' ' ' CYS . 47.0 mmt-85 -79.48 125.78 30.01 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.307 179.877 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -91.68 131.58 36.97 Favored 'General case' 0 N--CA 1.446 -0.635 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 -179.95 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -80.31 86.4 5.68 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 179.365 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 9' ' ' LEU . . . . . 0.992 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 14.6 mt -74.11 55.1 0.56 Allowed 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 -176.891 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 10' ' ' CYS . . . . . 0.409 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 73.8 m -74.24 117.36 15.96 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 177.878 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 63.46 -121.76 24.92 Favored Glycine 0 CA--C 1.521 0.459 0 C-N-CA 121.157 -0.544 . . . . 0.0 113.78 179.813 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -51.79 -32.08 29.71 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 112.825 0.676 . . . . 0.0 112.825 -178.706 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 13' ' ' HIS . . . . . 0.701 ' CB ' ' HA ' ' B' ' 9' ' ' LEU . 52.0 m170 -57.57 -39.76 77.43 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 120.437 -0.505 . . . . 0.0 110.74 -179.387 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 14' ' ' PHE . . . . . 0.848 ' HA ' HD13 ' B' ' 9' ' ' LEU . 34.4 t80 -62.01 -44.34 96.92 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.331 0.586 . . . . 0.0 109.823 178.766 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 55.1 t -62.02 -49.23 84.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.121 -0.945 . . . . 0.0 111.76 179.867 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 16' ' ' ARG . . . . . 0.649 ' HG2' ' HA ' ' B' ' 13' ' ' HIS . 19.2 ptt180 -62.51 -44.99 95.02 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.731 -178.885 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 17' ' ' ALA . . . . . 0.517 ' N ' ' HG3' ' B' ' 16' ' ' ARG . . . -65.54 -41.28 93.2 Favored 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 120.925 -0.31 . . . . 0.0 111.021 -179.854 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 63.6 tp -59.35 -54.72 43.51 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.175 179.89 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 22.3 m -64.67 -28.11 44.08 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.187 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -179.387 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 20' ' ' ARG . . . . . 0.756 ' NE ' ' HA ' ' B' ' 20' ' ' ARG . 3.5 mmp_? -84.49 -48.93 9.09 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -179.41 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 21' ' ' VAL . . . . . 0.557 HG13 ' HG3' ' A' ' 17' ' ' GLN . 58.4 t -63.54 -47.21 92.56 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.781 -179.245 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 22' ' ' CYS . . . . . 0.423 ' O ' ' HZ3' ' B' ' 27' ' ' TRP . 79.3 m -102.55 37.83 1.83 Allowed 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 120.412 -0.515 . . . . 0.0 111.753 -179.272 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -172.59 121.88 0.9 Allowed Glycine 0 N--CA 1.446 -0.661 0 C-N-CA 120.085 -1.055 . . . . 0.0 112.883 179.542 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -77.86 -65.97 1.82 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.896 -0.669 . . . . 0.0 112.259 179.502 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_exo -68.63 -54.63 0.27 Allowed 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.375 2.05 . . . . 0.0 111.698 179.806 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 29.2 mtm105 -150.5 -140.45 0.1 Allowed 'General case' 0 CA--C 1.512 -0.484 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 179.424 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 27' ' ' TRP . . . . . 0.716 ' HA ' ' CE3' ' B' ' 27' ' ' TRP . 0.0 OUTLIER -85.07 50.7 1.99 Allowed 'General case' 0 N--CA 1.438 -1.074 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 178.074 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 24.7 m -64.87 64.74 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 114.594 -1.185 . . . . 0.0 113.347 -179.037 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 29' ' ' THR . . . . . 0.507 ' HB ' ' CZ3' ' B' ' 27' ' ' TRP . 23.7 m -169.86 -44.12 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 179.143 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 30' ' ' GLU . . . . . 0.469 ' HB3' ' NE1' ' B' ' 27' ' ' TRP . 88.5 tt0 -114.08 -23.58 9.45 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.026 -0.988 . . . . 0.0 110.605 -179.819 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 31' ' ' ALA . . . . . 0.691 ' HB3' ' HB3' ' B' ' 27' ' ' TRP . . . . . . . . 0 C--O 1.246 0.915 0 CA-C-O 118.626 -0.702 . . . . 0.0 111.078 -179.047 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.236 0 N-CA-C 110.417 -0.216 . . . . 0.0 110.417 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -64.89 144.15 57.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.16 -179.761 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -169.87 124.66 0.79 Allowed 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 116.134 -0.485 . . . . 0.0 109.982 179.897 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 6.4 p -75.29 62.55 1.29 Allowed 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.814 179.616 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.564 ' HB3' ' HB2' ' A' ' 8' ' ' ARG . 13.3 t-20 -168.59 120.79 0.68 Allowed Pre-proline 0 C--N 1.325 -0.488 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 -178.585 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -53.0 -55.28 3.86 Favored 'Trans proline' 0 N--CA 1.473 0.301 0 C-N-CA 123.438 2.759 . . . . 0.0 114.156 -178.261 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -58.83 -41.64 87.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.404 0.621 . . . . 0.0 110.401 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.564 ' HB2' ' HB3' ' A' ' 5' ' ' ASN . 13.4 mmt180 -66.21 -44.45 83.84 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.722 179.051 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 7.1 t80 -58.58 -46.77 86.24 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.093 0.473 . . . . 0.0 110.188 178.848 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.992 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 55.3 m -61.17 -29.42 69.79 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.446 -0.797 . . . . 0.0 112.134 -179.913 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.409 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 44.0 t -86.96 -53.59 4.81 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.552 0.692 . . . . 0.0 111.06 -179.945 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 9.0 mp -62.79 -40.64 97.97 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.857 -1.065 . . . . 0.0 113.433 -178.673 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 19.6 m -113.71 -42.01 3.5 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 121.074 0.464 . . . . 0.0 111.131 -178.876 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.608 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 105.99 144.13 12.04 Favored Glycine 0 N--CA 1.442 -0.929 0 C-N-CA 120.869 -0.681 . . . . 0.0 111.512 -179.073 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.747 ' HA ' ' HD2' ' B' ' 6' ' ' ARG . 31.0 p -139.04 149.58 44.79 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 -179.453 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.533 HG22 ' OD1' ' A' ' 19' ' ' ASP . 6.2 t -111.78 -167.37 1.17 Allowed 'General case' 0 C--N 1.327 -0.384 0 O-C-N 122.256 -0.277 . . . . 0.0 110.702 -179.037 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.557 ' HG3' HG13 ' B' ' 21' ' ' VAL . 53.7 tt0 -53.28 -46.28 69.24 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.199 -0.455 . . . . 0.0 112.067 -179.186 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.404 ' H ' HG23 ' A' ' 16' ' ' THR . 70.2 mt-30 -60.23 -44.33 95.3 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.691 -0.231 . . . . 0.0 110.819 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.693 ' CB ' ' HB2' ' A' ' 15' ' ' CYS . 1.6 m-20 -58.65 -44.62 90.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.237 -0.438 . . . . 0.0 109.918 179.276 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.555 HD21 HD11 ' B' ' 9' ' ' LEU . 3.9 mm? -66.95 -44.82 79.57 Favored 'General case' 0 CA--C 1.52 -0.2 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.787 179.376 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 19.6 tp -56.86 -48.53 77.89 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.912 -179.232 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 18.2 p -63.6 -15.96 59.56 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 179.786 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 45.3 tp -87.01 -24.76 24.55 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.572 179.611 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.427 ' HA ' ' HD3' ' A' ' 25' ' ' PRO . 79.9 m -84.87 135.24 40.24 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.257 -179.539 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 24' ' ' CYS . 4.6 Cg_exo -77.75 133.66 12.9 Favored 'Trans proline' 0 N--CA 1.456 -0.677 0 C-N-CA 123.151 2.567 . . . . 0.0 112.349 -179.853 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.251 1.157 0 CA-C-O 117.574 -1.203 . . . . 0.0 109.271 179.317 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 1' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo . . . . . 0 N--CA 1.489 1.262 0 CA-C-O 121.579 0.575 . . . . 0.0 110.931 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 2' ' ' THR . . . . . 0.445 HG22 ' HD2' ' B' ' 3' ' ' PRO . 0.0 OUTLIER -157.84 171.42 7.47 Favored Pre-proline 0 C--N 1.316 -0.885 0 CA-C-N 114.885 -1.052 . . . . 0.0 108.421 -179.443 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 3' ' ' PRO . . . . . 0.557 ' HA ' ' O ' ' A' ' 13' ' ' SER . 52.8 Cg_endo -69.31 53.96 0.97 Allowed 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 122.569 2.179 . . . . 0.0 113.433 -179.168 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -78.94 -150.37 0.05 Allowed 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.339 179.564 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 5' ' ' MET . . . . . . . . . . . . . 14.0 tpt -78.19 52.0 1.06 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.968 0.89 . . . . 0.0 109.743 178.621 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 6' ' ' ARG . . . . . 0.721 ' HG2' HG23 ' A' ' 16' ' ' THR . 26.1 mtt85 -124.11 151.72 43.59 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 114.659 -1.155 . . . . 0.0 108.831 -179.836 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -84.42 131.74 34.64 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.074 0.464 . . . . 0.0 109.77 -179.636 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 8' ' ' LYS . . . . . 0.452 ' HA ' ' O ' ' A' ' 10' ' ' CYS . 1.5 mppt? -78.85 97.71 6.07 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.546 179.622 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 9' ' ' LEU . . . . . 0.869 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 15.1 mt -76.25 52.48 0.75 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.417 -0.81 . . . . 0.0 112.49 -178.517 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 69.4 m -72.72 120.2 18.01 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 178.649 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 61.06 -118.07 13.79 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 121.244 -0.503 . . . . 0.0 113.891 179.599 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 18.1 t-160 -54.07 -31.68 52.47 Favored 'General case' 0 N--CA 1.465 0.306 0 N-CA-C 113.06 0.763 . . . . 0.0 113.06 -178.471 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 13' ' ' HIS . . . . . 0.632 ' CB ' ' HA ' ' B' ' 9' ' ' LEU . 26.8 m170 -61.22 -38.76 87.76 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 120.164 -0.614 . . . . 0.0 111.187 -178.668 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 14' ' ' PHE . . . . . 0.793 ' HA ' HD13 ' B' ' 9' ' ' LEU . 33.0 t80 -61.19 -45.0 96.4 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 178.567 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 56.4 t -62.01 -50.92 78.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 114.972 -1.013 . . . . 0.0 111.753 179.776 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 16' ' ' ARG . . . . . 0.615 ' HG3' ' O ' ' B' ' 13' ' ' HIS . 4.4 ppt_? -61.88 -42.83 99.53 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 112.258 0.466 . . . . 0.0 112.258 -178.414 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -70.33 -45.85 65.35 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 121.01 -0.276 . . . . 0.0 111.406 -179.446 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 18' ' ' LEU . . . . . 1.005 HD22 ' HB2' ' B' ' 27' ' ' TRP . 0.4 OUTLIER -56.63 -54.41 46.41 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.647 -179.869 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 19' ' ' VAL . . . . . 0.521 ' HA ' ' HB3' ' B' ' 27' ' ' TRP . 90.8 t -62.26 -48.25 89.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -178.819 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 24.6 mmm-85 -67.63 -45.06 76.47 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 114.245 1.202 . . . . 0.0 114.245 -178.23 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 99.4 t -76.2 -42.95 37.68 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 N-CA-C 113.01 0.745 . . . . 0.0 113.01 -177.671 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 22' ' ' CYS . . . . . 0.453 ' HB2' ' HA ' ' B' ' 27' ' ' TRP . 99.0 m -81.53 36.94 0.44 Allowed 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 113.347 0.869 . . . . 0.0 113.347 -177.987 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 139.59 -48.0 0.87 Allowed Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.304 -0.95 . . . . 0.0 113.293 178.257 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 24' ' ' GLY . . . . . 0.421 ' O ' HG12 ' B' ' 19' ' ' VAL . . . 125.39 -72.99 0.43 Allowed Glycine 0 N--CA 1.448 -0.516 0 N-CA-C 110.703 -0.959 . . . . 0.0 110.703 -178.763 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -97.41 17.54 0.57 Allowed 'Trans proline' 0 N--CA 1.453 -0.905 0 C-N-CA 123.268 2.645 . . . . 0.0 111.333 178.92 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 17.9 mtp85 -169.27 148.07 3.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.3 -179.284 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 27' ' ' TRP . . . . . 1.005 ' HB2' HD22 ' B' ' 18' ' ' LEU . 0.0 OUTLIER -109.13 59.29 0.6 Allowed 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.533 178.553 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 16.5 m -46.3 91.77 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -178.066 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 7.2 t 178.37 -43.06 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.339 -0.846 . . . . 0.0 108.798 178.842 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -83.78 -38.02 21.84 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.057 179.137 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 31' ' ' ALA . . . . . 0.577 ' HB3' ' CH2' ' B' ' 27' ' ' TRP . . . . . . . . 0 C--O 1.253 1.238 0 CA-C-N 114.614 -1.175 . . . . 0.0 108.906 179.553 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.072 0 N-CA-C 110.104 -0.332 . . . . 0.0 110.104 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -168.16 -151.46 0.11 Allowed 'General case' 0 C--N 1.328 -0.355 0 O-C-N 123.361 0.413 . . . . 0.0 110.156 -179.826 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -148.71 -157.08 0.78 Allowed 'General case' 0 N--CA 1.439 -1.003 0 CA-C-O 121.552 0.691 . . . . 0.0 109.681 179.642 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 5.9 p -74.82 62.36 1.08 Allowed 'General case' 0 C--N 1.3 -1.579 0 CA-C-N 114.258 -1.337 . . . . 0.0 112.134 -179.829 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -165.71 111.83 0.77 Allowed Pre-proline 0 C--N 1.327 -0.397 0 CA-C-O 121.139 0.495 . . . . 0.0 109.883 179.646 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_exo -58.42 -46.57 23.72 Favored 'Trans proline' 0 N--CA 1.469 0.061 0 C-N-CA 123.549 2.833 . . . . 0.0 113.351 -178.914 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -58.8 -42.56 89.4 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.303 0.573 . . . . 0.0 110.296 179.822 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.433 ' HD3' ' HA ' ' A' ' 8' ' ' ARG . 14.4 tpp180 -64.96 -50.06 67.87 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.36 -0.836 . . . . 0.0 109.742 179.026 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 31.8 t80 -55.86 -49.58 72.96 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.573 -1.194 . . . . 0.0 111.214 179.806 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.869 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 56.5 m -68.11 -29.14 68.0 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.0 -0.545 . . . . 0.0 112.398 -179.323 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 44.7 t -79.16 -55.05 5.39 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.369 0.604 . . . . 0.0 110.902 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 11.2 mp -67.14 -47.34 71.36 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.266 -0.879 . . . . 0.0 112.562 -179.024 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.557 ' O ' ' HA ' ' B' ' 3' ' ' PRO . 16.5 m -100.98 -52.67 3.23 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.931 0.396 . . . . 0.0 111.323 -179.223 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.626 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 115.29 161.67 13.23 Favored Glycine 0 N--CA 1.445 -0.754 0 C-N-CA 120.36 -0.924 . . . . 0.0 112.295 -179.898 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.486 ' N ' ' HB3' ' B' ' 6' ' ' ARG . 21.4 p -155.1 153.58 31.07 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.899 0.38 . . . . 0.0 110.206 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.721 HG23 ' HG2' ' B' ' 6' ' ' ARG . 72.0 p -103.08 179.9 4.14 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.319 -179.373 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 5.9 mp0 -58.04 -39.76 79.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.245 179.295 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 10.8 mm100 -63.5 -40.88 98.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.3 179.215 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.439 ' HB2' ' HB2' ' A' ' 15' ' ' CYS . 51.4 m-20 -61.23 -42.79 99.23 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.457 178.934 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.734 HD21 HD11 ' B' ' 9' ' ' LEU . 3.6 mm? -66.11 -45.6 80.56 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.365 178.541 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 25.7 tp -56.84 -42.38 79.54 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.848 -179.619 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 19.7 m -65.65 -21.07 66.53 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.345 0.593 . . . . 0.0 111.327 179.676 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 33.8 tp -86.33 -1.28 57.38 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.946 179.852 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.404 ' HA ' ' HD3' ' A' ' 25' ' ' PRO . 74.3 m -128.95 139.4 35.57 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-O 120.947 0.403 . . . . 0.0 111.451 -179.582 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 24' ' ' CYS . 15.0 Cg_exo -67.88 127.06 15.5 Favored 'Trans proline' 0 N--CA 1.459 -0.513 0 C-N-CA 122.857 2.372 . . . . 0.0 111.78 179.873 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 22.4 t80 . . . . . 0 C--O 1.248 1.018 0 CA-C-N 115.433 -0.803 . . . . 0.0 108.92 -179.968 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 1' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo . . . . . 0 N--CA 1.484 0.953 0 N-CA-C 110.709 -0.535 . . . . 0.0 110.709 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 2' ' ' THR . . . . . 0.556 ' HB ' ' HD2' ' B' ' 3' ' ' PRO . 0.4 OUTLIER -161.07 173.75 4.47 Favored Pre-proline 0 C--N 1.317 -0.841 0 CA-C-N 114.828 -1.078 . . . . 0.0 108.521 -178.799 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 3' ' ' PRO . . . . . 0.556 ' HD2' ' HB ' ' B' ' 2' ' ' THR . 61.5 Cg_endo -71.84 50.43 1.41 Allowed 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 122.546 2.164 . . . . 0.0 111.263 178.808 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 4' ' ' GLU . . . . . 0.666 ' HG3' HG21 ' A' ' 16' ' ' THR . 3.1 pt-20 -71.87 135.88 46.74 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 114.208 -1.36 . . . . 0.0 111.448 -178.87 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 5' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.1 130.7 42.18 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.853 -179.569 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 6' ' ' ARG . . . . . 0.437 ' HA ' HG22 ' A' ' 16' ' ' THR . 44.8 mtp85 -73.49 129.92 39.01 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.439 -179.823 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 7' ' ' GLU . . . . . 0.555 ' HG3' HD23 ' B' ' 9' ' ' LEU . 11.8 tp10 -93.54 135.17 35.07 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-O 121.46 0.648 . . . . 0.0 110.309 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 8' ' ' LYS . . . . . 0.439 ' HD3' ' N ' ' B' ' 8' ' ' LYS . 0.7 OUTLIER -82.87 95.33 7.91 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 179.876 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 9' ' ' LEU . . . . . 0.787 HD13 ' HA ' ' B' ' 14' ' ' PHE . 18.8 mt -77.45 54.47 1.16 Allowed 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 -177.561 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 10' ' ' CYS . . . . . 0.413 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 74.4 m -72.51 121.06 19.02 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.039 178.307 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 57.97 -120.21 20.57 Favored Glycine 0 CA--C 1.52 0.392 0 C-N-CA 121.34 -0.457 . . . . 0.0 113.892 179.323 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -52.77 -30.71 34.42 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -178.988 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 13' ' ' HIS . . . . . 0.628 ' HA ' ' HG2' ' B' ' 16' ' ' ARG . 46.9 m170 -58.46 -41.84 86.08 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 120.438 -0.505 . . . . 0.0 110.682 -179.456 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 14' ' ' PHE . . . . . 0.787 ' HA ' HD13 ' B' ' 9' ' ' LEU . 34.3 t80 -60.88 -44.39 97.14 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.217 0.532 . . . . 0.0 109.753 178.766 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 46.9 t -61.15 -50.59 79.87 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.254 -0.885 . . . . 0.0 111.751 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 16' ' ' ARG . . . . . 0.628 ' HG2' ' HA ' ' B' ' 13' ' ' HIS . 18.5 ptt180 -62.05 -45.31 94.1 Favored 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -178.723 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 17' ' ' ALA . . . . . 0.537 ' N ' ' HG3' ' B' ' 16' ' ' ARG . . . -67.53 -43.43 80.8 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 111.76 0.281 . . . . 0.0 111.76 -179.216 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 18' ' ' LEU . . . . . 0.571 ' O ' ' HB2' ' B' ' 22' ' ' CYS . 3.7 tt -60.61 -55.38 34.04 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 110.118 -0.327 . . . . 0.0 110.118 -179.799 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 19' ' ' VAL . . . . . 0.469 ' HA ' ' NE1' ' B' ' 27' ' ' TRP . 83.5 t -57.28 -41.43 78.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.166 -0.47 . . . . 0.0 112.217 -179.605 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 20' ' ' ARG . . . . . 0.593 ' NE ' ' HA ' ' B' ' 20' ' ' ARG . 4.0 tpm_? -78.95 -60.87 2.21 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 113.32 0.859 . . . . 0.0 113.32 -178.517 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 63.0 t -65.44 -45.68 92.22 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.85 0 N-CA-C 114.004 1.113 . . . . 0.0 114.004 -176.489 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 22' ' ' CYS . . . . . 0.624 ' HB3' ' HB3' ' B' ' 27' ' ' TRP . 73.0 m -67.9 -25.63 65.59 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -178.271 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 23' ' ' GLY . . . . . 0.431 ' N ' ' HD1' ' B' ' 27' ' ' TRP . . . 165.46 -109.72 0.37 Allowed Glycine 0 N--CA 1.445 -0.751 0 C-N-CA 119.66 -1.257 . . . . 0.0 113.015 -179.673 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 174.47 -66.6 0.1 Allowed Glycine 0 N--CA 1.446 -0.655 0 N-CA-C 111.472 -0.651 . . . . 0.0 111.472 -179.931 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -72.68 -27.51 15.05 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.478 2.119 . . . . 0.0 112.36 179.626 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 26' ' ' ARG . . . . . 0.705 ' HB2' ' NH1' ' B' ' 26' ' ' ARG . 0.1 OUTLIER -167.49 151.48 6.54 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 116.123 -0.49 . . . . 0.0 109.935 -179.59 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 27' ' ' TRP . . . . . 0.657 ' CZ3' ' HB2' ' B' ' 30' ' ' GLU . 0.0 OUTLIER -156.91 -88.43 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.742 179.727 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 21.1 m -166.07 62.2 0.1 Allowed 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 112.978 0.733 . . . . 0.0 112.978 -179.824 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 29' ' ' THR . . . . . 0.678 HG23 ' H ' ' B' ' 30' ' ' GLU . 7.5 t -173.09 -68.06 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.332 0 O-C-N 122.348 -0.22 . . . . 0.0 110.658 177.771 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 30' ' ' GLU . . . . . 0.678 ' H ' HG23 ' B' ' 29' ' ' THR . 20.2 mm-40 -84.72 -26.75 27.46 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.555 -0.906 . . . . 0.0 108.555 178.492 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.23 0 CA-C-N 114.124 -1.398 . . . . 0.0 108.459 179.835 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.15 0 N-CA-C 110.217 -0.29 . . . . 0.0 110.217 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -69.51 142.29 53.73 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.716 -0.22 . . . . 0.0 110.586 179.544 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.409 ' HB1' ' HD2' ' A' ' 8' ' ' ARG . . . -168.8 119.14 0.73 Allowed 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.402 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.6 m -75.46 59.53 1.1 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.596 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 15.3 t-20 -175.5 119.42 0.32 Allowed Pre-proline 0 C--N 1.326 -0.439 0 N-CA-C 108.531 -0.915 . . . . 0.0 108.531 -179.108 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -54.47 -47.86 24.55 Favored 'Trans proline' 0 N--CA 1.472 0.216 0 C-N-CA 123.365 2.71 . . . . 0.0 114.091 -178.146 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.86 -43.25 98.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.4 0.619 . . . . 0.0 110.169 179.79 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.409 ' HD2' ' HB1' ' A' ' 3' ' ' ALA . 26.1 ttm180 -66.28 -49.07 68.34 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.258 -0.883 . . . . 0.0 109.885 179.212 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 16.2 t80 -54.93 -50.76 68.05 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 114.452 -1.249 . . . . 0.0 111.33 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.656 ' SG ' ' HG ' ' B' ' 9' ' ' LEU . 35.5 t -73.01 -12.67 61.01 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.798 0.332 . . . . 0.0 111.713 -179.15 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.413 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 16.0 t -83.99 -53.55 5.48 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 121.723 0.773 . . . . 0.0 109.075 178.36 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.9 mp -69.81 -45.21 68.41 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.376 -1.283 . . . . 0.0 112.67 -179.73 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 8.3 m -98.36 -34.78 10.54 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 112.174 0.435 . . . . 0.0 112.174 -178.218 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.604 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 87.76 150.52 19.73 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.642 -0.79 . . . . 0.0 112.105 -179.026 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.62 ' HB2' ' CB ' ' A' ' 19' ' ' ASP . 32.1 p -148.28 148.73 30.77 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.845 0.355 . . . . 0.0 110.152 -179.216 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.666 HG21 ' HG3' ' B' ' 4' ' ' GLU . 65.1 p -94.13 -176.63 4.05 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.95 0.405 . . . . 0.0 111.448 -178.545 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.453 ' H ' ' CD ' ' A' ' 17' ' ' GLN . 2.0 pm0 -60.78 -40.2 91.71 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 115.956 -0.566 . . . . 0.0 109.785 178.321 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 37.2 tt0 -60.29 -45.04 94.72 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.25 -0.886 . . . . 0.0 109.531 178.498 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.62 ' CB ' ' HB2' ' A' ' 15' ' ' CYS . 12.3 m-20 -56.26 -45.84 79.9 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 114.997 -1.001 . . . . 0.0 109.762 178.897 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.638 HD21 HD11 ' B' ' 9' ' ' LEU . 3.2 mm? -63.96 -44.7 91.99 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.543 178.491 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 32.0 tp -56.7 -45.85 81.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.413 -179.284 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.0 p -66.19 -10.75 44.47 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -179.835 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.411 HD13 ' HA ' ' A' ' 23' ' ' LEU . 4.0 mm? -109.39 12.42 24.66 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.601 -0.272 . . . . 0.0 111.26 179.57 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.409 ' HA ' ' HD3' ' A' ' 25' ' ' PRO . 96.1 m -141.39 133.65 13.93 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.192 0.52 . . . . 0.0 111.491 179.709 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 24' ' ' CYS . 96.3 Cg_endo -97.63 -158.84 0.04 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.987 0 C-N-CA 123.887 3.058 . . . . 0.0 112.277 179.843 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 23.4 t80 . . . . . 0 C--O 1.249 1.039 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.207 178.623 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 1' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_exo . . . . . 0 N--CA 1.478 0.566 0 N-CA-C 111.221 -0.338 . . . . 0.0 111.221 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 32.4 p -130.15 137.16 30.26 Favored Pre-proline 0 C--N 1.327 -0.394 0 CA-C-O 120.914 0.388 . . . . 0.0 111.621 -179.862 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -80.33 107.21 1.99 Allowed 'Trans proline' 0 N--CA 1.458 -0.61 0 C-N-CA 122.643 2.229 . . . . 0.0 111.515 179.451 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 4' ' ' GLU . . . . . 0.602 ' CG ' HG21 ' A' ' 16' ' ' THR . 11.4 pt-20 -167.62 -157.27 0.22 Allowed 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 -179.079 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 5' ' ' MET . . . . . 0.468 ' O ' ' HB ' ' A' ' 16' ' ' THR . 26.3 ptt? -71.4 129.8 39.71 Favored 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 177.922 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 58.7 mtp85 -131.95 141.89 49.46 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.712 -178.329 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -131.29 148.91 52.73 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.533 -0.544 . . . . 0.0 109.533 179.208 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 8' ' ' LYS . . . . . 0.476 ' NZ ' ' HB2' ' B' ' 8' ' ' LYS . 4.8 mtmp? -73.17 96.29 2.21 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.293 179.943 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 9' ' ' LEU . . . . . 0.684 ' HB2' ' SG ' ' A' ' 10' ' ' CYS . 96.6 mt -88.01 58.9 5.05 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.4 0.619 . . . . 0.0 111.307 -179.723 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 10' ' ' CYS . . . . . 0.453 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 99.5 m -64.45 136.86 57.5 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.611 -0.722 . . . . 0.0 112.001 179.827 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 57.42 -125.05 37.96 Favored Glycine 0 CA--C 1.518 0.266 0 CA-C-N 115.644 -0.707 . . . . 0.0 114.809 177.96 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 15.4 t-160 -50.69 -31.45 16.46 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 123.325 0.65 . . . . 0.0 112.736 -178.228 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 13' ' ' HIS . . . . . 0.419 ' HB3' ' CD2' ' B' ' 9' ' ' LEU . 22.6 m170 -59.51 -43.68 93.31 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 121.216 -0.194 . . . . 0.0 111.134 -179.42 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 14' ' ' PHE . . . . . . . . . . . . . 34.6 t80 -64.05 -42.3 97.09 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.168 0.509 . . . . 0.0 109.86 178.927 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 15' ' ' VAL . . . . . 0.651 ' O ' HG23 ' B' ' 19' ' ' VAL . 39.3 t -58.84 -56.67 15.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.379 -179.935 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 16' ' ' ARG . . . . . 0.533 ' HD3' ' N ' ' B' ' 17' ' ' ALA . 0.0 OUTLIER -61.07 -35.06 75.95 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-O 120.754 0.311 . . . . 0.0 110.971 -179.676 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 17' ' ' ALA . . . . . 0.533 ' N ' ' HD3' ' B' ' 16' ' ' ARG . . . -64.15 -46.76 82.61 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.48 179.109 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 21.2 mt -60.51 -45.92 92.03 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.433 179.452 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 19' ' ' VAL . . . . . 0.884 HG22 ' HE1' ' B' ' 27' ' ' TRP . 14.7 t -60.62 -39.55 81.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-O 120.939 0.4 . . . . 0.0 110.8 -179.737 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 31.4 tpt85 -74.27 -57.67 3.8 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.286 0.565 . . . . 0.0 112.081 -179.657 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 21' ' ' VAL . . . . . 0.672 HG22 ' HG3' ' A' ' 17' ' ' GLN . 65.2 t -65.9 -57.36 10.95 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.892 0 CA-C-N 114.706 -1.134 . . . . 0.0 113.502 -177.019 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 56.8 m -101.52 37.95 1.7 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.883 0.373 . . . . 0.0 111.527 -178.219 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -78.46 124.18 6.57 Favored Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.315 179.522 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 154.21 -150.16 21.71 Favored Glycine 0 N--CA 1.445 -0.726 0 C-N-CA 120.827 -0.701 . . . . 0.0 111.971 179.836 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_exo -64.15 -27.92 64.96 Favored 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 123.022 2.481 . . . . 0.0 112.377 179.793 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 26' ' ' ARG . . . . . 0.417 ' O ' HG22 ' B' ' 29' ' ' THR . 32.1 mmt180 -80.23 -11.87 59.69 Favored 'General case' 0 CA--C 1.51 -0.572 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.667 -179.632 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 27' ' ' TRP . . . . . 0.884 ' HE1' HG22 ' B' ' 19' ' ' VAL . 0.0 OUTLIER -81.05 58.52 3.49 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 122.424 1.106 . . . . 0.0 110.89 -179.407 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 22.5 m -157.19 53.81 0.5 Allowed 'General case' 0 C--N 1.306 -1.288 0 CA-C-N 113.298 -1.774 . . . . 0.0 107.533 178.777 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 29' ' ' THR . . . . . 0.534 HG23 ' H ' ' B' ' 30' ' ' GLU . 1.7 t -139.43 -55.48 0.58 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.602 -1.181 . . . . 0.0 110.717 -177.945 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 30' ' ' GLU . . . . . 0.651 ' HB2' ' CZ3' ' B' ' 27' ' ' TRP . 22.2 mm-40 -77.11 -28.33 54.35 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.664 179.699 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.876 0 CA-C-N 114.651 -1.159 . . . . 0.0 108.029 179.665 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.051 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -71.96 137.83 47.61 Favored 'General case' 0 C--N 1.327 -0.4 0 O-C-N 123.338 0.399 . . . . 0.0 110.558 179.959 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -81.1 56.35 2.79 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.131 0.491 . . . . 0.0 111.138 -179.797 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 2.1 m -78.01 54.65 1.34 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.7 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -169.42 112.3 0.5 Allowed Pre-proline 0 C--N 1.324 -0.528 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 -179.539 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -57.66 -47.02 23.17 Favored 'Trans proline' 0 C--O 1.235 0.338 0 C-N-CA 123.291 2.661 . . . . 0.0 113.446 -178.708 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.31 -46.35 90.19 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.202 0.525 . . . . 0.0 110.64 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.442 ' HD3' ' HA ' ' A' ' 8' ' ' ARG . 3.6 mmt180 -68.8 -39.35 80.16 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.121 179.484 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 31.3 t80 -57.93 -53.43 58.34 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.081 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.684 ' SG ' ' HB2' ' B' ' 9' ' ' LEU . 49.0 t -69.46 -18.35 63.71 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.018 0.437 . . . . 0.0 111.487 -179.64 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.453 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 16.2 t -81.09 -53.02 6.76 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.474 0.654 . . . . 0.0 110.47 179.401 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 94.2 mt -75.37 -57.88 3.62 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.044 -0.98 . . . . 0.0 112.51 -179.131 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 14.2 m -81.98 -29.4 32.15 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.823 0.344 . . . . 0.0 111.72 -178.783 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.58 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 86.13 147.66 10.71 Favored Glycine 0 N--CA 1.447 -0.59 0 C-N-CA 120.533 -0.841 . . . . 0.0 111.648 -178.914 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 18.1 p -139.84 -160.03 1.02 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.885 0.342 . . . . 0.0 110.529 -179.885 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.615 ' CG2' ' HB2' ' A' ' 19' ' ' ASP . 2.8 t -160.19 -178.65 7.12 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 -179.086 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.672 ' HG3' HG22 ' B' ' 21' ' ' VAL . 38.1 tt0 -62.7 -54.5 38.33 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -179.341 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -63.11 -34.17 77.02 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 179.985 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.615 ' HB2' ' CG2' ' A' ' 16' ' ' THR . 13.7 t70 -61.95 -45.77 92.2 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.949 179.076 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 53.2 mt -69.15 -42.72 75.57 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.523 179.498 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 32.4 tp -55.84 -52.48 63.88 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.349 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 16.1 p -65.37 -11.5 42.86 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.971 179.364 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 48.8 tp -93.6 -26.8 16.94 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.188 -0.46 . . . . 0.0 109.965 179.108 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.439 ' HA ' ' HD3' ' A' ' 25' ' ' PRO . 80.5 m -85.15 136.79 37.75 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.874 -179.868 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 24' ' ' CYS . 16.5 Cg_exo -67.08 119.87 6.92 Favored 'Trans proline' 0 N--CA 1.457 -0.632 0 C-N-CA 122.592 2.195 . . . . 0.0 110.62 179.21 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 25.4 m-85 . . . . . 0 C--O 1.248 0.985 0 CA-C-O 118.654 -0.689 . . . . 0.0 110.53 -179.135 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 1' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo . . . . . 0 N--CA 1.478 0.568 0 N-CA-C 110.722 -0.53 . . . . 0.0 110.722 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 2' ' ' THR . . . . . 0.605 HG23 ' HD2' ' B' ' 3' ' ' PRO . 22.4 m -163.51 144.15 7.04 Favored Pre-proline 0 C--N 1.326 -0.426 0 N-CA-C 109.457 -0.572 . . . . 0.0 109.457 -178.904 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 3' ' ' PRO . . . . . 0.605 ' HD2' HG23 ' B' ' 2' ' ' THR . 80.1 Cg_exo -45.8 145.1 4.98 Favored 'Trans proline' 0 C--N 1.359 1.091 0 C-N-CA 122.809 2.34 . . . . 0.0 111.411 179.528 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -47.31 115.2 1.04 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 122.323 1.059 . . . . 0.0 113.151 -177.129 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 5' ' ' MET . . . . . . . . . . . . . 39.3 ttp 177.25 47.48 0.0 OUTLIER 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 112.658 -2.064 . . . . 0.0 107.149 179.264 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.48 155.71 19.76 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 114.853 -1.067 . . . . 0.0 112.276 -177.372 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -147.89 151.86 36.6 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.308 -0.86 . . . . 0.0 109.152 178.226 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 8' ' ' LYS . . . . . 0.43 ' HE2' ' HB2' ' B' ' 8' ' ' LYS . 25.3 mtmm -67.91 97.44 0.66 Allowed 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.957 -178.981 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 9' ' ' LEU . . . . . 0.639 ' HB2' ' SG ' ' A' ' 10' ' ' CYS . 84.1 mt -88.9 53.24 2.63 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.275 0.559 . . . . 0.0 110.752 179.581 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 10' ' ' CYS . . . . . 0.405 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 96.6 m -60.18 138.72 57.86 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.788 -179.931 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 66.95 -133.88 31.73 Favored Glycine 0 N--CA 1.451 -0.327 0 CA-C-N 115.668 -0.696 . . . . 0.0 114.824 178.334 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 17.5 t-160 -52.47 -29.25 23.85 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 -178.077 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 13' ' ' HIS . . . . . 0.591 ' HB3' HD22 ' B' ' 9' ' ' LEU . 22.7 m170 -58.6 -46.11 87.71 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.471 0.177 . . . . 0.0 111.286 -179.147 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 14' ' ' PHE . . . . . 0.581 ' CZ ' ' HB2' ' A' ' 6' ' ' PRO . 54.0 t80 -63.22 -45.19 92.82 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 178.509 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 40.6 t -54.2 -54.56 20.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.473 -179.608 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 16' ' ' ARG . . . . . 0.58 ' HG3' ' O ' ' B' ' 13' ' ' HIS . 0.0 OUTLIER -61.75 -42.74 99.36 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.852 -0.339 . . . . 0.0 111.598 -179.481 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 17' ' ' ALA . . . . . 0.509 ' N ' ' HE ' ' B' ' 16' ' ' ARG . . . -63.68 -52.39 60.88 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 -179.953 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 18' ' ' LEU . . . . . 0.503 HD22 ' CZ ' ' B' ' 14' ' ' PHE . 16.2 tp -64.57 -53.84 41.59 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.264 -179.044 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 19' ' ' VAL . . . . . 0.634 ' HA ' ' NE1' ' B' ' 27' ' ' TRP . 83.1 t -58.31 -40.31 77.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -178.295 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 20' ' ' ARG . . . . . 0.999 ' HE ' ' HA ' ' B' ' 20' ' ' ARG . 1.0 OUTLIER -82.29 -46.53 13.53 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 114.183 1.179 . . . . 0.0 114.183 -178.658 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 21' ' ' VAL . . . . . 0.489 HG21 ' HB3' ' A' ' 17' ' ' GLN . 72.8 t -73.83 -45.49 49.53 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 N-CA-C 113.447 0.906 . . . . 0.0 113.447 -177.778 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 22' ' ' CYS . . . . . 0.807 ' HB3' ' HB3' ' B' ' 27' ' ' TRP . 63.6 m -73.22 -33.23 65.23 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 -178.4 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 170.34 -101.95 0.17 Allowed Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 119.365 -1.398 . . . . 0.0 113.432 -179.202 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 170.68 -71.55 0.12 Allowed Glycine 0 N--CA 1.449 -0.471 0 N-CA-C 111.802 -0.519 . . . . 0.0 111.802 -179.743 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -69.41 -31.09 22.8 Favored 'Trans proline' 0 C--N 1.348 0.527 0 C-N-CA 122.531 2.154 . . . . 0.0 112.288 179.627 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 26' ' ' ARG . . . . . 0.583 ' HB2' ' OXT' ' B' ' 31' ' ' ALA . 0.0 OUTLIER -166.01 154.01 10.64 Favored 'General case' 0 CA--C 1.512 -0.496 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 179.559 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 27' ' ' TRP . . . . . 0.807 ' HB3' ' HB3' ' B' ' 22' ' ' CYS . 0.0 OUTLIER -140.26 -78.38 0.3 Allowed 'General case' 0 C--N 1.314 -0.976 0 O-C-N 123.357 0.411 . . . . 0.0 110.332 -179.215 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 28' ' ' SER . . . . . 0.492 ' HB2' ' HD3' ' A' ' 25' ' ' PRO . 5.6 t -178.68 49.03 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -179.805 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 29' ' ' THR . . . . . 0.803 HG23 ' H ' ' B' ' 30' ' ' GLU . 2.9 t -172.92 -79.18 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 121.184 -0.206 . . . . 0.0 110.761 178.949 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 30' ' ' GLU . . . . . 0.803 ' H ' HG23 ' B' ' 29' ' ' THR . 0.6 OUTLIER -67.29 -26.9 66.77 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 178.045 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 31' ' ' ALA . . . . . 0.583 ' OXT' ' HB2' ' B' ' 26' ' ' ARG . . . . . . . . 0 C--O 1.258 1.512 0 CA-C-N 114.099 -1.409 . . . . 0.0 107.747 179.069 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.016 0 N-CA-C 110.084 -0.339 . . . . 0.0 110.084 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.533 ' H ' HD22 ' A' ' 23' ' ' LEU . . . -81.19 66.3 6.67 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.826 0.346 . . . . 0.0 110.569 179.815 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -168.74 134.6 1.74 Allowed 'General case' 0 N--CA 1.442 -0.83 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 -179.602 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 4.8 p -54.2 -35.37 62.3 Favored 'General case' 0 C--N 1.318 -0.773 0 O-C-N 123.836 0.71 . . . . 0.0 111.495 -179.715 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -156.38 99.25 2.11 Favored Pre-proline 0 C--N 1.318 -0.786 0 CA-C-N 115.393 -0.821 . . . . 0.0 109.365 178.554 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.581 ' HB2' ' CZ ' ' B' ' 14' ' ' PHE . 24.0 Cg_exo -60.35 -39.45 66.93 Favored 'Trans proline' 0 C--N 1.331 -0.388 0 C-N-CA 123.826 3.017 . . . . 0.0 112.853 -178.708 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.94 -47.12 83.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.212 0.529 . . . . 0.0 110.527 179.885 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.409 ' HA ' ' HD2' ' A' ' 8' ' ' ARG . 14.0 tpt85 -66.73 -48.07 70.33 Favored 'General case' 0 CA--C 1.511 -0.532 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.698 179.222 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 10.5 t80 -52.23 -57.07 10.8 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 114.33 -1.305 . . . . 0.0 112.0 -179.518 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.65 ' O ' ' HA2' ' A' ' 14' ' ' GLY . 18.1 t -66.25 -19.83 65.94 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -178.535 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.405 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 14.4 t -84.89 -53.08 5.55 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.641 0.734 . . . . 0.0 110.427 179.453 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 15.0 tp -72.28 -62.52 1.41 Allowed 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 114.89 -1.05 . . . . 0.0 111.923 -179.138 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 14.7 m -79.86 -28.25 40.02 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.339 -178.829 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.65 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 85.7 152.52 19.28 Favored Glycine 0 N--CA 1.445 -0.714 0 C-N-CA 120.669 -0.777 . . . . 0.0 111.84 -179.267 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 9.1 p -151.57 -163.05 1.66 Allowed 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 179.451 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.612 HG22 ' HB2' ' A' ' 19' ' ' ASP . 13.4 t -153.33 168.52 25.78 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 108.37 -0.974 . . . . 0.0 108.37 179.493 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.49 ' NE2' ' H ' ' A' ' 17' ' ' GLN . 0.0 OUTLIER -55.25 -48.27 74.21 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.616 0.246 . . . . 0.0 111.39 -178.858 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.58 ' HB2' HG21 ' B' ' 2' ' ' THR . 8.7 mp0 -62.78 -38.07 89.15 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.475 179.712 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.612 ' HB2' HG22 ' A' ' 16' ' ' THR . 30.3 t70 -61.5 -44.03 97.8 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.782 179.371 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 67.9 mt -68.1 -39.91 82.72 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.258 178.687 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 49.9 tp -57.93 -43.55 86.35 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.704 179.469 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 36.3 p -69.61 0.77 4.9 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 120.964 0.411 . . . . 0.0 111.865 179.762 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.533 HD22 ' H ' ' A' ' 2' ' ' ALA . 89.1 mt -117.01 9.92 13.82 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.007 179.241 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 75.4 m -134.18 143.19 46.06 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.331 -179.221 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.492 ' HD3' ' HB2' ' B' ' 28' ' ' SER . 66.4 Cg_endo -90.35 -157.95 0.07 OUTLIER 'Trans proline' 0 N--CA 1.45 -1.075 0 C-N-CA 123.293 2.662 . . . . 0.0 111.312 178.724 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 12.6 t80 . . . . . 0 C--O 1.251 1.138 0 CA-C-O 118.851 -0.595 . . . . 0.0 109.999 179.277 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 1' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo . . . . . 0 CA--C 1.512 -0.588 0 N-CA-C 110.159 -0.747 . . . . 0.0 110.159 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 6.0 m -62.5 123.64 79.7 Favored Pre-proline 0 C--N 1.318 -0.769 0 O-C-N 123.719 0.637 . . . . 0.0 109.944 179.529 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -68.77 144.94 61.27 Favored 'Trans proline' 0 C--O 1.234 0.322 0 C-N-CA 122.71 2.273 . . . . 0.0 112.666 -179.155 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 4' ' ' GLU . . . . . 0.56 ' OE1' ' HB ' ' A' ' 16' ' ' THR . 1.6 mp0 -76.26 -149.03 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.502 0.668 . . . . 0.0 109.995 179.673 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 5' ' ' MET . . . . . . . . . . . . . 24.9 ptt? -82.62 121.36 26.73 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 178.186 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 6' ' ' ARG . . . . . 0.633 ' HG2' HG23 ' A' ' 16' ' ' THR . 49.6 mtt180 -72.61 123.96 24.29 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.762 0.315 . . . . 0.0 111.172 -179.158 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 7' ' ' GLU . . . . . 0.4 ' HG2' ' N ' ' B' ' 8' ' ' LYS . 22.3 tt0 -100.05 151.28 21.55 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 179.124 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 8' ' ' LYS . . . . . 0.444 ' HA ' ' O ' ' A' ' 10' ' ' CYS . 55.2 mttm -86.8 95.52 9.87 Favored 'General case' 0 C--N 1.312 -1.065 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 178.447 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 9' ' ' LEU . . . . . 0.739 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 2.8 mm? -76.65 57.08 1.21 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.81 -0.632 . . . . 0.0 112.249 -178.472 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 10' ' ' CYS . . . . . 0.442 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 93.7 m -74.26 124.91 27.3 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.158 179.313 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 52.25 -115.04 3.77 Favored Glycine 0 CA--C 1.519 0.304 0 CA-C-N 115.897 -0.592 . . . . 0.0 114.326 178.617 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 12' ' ' HIS . . . . . 0.424 ' O ' ' HG3' ' B' ' 16' ' ' ARG . 15.6 t-160 -51.29 -31.69 22.27 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 123.131 0.573 . . . . 0.0 112.396 -178.97 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 13' ' ' HIS . . . . . 0.672 ' HB3' ' HA ' ' B' ' 9' ' ' LEU . 27.0 m170 -62.39 -42.82 99.72 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 120.695 -0.402 . . . . 0.0 110.589 -179.67 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 14' ' ' PHE . . . . . . . . . . . . . 19.3 t80 -60.49 -38.85 85.61 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 178.996 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 15' ' ' VAL . . . . . 0.417 ' O ' HG23 ' B' ' 19' ' ' VAL . 65.1 t -60.97 -57.5 11.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.386 -0.825 . . . . 0.0 111.4 179.497 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 16' ' ' ARG . . . . . 0.492 ' HD3' ' N ' ' B' ' 17' ' ' ALA . 0.0 OUTLIER -63.85 -28.54 69.92 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 120.964 -0.295 . . . . 0.0 111.322 179.93 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 17' ' ' ALA . . . . . 0.698 ' HB1' HD13 ' A' ' 20' ' ' LEU . . . -63.75 -53.08 56.65 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.29 179.188 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 100.0 mt -60.77 -46.79 89.09 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.732 179.285 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 19' ' ' VAL . . . . . 0.645 HG12 ' HE ' ' B' ' 20' ' ' ARG . 71.8 t -58.43 -38.51 70.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.621 -0.718 . . . . 0.0 112.825 -179.35 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 20' ' ' ARG . . . . . 0.645 ' HE ' HG12 ' B' ' 19' ' ' VAL . 0.0 OUTLIER -93.27 -43.75 8.65 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 -178.171 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 94.7 t -70.7 -40.82 77.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -178.75 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 52.5 m -116.6 47.26 1.47 Allowed 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 120.907 -0.317 . . . . 0.0 111.538 -179.126 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 23' ' ' GLY . . . . . 0.87 ' HA2' ' HB2' ' B' ' 28' ' ' SER . . . -168.38 139.47 5.68 Favored Glycine 0 N--CA 1.443 -0.875 0 C-N-CA 119.268 -1.444 . . . . 0.0 114.006 -179.9 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -84.14 -77.62 1.14 Allowed Glycine 0 N--CA 1.447 -0.57 0 N-CA-C 110.713 -0.955 . . . . 0.0 110.713 178.454 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 25' ' ' PRO . . . . . 0.481 ' HD2' ' OG ' ' B' ' 28' ' ' SER . 39.2 Cg_endo -68.6 -45.74 2.24 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.35 2.033 . . . . 0.0 110.928 178.57 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 26' ' ' ARG . . . . . 0.515 ' NH2' ' HB2' ' B' ' 31' ' ' ALA . 25.1 mtm105 -150.58 -128.55 0.04 OUTLIER 'General case' 0 CA--C 1.506 -0.719 0 CA-C-O 121.57 0.7 . . . . 0.0 110.364 178.582 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 27' ' ' TRP . . . . . 0.658 ' HA ' ' HE3' ' B' ' 27' ' ' TRP . 0.0 OUTLIER -82.83 62.07 6.22 Favored 'General case' 0 N--CA 1.422 -1.872 0 CA-C-N 114.254 -1.339 . . . . 0.0 109.645 -179.758 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 28' ' ' SER . . . . . 0.87 ' HB2' ' HA2' ' B' ' 23' ' ' GLY . 69.4 m -53.37 81.57 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.014 0 CA-C-O 122.244 1.021 . . . . 0.0 113.282 -179.712 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 28.3 m 177.31 -42.28 0.01 OUTLIER 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 102.97 -2.974 . . . . 0.0 102.97 179.806 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 30' ' ' GLU . . . . . 0.491 ' OE1' ' HB3' ' B' ' 27' ' ' TRP . 3.6 tm-20 -98.71 -31.61 11.82 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 111.009 -2.814 . . . . 0.0 106.329 176.154 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 31' ' ' ALA . . . . . 0.579 ' O ' ' HA ' ' B' ' 28' ' ' SER . . . . . . . . 0 C--O 1.245 0.837 0 CA-C-N 113.142 -1.845 . . . . 0.0 109.459 179.551 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.147 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -69.22 144.24 53.76 Favored 'General case' 0 C--N 1.329 -0.291 0 O-C-N 123.085 0.24 . . . . 0.0 110.527 179.35 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -165.15 119.56 1.28 Allowed 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 116.312 -0.404 . . . . 0.0 109.999 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 3.9 p -77.73 52.86 1.05 Allowed 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.445 -179.895 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.463 ' HB3' ' HB2' ' A' ' 8' ' ' ARG . 29.6 t-20 -171.49 113.2 0.41 Allowed Pre-proline 0 C--N 1.327 -0.411 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 -179.716 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.565 ' HB3' HD13 ' A' ' 23' ' ' LEU . 27.8 Cg_exo -59.36 -48.06 14.85 Favored 'Trans proline' 0 C--N 1.335 -0.146 0 C-N-CA 123.209 2.606 . . . . 0.0 113.487 -178.637 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -58.73 -44.86 90.57 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.402 0.62 . . . . 0.0 110.408 179.781 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.463 ' HB2' ' HB3' ' A' ' 5' ' ' ASN . 12.0 mmt85 -67.47 -45.48 75.81 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.698 178.991 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 26.9 t80 -58.44 -48.73 79.76 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.088 179.784 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.739 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 61.9 m -65.9 -23.42 66.63 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.968 -179.811 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.442 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 37.6 t -88.2 -59.58 2.2 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.433 0.635 . . . . 0.0 110.475 179.531 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 13.0 tp -55.3 -54.2 46.5 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.848 -1.069 . . . . 0.0 111.083 -179.629 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 14.3 m -96.48 -59.52 1.81 Allowed 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.977 -179.913 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.696 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 121.48 156.14 9.67 Favored Glycine 0 N--CA 1.452 -0.29 0 N-CA-C 110.82 -0.912 . . . . 0.0 110.82 -179.692 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.683 ' SG ' HD23 ' B' ' 9' ' ' LEU . 31.3 p -150.56 155.75 40.05 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 117.546 0.673 . . . . 0.0 111.574 -178.985 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.633 HG23 ' HG2' ' B' ' 6' ' ' ARG . 72.8 p -91.01 -173.28 3.61 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.017 -179.495 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 88.9 mt-30 -69.14 -40.13 78.43 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 177.979 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 62.6 mt-30 -65.79 -39.55 91.07 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.535 178.674 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.589 ' CB ' ' HB2' ' A' ' 15' ' ' CYS . 38.5 m-20 -59.51 -47.19 86.48 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 178.212 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.698 HD13 ' HB1' ' B' ' 17' ' ' ALA . 30.6 mt -63.8 -45.99 87.19 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.804 179.026 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -55.04 -45.14 75.19 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.237 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 23.9 m -60.93 -25.04 66.49 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.557 179.658 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.565 HD13 ' HB3' ' A' ' 6' ' ' PRO . 85.2 mt -79.48 -24.64 42.22 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.593 179.301 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.488 ' HA ' ' HD3' ' A' ' 25' ' ' PRO . 56.5 m -85.04 133.74 42.49 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.126 -179.623 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.488 ' HD3' ' HA ' ' A' ' 24' ' ' CYS . 3.0 Cg_exo -73.79 125.17 9.76 Favored 'Trans proline' 0 N--CA 1.457 -0.652 0 C-N-CA 122.852 2.368 . . . . 0.0 111.68 179.572 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 17.8 t80 . . . . . 0 C--O 1.25 1.08 0 CA-C-O 117.521 -1.228 . . . . 0.0 108.899 179.891 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 . . . . . 0 N--CA 1.45 -0.453 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 65.5 mttm -72.97 97.15 2.24 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.643 0.735 . . . . 0.0 109.324 179.261 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . 0.769 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 61.1 mt -79.1 56.22 1.97 Allowed 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 114.85 -1.068 . . . . 0.0 113.295 -177.407 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 10' ' ' CYS . . . . . 0.496 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 88.8 m -74.06 125.09 27.54 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.266 178.42 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 61.05 -126.47 40.65 Favored Glycine 0 N--CA 1.452 -0.296 0 CA-C-N 116.075 -0.511 . . . . 0.0 113.697 179.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 12' ' ' HIS . . . . . 0.597 ' O ' ' HG2' ' B' ' 16' ' ' ARG . 16.0 t-160 -55.01 -25.73 32.22 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -179.117 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 13' ' ' HIS . . . . . 0.603 ' HB3' ' HA ' ' B' ' 9' ' ' LEU . 51.6 m170 -56.12 -42.16 76.43 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.908 -0.317 . . . . 0.0 111.03 -179.255 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 14' ' ' PHE . . . . . 0.583 ' HA ' ' HB3' ' B' ' 9' ' ' LEU . 36.0 t80 -60.18 -45.83 91.79 Favored 'General case' 0 C--N 1.328 -0.34 0 O-C-N 123.43 0.456 . . . . 0.0 110.235 178.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . 0.563 ' O ' HG23 ' B' ' 19' ' ' VAL . 93.1 t -59.12 -56.89 14.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.496 -0.774 . . . . 0.0 112.228 -179.777 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . 0.597 ' HG2' ' O ' ' B' ' 12' ' ' HIS . 1.9 ptm180 -60.0 -38.56 82.97 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 120.736 0.303 . . . . 0.0 111.603 -179.727 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . 0.817 ' HA ' ' HE ' ' B' ' 20' ' ' ARG . . . -66.43 -41.57 88.99 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.823 0.344 . . . . 0.0 110.381 179.31 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 53.0 tp -58.02 -45.44 86.89 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.727 179.056 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 19' ' ' VAL . . . . . 0.563 HG23 ' O ' ' B' ' 15' ' ' VAL . 40.6 t -62.39 -44.77 99.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.609 178.885 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . 0.817 ' HE ' ' HA ' ' B' ' 17' ' ' ALA . 81.5 mtm180 -57.0 -50.18 73.5 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.67 -0.696 . . . . 0.0 112.801 -179.309 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 21' ' ' VAL . . . . . 0.54 HG22 ' HG3' ' A' ' 17' ' ' GLN . 74.2 t -76.84 -53.19 15.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 N-CA-C 113.888 1.07 . . . . 0.0 113.888 -177.131 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 81.9 m . . . . . 0 C--N 1.327 -0.398 0 N-CA-C 111.94 0.348 . . . . 0.0 111.94 -178.103 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo . . . . . 0 CA--C 1.528 0.181 0 N-CA-C 113.473 0.528 . . . . 0.0 113.473 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -59.3 -42.78 92.13 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.309 0.576 . . . . 0.0 110.456 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 5.7 tpt85 -67.89 -45.8 73.43 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.973 179.273 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 32.0 t80 -57.39 -47.46 81.62 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 114.78 -1.1 . . . . 0.0 110.78 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.769 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 89.3 m -65.45 -30.8 71.63 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.139 179.813 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.496 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 26.7 t -75.87 -57.18 4.03 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.583 0.706 . . . . 0.0 110.706 179.63 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 92.8 mt -59.91 -55.93 28.01 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 114.932 -1.031 . . . . 0.0 112.1 -179.3 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.2 m -92.02 -63.65 1.21 Allowed 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.194 -179.373 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.571 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 133.85 158.07 8.48 Favored Glycine 0 N--CA 1.451 -0.345 0 N-CA-C 110.686 -0.966 . . . . 0.0 110.686 -179.521 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 93.2 m -140.33 145.16 36.84 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 117.43 0.615 . . . . 0.0 111.79 -179.449 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 63.5 p -100.89 -168.64 1.59 Allowed 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.544 179.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.54 ' HG3' HG22 ' B' ' 21' ' ' VAL . 49.8 tt0 -69.78 -41.4 75.18 Favored 'General case' 0 CA--C 1.512 -0.487 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 177.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 66.7 tp60 -62.96 -45.92 90.15 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.801 179.197 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 63.1 m-20 -57.04 -46.72 82.2 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.326 -0.852 . . . . 0.0 109.9 179.177 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.534 HD11 ' HB1' ' B' ' 17' ' ' ALA . 54.7 mt -69.11 -39.81 78.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.925 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 30.3 tp -58.42 -39.45 79.8 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.99 0.424 . . . . 0.0 110.539 -179.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.6 m -63.99 -21.38 66.47 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.062 179.408 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -97.69 -4.43 37.31 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.685 179.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 93.1 m . . . . . 0 C--N 1.33 -0.251 0 CA-C-O 121.075 0.465 . . . . 0.0 110.831 -179.991 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 . . . . . 0 N--CA 1.449 -0.5 0 N-CA-C 109.287 -0.635 . . . . 0.0 109.287 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . 0.447 ' HA ' ' O ' ' A' ' 10' ' ' CYS . 65.6 mttm -73.98 94.82 2.4 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 178.818 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . 0.729 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 28.7 mt -76.18 55.33 0.94 Allowed 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 114.794 -1.093 . . . . 0.0 113.93 -176.643 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 10' ' ' CYS . . . . . 0.445 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 75.1 m -74.87 117.69 17.0 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 177.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 61.18 -121.64 27.02 Favored Glycine 0 CA--C 1.521 0.411 0 C-N-CA 121.09 -0.576 . . . . 0.0 113.695 179.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 14.8 t-160 -53.47 -28.67 31.79 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -178.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 13' ' ' HIS . . . . . 0.624 ' CB ' ' HA ' ' B' ' 9' ' ' LEU . 49.6 m170 -58.37 -40.71 83.04 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.766 -0.373 . . . . 0.0 110.707 -179.288 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 14' ' ' PHE . . . . . 0.653 ' HA ' HD13 ' B' ' 9' ' ' LEU . 21.4 t80 -58.55 -45.79 88.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.347 0.594 . . . . 0.0 109.8 178.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . 0.541 ' O ' HG23 ' B' ' 19' ' ' VAL . 94.6 t -63.04 -53.76 42.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.892 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . 0.605 ' O ' ' HG3' ' B' ' 20' ' ' ARG . 0.0 OUTLIER -61.27 -40.35 93.76 Favored 'General case' 0 N--CA 1.462 0.154 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 -179.038 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.41 -41.05 89.85 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 121.027 -0.269 . . . . 0.0 110.436 179.41 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 10.7 mt -56.45 -49.81 73.53 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.342 178.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 19' ' ' VAL . . . . . 0.541 HG23 ' O ' ' B' ' 15' ' ' VAL . 11.5 t -64.95 -38.07 81.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.748 179.691 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . 0.605 ' HG3' ' O ' ' B' ' 16' ' ' ARG . 33.4 mtm105 -62.07 -51.99 65.73 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 49.1 t -73.46 -53.95 16.72 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 -177.295 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 60.3 m . . . . . 0 C--N 1.326 -0.419 0 C-N-CA 121.182 -0.207 . . . . 0.0 110.918 -178.605 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo . . . . . 0 C--O 1.226 -0.116 0 N-CA-C 113.262 0.447 . . . . 0.0 113.262 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -58.07 -40.98 82.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.169 0.509 . . . . 0.0 110.116 179.491 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 43.6 ttt85 -64.61 -54.69 27.93 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.134 178.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 26.7 t80 -56.04 -48.44 75.99 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 114.162 -1.381 . . . . 0.0 111.284 -179.583 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.729 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 91.0 m -64.6 -30.03 71.05 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.551 -179.834 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.445 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 35.5 t -77.83 -57.87 3.57 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.336 0.588 . . . . 0.0 110.641 179.708 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 88.6 mt -57.13 -58.69 7.09 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 114.94 -1.027 . . . . 0.0 111.976 -179.117 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 34.6 t -92.56 -63.21 1.26 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 120.927 0.394 . . . . 0.0 110.672 -179.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.628 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 132.01 155.73 8.1 Favored Glycine 0 N--CA 1.446 -0.691 0 N-CA-C 110.56 -1.016 . . . . 0.0 110.56 -179.454 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 90.8 m -131.85 135.48 46.74 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 117.191 0.495 . . . . 0.0 111.097 -179.186 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 31.4 p -80.6 170.07 16.81 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.054 179.372 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 23.2 mt-30 -66.62 -40.49 88.83 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 178.243 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 77.6 mm-40 -63.16 -43.53 98.05 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 178.593 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -58.82 -43.5 90.63 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.947 178.826 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.683 HD11 HD11 ' B' ' 9' ' ' LEU . 96.9 mt -69.41 -41.75 75.98 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.275 179.464 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 40.8 tp -57.55 -44.04 84.88 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.216 0.531 . . . . 0.0 110.55 -179.727 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.1 m -64.49 -16.63 62.83 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.219 179.615 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 23.8 tp -113.61 16.61 18.64 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.321 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 43.5 m . . . . . 0 C--N 1.332 -0.191 0 C-N-CA 120.208 -0.597 . . . . 0.0 111.015 179.375 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . 0.42 ' HG2' ' N ' ' B' ' 8' ' ' LYS . 26.3 tt0 . . . . . 0 C--O 1.238 0.494 0 CA-C-O 121.037 0.446 . . . . 0.0 111.028 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . 0.42 ' N ' ' HG2' ' B' ' 7' ' ' GLU . 47.3 mttm -79.48 98.22 6.73 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 177.572 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . 0.918 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 38.6 mt -78.89 57.45 2.14 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 112.805 0.669 . . . . 0.0 112.805 -177.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 10' ' ' CYS . . . . . 0.438 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 80.1 m -72.66 124.22 24.85 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.03 178.638 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 61.28 -124.3 34.66 Favored Glycine 0 CA--C 1.52 0.382 0 C-N-CA 121.334 -0.46 . . . . 0.0 114.077 179.272 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 23.5 t-160 -51.99 -31.2 28.33 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 123.233 0.613 . . . . 0.0 112.634 -178.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 13' ' ' HIS . . . . . 0.616 ' HB3' ' HA ' ' B' ' 9' ' ' LEU . 43.2 m170 -57.09 -42.64 81.09 Favored 'General case' 0 C--N 1.32 -0.712 0 C-N-CA 120.714 -0.395 . . . . 0.0 110.793 -179.339 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 14' ' ' PHE . . . . . 0.566 ' HA ' HD13 ' B' ' 9' ' ' LEU . 54.7 t80 -61.39 -46.26 90.9 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.183 0.516 . . . . 0.0 109.866 178.61 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . 0.468 ' O ' HG23 ' B' ' 19' ' ' VAL . 40.5 t -59.82 -52.35 62.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.276 -0.874 . . . . 0.0 111.674 -179.754 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . 0.681 ' HG3' ' N ' ' B' ' 17' ' ' ALA . 0.1 OUTLIER -58.65 -45.29 89.65 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.084 -178.936 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . 0.681 ' N ' ' HG3' ' B' ' 16' ' ' ARG . . . -68.41 -42.94 78.25 Favored 'General case' 0 C--O 1.218 -0.589 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.445 -179.453 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 50.2 tp -55.09 -51.1 67.45 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.731 0.301 . . . . 0.0 110.455 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 19' ' ' VAL . . . . . 0.468 HG23 ' O ' ' B' ' 15' ' ' VAL . 59.2 t -60.75 -44.82 98.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.048 179.337 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 65.7 mtp85 -66.33 -47.93 71.92 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 -179.344 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 21' ' ' VAL . . . . . 0.542 HG23 ' O ' ' B' ' 17' ' ' ALA . 95.5 t -62.01 -61.13 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 -178.882 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 68.2 m . . . . . 0 C--N 1.326 -0.436 0 CA-C-O 121.153 0.501 . . . . 0.0 111.424 -178.974 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_exo . . . . . 0 CA--C 1.528 0.203 0 N-CA-C 113.666 0.602 . . . . 0.0 113.666 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -59.27 -42.77 91.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.401 0.619 . . . . 0.0 110.303 179.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 25.0 ttt85 -65.74 -49.08 69.7 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.188 -0.915 . . . . 0.0 109.944 179.178 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 13.6 t80 -55.85 -48.17 75.99 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.833 -1.076 . . . . 0.0 110.889 179.534 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.918 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 69.0 m -63.69 -27.73 69.41 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.789 -0.641 . . . . 0.0 112.083 -179.748 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.438 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 52.7 t -86.56 -59.71 2.2 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.311 0.577 . . . . 0.0 110.792 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 53.2 mt -54.66 -51.6 64.96 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.158 -0.928 . . . . 0.0 111.785 -179.64 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 9.7 m -99.68 -63.07 1.16 Allowed 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 120.989 0.423 . . . . 0.0 110.546 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.634 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 127.67 149.62 7.17 Favored Glycine 0 N--CA 1.448 -0.503 0 N-CA-C 110.216 -1.154 . . . . 0.0 110.216 -179.403 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.684 ' HB2' ' CB ' ' A' ' 19' ' ' ASP . 28.3 p -144.07 -157.93 0.83 Allowed 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 117.485 0.642 . . . . 0.0 110.292 -179.01 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.631 ' H ' ' HB2' ' A' ' 19' ' ' ASP . 14.3 t -171.32 -162.77 0.25 Allowed 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 110.321 -0.251 . . . . 0.0 110.321 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.489 ' CD ' HG22 ' B' ' 21' ' ' VAL . 53.2 mm-40 -57.55 -50.29 73.57 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.674 -179.25 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 11.4 mm100 -62.02 -43.65 98.39 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.853 0.359 . . . . 0.0 110.852 -179.523 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.684 ' CB ' ' HB2' ' A' ' 15' ' ' CYS . 2.9 m-20 -58.16 -41.6 84.16 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.459 179.443 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.452 HD12 HG21 ' B' ' 21' ' ' VAL . 69.0 mt -78.78 -40.36 33.36 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 -179.376 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 21.2 tp -56.59 -44.29 80.94 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.561 -179.456 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 19.1 m -60.34 -22.93 63.81 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.597 179.716 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 94.2 mt -80.6 -26.79 37.63 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.157 179.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 97.9 m . . . . . 0 C--N 1.327 -0.397 0 CA-C-O 121.082 0.468 . . . . 0.0 111.159 -179.62 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 78.5 tt0 . . . . . 0 N--CA 1.45 -0.448 0 CA-C-O 121.304 0.573 . . . . 0.0 110.75 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 21.8 mmmt -78.48 91.95 4.59 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 177.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . 1.02 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 16.5 mt -75.56 57.74 0.98 Allowed 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 113.722 1.008 . . . . 0.0 113.722 -176.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 10' ' ' CYS . . . . . 0.424 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 87.8 m -77.18 123.11 25.96 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 178.028 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 64.11 -125.26 31.82 Favored Glycine 0 CA--C 1.521 0.451 0 C-N-CA 121.204 -0.522 . . . . 0.0 113.865 179.629 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 22.7 t-160 -52.24 -32.03 35.03 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 112.779 0.659 . . . . 0.0 112.779 -178.574 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 13' ' ' HIS . . . . . 0.621 ' HB3' ' HA ' ' B' ' 9' ' ' LEU . 41.0 m170 -56.41 -43.06 78.98 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 120.766 -0.374 . . . . 0.0 110.996 -179.312 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 14' ' ' PHE . . . . . 0.828 ' HA ' HD13 ' B' ' 9' ' ' LEU . 35.4 t80 -61.21 -45.73 93.38 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.176 0.513 . . . . 0.0 109.987 178.867 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 43.4 t -59.87 -51.52 71.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 115.292 -0.867 . . . . 0.0 111.866 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . 0.581 ' HG3' ' N ' ' B' ' 17' ' ' ALA . 10.7 ptt180 -62.22 -45.19 94.46 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.303 0.483 . . . . 0.0 112.303 -178.361 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . 0.581 ' N ' ' HG3' ' B' ' 16' ' ' ARG . . . -67.95 -48.27 66.34 Favored 'General case' 0 C--O 1.223 -0.324 0 N-CA-C 111.749 0.277 . . . . 0.0 111.749 -178.838 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 39.0 tp -57.01 -50.83 71.53 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.078 0.466 . . . . 0.0 110.898 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 46.5 t -60.56 -48.29 89.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.698 -0.683 . . . . 0.0 112.635 -179.565 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . 0.485 ' CZ ' ' HA ' ' B' ' 20' ' ' ARG . 0.1 OUTLIER -75.0 -39.3 61.31 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 113.956 1.095 . . . . 0.0 113.956 -178.145 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 21' ' ' VAL . . . . . 0.442 HG11 ' O ' ' A' ' 17' ' ' GLN . 70.0 t -71.12 -46.04 68.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -178.436 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 91.9 m . . . . . 0 C--N 1.33 -0.248 0 C-N-CA 120.332 -0.547 . . . . 0.0 111.519 -179.041 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.509 ' HB3' HD13 ' A' ' 23' ' ' LEU . 35.3 Cg_exo . . . . . 0 C--O 1.229 0.058 0 N-CA-C 113.693 0.613 . . . . 0.0 113.693 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.45 -45.22 85.0 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.225 0.536 . . . . 0.0 110.733 -179.804 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.427 ' HD2' ' HA ' ' A' ' 8' ' ' ARG . 10.3 tpt85 -70.01 -48.38 58.3 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.333 179.541 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 19.7 t80 -54.86 -52.53 62.49 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.945 -1.025 . . . . 0.0 111.52 -179.481 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 1.02 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 33.5 m -63.47 -32.47 73.93 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.049 -0.523 . . . . 0.0 112.198 -179.497 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.424 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 37.4 t -77.14 -57.06 4.05 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.453 0.644 . . . . 0.0 111.015 179.867 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 14.0 tp -62.48 -60.9 2.89 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 114.938 -1.028 . . . . 0.0 112.139 -178.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 9.2 m -86.02 -50.52 6.99 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.851 -178.495 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.597 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 111.16 155.41 13.63 Favored Glycine 0 N--CA 1.451 -0.35 0 N-CA-C 110.036 -1.226 . . . . 0.0 110.036 -178.543 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.703 ' HB2' ' HB3' ' A' ' 19' ' ' ASP . 18.3 p -146.0 153.92 41.31 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 118.255 1.027 . . . . 0.0 112.859 -178.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 59.7 p -95.97 -179.46 4.7 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.693 -179.612 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.442 ' O ' HG11 ' B' ' 21' ' ' VAL . 19.8 pt20 -61.59 -44.91 96.14 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 120.679 0.276 . . . . 0.0 110.983 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 55.6 mt-30 -63.06 -36.87 85.01 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.475 0.655 . . . . 0.0 109.697 179.072 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.703 ' HB3' ' HB2' ' A' ' 15' ' ' CYS . 5.5 t0 -61.6 -42.48 98.93 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.809 -1.087 . . . . 0.0 109.481 179.416 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.695 HD21 HD11 ' B' ' 9' ' ' LEU . 1.6 mm? -67.67 -46.26 72.88 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 121.055 0.455 . . . . 0.0 110.513 177.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 26.3 tp -55.39 -47.4 75.91 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.406 -178.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.8 p -65.01 -9.95 25.76 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 -179.755 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.523 ' HG ' ' O ' ' A' ' 19' ' ' ASP . 95.7 mt -85.32 -24.76 27.52 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.79 0.329 . . . . 0.0 110.459 179.164 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 51.4 m . . . . . 0 C--N 1.328 -0.355 0 CA-C-O 120.874 0.369 . . . . 0.0 111.475 -179.94 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . 0.414 ' CD ' HH21 ' B' ' 16' ' ' ARG . 40.0 tt0 . . . . . 0 CA--C 1.508 -0.643 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -74.93 93.25 2.65 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 178.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . 0.908 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 2.5 mp -75.41 53.55 0.68 Allowed 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.627 -0.715 . . . . 0.0 112.906 -177.683 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 80.6 m -75.31 124.6 27.37 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.007 178.472 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 60.08 -120.87 24.66 Favored Glycine 0 CA--C 1.52 0.404 0 C-N-CA 121.301 -0.476 . . . . 0.0 114.089 179.167 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 22.4 t-160 -51.41 -35.22 38.15 Favored 'General case' 0 N--CA 1.467 0.376 0 N-CA-C 113.18 0.808 . . . . 0.0 113.18 -178.422 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 13' ' ' HIS . . . . . 0.666 ' C ' ' HG ' ' B' ' 9' ' ' LEU . 36.6 m170 -56.32 -43.01 78.57 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 120.435 -0.506 . . . . 0.0 110.581 -179.092 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 14' ' ' PHE . . . . . 0.75 ' HA ' HD23 ' B' ' 9' ' ' LEU . 27.8 t80 -61.27 -47.47 85.85 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 178.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 20.5 t -58.21 -52.24 61.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.93 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . 0.539 ' HG3' ' N ' ' B' ' 17' ' ' ALA . 15.6 ptt180 -61.84 -46.21 90.45 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -178.206 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . 0.773 ' HB3' HD21 ' B' ' 9' ' ' LEU . . . -68.56 -44.29 74.77 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 111.788 0.292 . . . . 0.0 111.788 -179.027 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 20.0 tp -59.77 -51.88 67.86 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.087 -179.452 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 84.6 t -63.3 -41.19 91.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 120.662 0.268 . . . . 0.0 111.606 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . 0.923 ' HE ' ' HA ' ' B' ' 20' ' ' ARG . 0.4 OUTLIER -70.87 -48.17 55.27 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -179.071 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 87.3 t -66.3 -41.05 88.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 120.538 0.208 . . . . 0.0 111.247 -179.363 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 79.2 m . . . . . 0 C--N 1.328 -0.342 0 CA-C-O 121.158 0.504 . . . . 0.0 111.567 179.767 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_exo . . . . . 0 N--CA 1.464 -0.218 0 N-CA-C 113.416 0.506 . . . . 0.0 113.416 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.76 -43.95 85.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.136 0.493 . . . . 0.0 110.581 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.428 ' HD2' ' HA ' ' A' ' 8' ' ' ARG . 14.4 tpt180 -68.24 -51.27 47.15 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.283 179.52 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 47.0 t80 -55.57 -51.64 66.42 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 114.757 -1.11 . . . . 0.0 111.282 -179.584 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.908 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 14.1 m -62.48 -35.3 78.92 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.96 -179.725 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 38.2 t -72.43 -59.41 2.74 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.239 0.542 . . . . 0.0 111.562 -179.646 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.413 HD13 ' HA ' ' A' ' 12' ' ' LEU . 4.0 mm? -68.84 -56.6 7.46 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 113.005 0.743 . . . . 0.0 113.005 -178.416 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 13.9 m -81.74 -43.21 18.71 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 111.777 0.288 . . . . 0.0 111.777 -178.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.572 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 99.8 148.36 22.67 Favored Glycine 0 N--CA 1.45 -0.404 0 N-CA-C 110.875 -0.89 . . . . 0.0 110.875 -178.977 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.649 ' SG ' HD22 ' B' ' 9' ' ' LEU . 24.3 p -142.63 163.45 32.8 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 117.018 0.409 . . . . 0.0 111.897 -178.361 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.401 ' H ' ' HB2' ' A' ' 19' ' ' ASP . 63.3 p -114.89 -172.88 2.21 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.812 -179.389 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 24.3 pt20 -57.64 -42.5 83.56 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 120.611 0.244 . . . . 0.0 111.01 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -60.8 -41.67 96.09 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.181 0.515 . . . . 0.0 110.213 179.287 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.607 ' CB ' ' HB2' ' A' ' 15' ' ' CYS . 0.5 OUTLIER -61.99 -39.76 93.34 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.92 179.696 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.411 HD21 ' CD2' ' B' ' 9' ' ' LEU . 3.4 mm? -71.67 -39.34 70.35 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.751 -0.462 . . . . 0.0 109.751 178.057 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -57.7 -41.36 81.55 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.879 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 30.9 p -65.83 -5.39 8.86 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 71.6 mt -105.7 -10.5 16.74 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.009 0.433 . . . . 0.0 110.303 179.581 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 62.9 m . . . . . 0 C--N 1.326 -0.429 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.754 -179.368 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 . . . . . 0 N--CA 1.453 -0.304 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . 0.518 ' HA ' ' O ' ' A' ' 10' ' ' CYS . 65.7 mttm -77.55 95.01 4.43 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.579 0.704 . . . . 0.0 110.285 -179.643 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . 1.108 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 7.9 mp -75.02 52.02 0.54 Allowed 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 114.961 -1.018 . . . . 0.0 112.369 -179.106 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 67.5 m -73.08 123.13 22.96 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.222 -0.444 . . . . 0.0 109.94 178.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 59.24 -118.36 14.01 Favored Glycine 0 CA--C 1.52 0.383 0 C-N-CA 121.259 -0.496 . . . . 0.0 113.826 179.359 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 11.1 t-160 -54.14 -32.11 54.35 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 -178.661 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 13' ' ' HIS . . . . . 0.664 ' CB ' ' HA ' ' B' ' 9' ' ' LEU . 30.3 m170 -60.75 -36.94 80.17 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 120.109 -0.637 . . . . 0.0 110.815 -178.751 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 14' ' ' PHE . . . . . 0.877 ' HA ' HD23 ' B' ' 9' ' ' LEU . 15.9 t80 -62.13 -45.36 93.81 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 178.524 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 47.9 t -63.72 -52.94 50.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.087 -0.96 . . . . 0.0 111.9 179.699 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . 0.546 ' HG3' ' O ' ' B' ' 13' ' ' HIS . 3.7 ppt_? -59.68 -44.4 93.63 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.896 -0.593 . . . . 0.0 112.066 -178.442 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . 0.734 ' HB3' HD21 ' B' ' 9' ' ' LEU . . . -69.62 -41.8 75.18 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 121.146 -0.222 . . . . 0.0 111.115 -179.373 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 18' ' ' LEU . . . . . 0.436 ' O ' ' HB2' ' B' ' 22' ' ' CYS . 7.2 mt -56.85 -55.61 32.24 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.836 0.35 . . . . 0.0 111.259 179.502 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 41.7 t -64.26 -38.44 82.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.995 -0.548 . . . . 0.0 112.315 -178.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . 0.739 ' NE ' ' HA ' ' B' ' 20' ' ' ARG . 0.1 OUTLIER -77.06 -54.5 6.46 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.125 -0.63 . . . . 0.0 112.592 -178.563 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 21' ' ' VAL . . . . . 0.634 HG13 ' HG3' ' A' ' 17' ' ' GLN . 78.3 t -63.46 -45.73 97.11 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 CA-C-N 115.734 -0.666 . . . . 0.0 112.164 -178.502 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 22' ' ' CYS . . . . . 0.436 ' HB2' ' O ' ' B' ' 18' ' ' LEU . 88.1 m . . . . . 0 C--N 1.322 -0.607 0 CA-C-O 121.337 0.589 . . . . 0.0 112.043 -179.225 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_exo . . . . . 0 N--CA 1.465 -0.182 0 N-CA-C 113.431 0.512 . . . . 0.0 113.431 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.6 -44.32 81.0 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.313 0.578 . . . . 0.0 110.587 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 17.3 mmm180 -67.62 -50.24 59.09 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.073 179.296 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -57.34 -49.09 77.24 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.794 179.629 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 1.108 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 65.0 m -61.88 -38.67 89.2 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.723 -0.672 . . . . 0.0 112.074 -179.66 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 47.7 t -74.46 -59.66 2.63 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.245 0.545 . . . . 0.0 111.664 -179.398 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -61.99 -56.56 17.89 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.541 -0.754 . . . . 0.0 112.629 -178.518 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 12.5 m -91.22 -59.26 2.2 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.932 0.396 . . . . 0.0 111.144 -179.234 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.592 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 123.57 144.46 6.55 Favored Glycine 0 N--CA 1.446 -0.675 0 N-CA-C 110.894 -0.883 . . . . 0.0 110.894 -179.513 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.601 ' SG ' HD22 ' B' ' 9' ' ' LEU . 20.8 p -130.3 153.51 48.57 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 117.162 0.481 . . . . 0.0 110.789 -179.783 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.528 HG22 ' HB2' ' A' ' 19' ' ' ASP . 10.1 t -107.02 -176.86 3.2 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.638 -178.75 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.634 ' HG3' HG13 ' B' ' 21' ' ' VAL . 34.1 tt0 -59.0 -53.08 62.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.68 -179.737 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 8.8 mm100 -60.69 -38.43 84.93 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.392 0.615 . . . . 0.0 110.432 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.528 ' HB2' HG22 ' A' ' 16' ' ' THR . 3.0 t0 -62.12 -41.64 98.44 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.176 -0.92 . . . . 0.0 109.818 179.362 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 77.8 mt -72.81 -41.36 65.01 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.014 179.131 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 45.8 tp -56.35 -45.88 80.21 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.88 -179.486 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 11.0 p -64.27 -9.98 20.87 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 179.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 98.4 mt -96.59 -20.77 18.08 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.032 179.422 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 76.5 m . . . . . 0 C--N 1.327 -0.381 0 CA-C-O 121.181 0.515 . . . . 0.0 111.872 -179.026 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . 0.548 ' O ' HD22 ' B' ' 9' ' ' LEU . 8.8 tp10 . . . . . 0 N--CA 1.445 -0.685 0 CA-C-O 121.468 0.652 . . . . 0.0 109.475 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 6.0 mtmm -83.06 86.51 6.99 Favored 'General case' 0 C--N 1.308 -1.2 0 CA-C-N 115.331 -0.85 . . . . 0.0 109.555 -179.225 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . 0.638 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 1.6 mm? -74.73 54.44 0.62 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.653 -0.703 . . . . 0.0 112.878 -178.653 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 10' ' ' CYS . . . . . 0.488 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 81.2 m -71.28 119.66 15.74 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.608 178.78 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 53.47 -116.57 5.98 Favored Glycine 0 C--N 1.331 0.29 0 CA-C-N 116.161 -0.472 . . . . 0.0 113.583 179.213 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 22.6 t-160 -51.28 -34.04 31.19 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 122.978 0.511 . . . . 0.0 111.909 -179.634 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 13' ' ' HIS . . . . . 0.589 ' O ' HD12 ' B' ' 9' ' ' LEU . 46.7 m170 -55.16 -44.57 75.29 Favored 'General case' 0 C--N 1.32 -0.696 0 C-N-CA 120.495 -0.482 . . . . 0.0 110.48 -179.362 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 14' ' ' PHE . . . . . 0.461 ' CA ' ' HB3' ' B' ' 9' ' ' LEU . 25.7 t80 -62.64 -48.0 81.24 Favored 'General case' 0 C--N 1.329 -0.318 0 O-C-N 123.382 0.426 . . . . 0.0 110.229 178.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 13.0 t -56.43 -50.58 71.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.753 179.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.96 -45.08 96.17 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.016 -0.993 . . . . 0.0 112.061 -179.359 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.17 -44.56 83.7 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.769 0.319 . . . . 0.0 111.524 -179.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 29.4 tp -61.05 -51.53 68.79 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.607 -179.346 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 21.1 m -64.36 -33.89 65.69 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 -179.448 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . 0.534 ' HA ' ' NE ' ' B' ' 20' ' ' ARG . 13.9 mmp_? -77.38 -52.33 9.33 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 112.395 0.517 . . . . 0.0 112.395 -179.376 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 91.1 t -71.13 -52.75 24.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -178.545 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 83.6 m . . . . . 0 C--N 1.324 -0.542 0 CA-C-O 120.772 0.32 . . . . 0.0 111.282 -179.309 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo . . . . . 0 N--CA 1.466 -0.098 0 N-CA-C 113.416 0.506 . . . . 0.0 113.416 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -58.66 -43.35 89.83 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.024 0.44 . . . . 0.0 110.925 -179.747 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.404 ' HA ' ' HD3' ' A' ' 8' ' ' ARG . 3.0 mmt85 -73.25 -43.87 60.36 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.498 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 32.3 t80 -62.7 -51.42 67.27 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.115 -179.714 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.667 ' O ' ' HA2' ' A' ' 14' ' ' GLY . 86.6 m -67.32 -17.54 64.8 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.883 -179.577 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.488 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 28.8 t -82.95 -57.28 3.36 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.298 0.571 . . . . 0.0 110.341 178.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 97.2 mt -69.49 -57.85 4.71 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.885 -1.052 . . . . 0.0 112.555 -178.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 14.1 m -84.36 -29.68 26.07 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.085 0.469 . . . . 0.0 111.446 -178.787 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.667 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 83.62 151.31 11.41 Favored Glycine 0 N--CA 1.446 -0.672 0 C-N-CA 120.779 -0.724 . . . . 0.0 111.493 -178.861 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 82.9 m -134.79 143.79 47.29 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.933 0.396 . . . . 0.0 111.046 -179.162 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 39.7 p -80.64 167.34 20.15 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 178.559 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 4.6 pp0? -61.73 -37.64 84.97 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 179.373 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 66.9 tp60 -63.63 -43.42 96.87 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.199 178.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -59.7 -44.18 93.78 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.464 179.654 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.509 HD11 HD21 ' B' ' 9' ' ' LEU . 81.2 mt -65.23 -46.32 81.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.344 178.723 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 30.9 tp -57.31 -41.11 79.27 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.808 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 21.2 m -62.62 -24.16 67.44 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.36 179.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 96.6 mt -77.65 -23.19 49.74 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.487 179.244 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 43.2 m . . . . . 0 C--N 1.325 -0.458 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.251 -179.541 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 . . . . . 0 N--CA 1.451 -0.381 0 CA-C-O 120.661 0.267 . . . . 0.0 110.817 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 25.0 mtpp -71.8 98.04 1.9 Allowed 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 107.555 -1.276 . . . . 0.0 107.555 177.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . 0.811 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 32.5 mt -77.97 59.21 2.1 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 113.974 1.102 . . . . 0.0 113.974 -176.485 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 10' ' ' CYS . . . . . 0.424 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 93.2 m -80.99 122.83 27.78 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 177.759 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 63.08 -123.28 29.64 Favored Glycine 0 CA--C 1.52 0.35 0 C-N-CA 121.107 -0.568 . . . . 0.0 113.569 179.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 23.6 t-160 -53.41 -31.03 43.24 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 112.707 0.632 . . . . 0.0 112.707 -178.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 13' ' ' HIS . . . . . 0.641 ' CB ' ' HA ' ' B' ' 9' ' ' LEU . 51.4 m170 -56.5 -43.44 79.74 Favored 'General case' 0 C--N 1.321 -0.668 0 C-N-CA 120.665 -0.414 . . . . 0.0 111.26 -179.035 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 14' ' ' PHE . . . . . 0.713 ' HA ' HD13 ' B' ' 9' ' ' LEU . 45.8 t80 -61.44 -45.64 93.43 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.257 0.551 . . . . 0.0 109.666 178.691 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 23.7 t -60.45 -49.4 84.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.023 -0.989 . . . . 0.0 111.588 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . 0.623 ' HG3' ' N ' ' B' ' 17' ' ' ALA . 12.5 ptt85 -61.03 -43.22 99.21 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.706 -0.224 . . . . 0.0 111.549 -178.587 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . 0.623 ' N ' ' HG3' ' B' ' 16' ' ' ARG . . . -66.41 -51.25 58.93 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.805 0.336 . . . . 0.0 111.43 -179.176 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 29.9 tp -60.37 -54.59 43.79 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.714 -179.394 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 77.8 t -59.9 -45.36 95.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -178.698 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . 0.491 ' HD2' ' HA ' ' B' ' 20' ' ' ARG . 23.6 tpt85 -71.71 -56.18 6.28 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -178.107 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 21' ' ' VAL . . . . . 0.466 HG11 ' O ' ' A' ' 17' ' ' GLN . 89.2 t -61.83 -45.97 97.52 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.844 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 -176.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 74.4 m . . . . . 0 C--N 1.326 -0.425 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 -178.89 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_exo . . . . . 0 N--CA 1.466 -0.137 0 N-CA-C 113.093 0.382 . . . . 0.0 113.093 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.86 -41.88 78.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.271 0.557 . . . . 0.0 110.666 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.452 ' HD3' ' HA ' ' A' ' 8' ' ' ARG . 30.4 mmt-85 -70.35 -49.38 49.82 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.56 -0.746 . . . . 0.0 111.184 179.335 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 28.0 t80 -59.03 -49.12 79.12 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.657 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.811 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 95.0 m -63.31 -30.48 71.61 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.65 -179.416 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.424 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 36.0 t -77.04 -56.0 4.96 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.207 0.527 . . . . 0.0 110.063 178.97 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 85.5 mt -55.23 -55.08 35.33 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.078 -0.964 . . . . 0.0 110.723 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.403 ' HB2' ' H ' ' A' ' 14' ' ' GLY . 15.2 m -95.14 -92.88 0.19 Allowed 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.925 -0.579 . . . . 0.0 109.775 178.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.403 ' H ' ' HB2' ' A' ' 13' ' ' SER . . . 165.65 149.97 6.08 Favored Glycine 0 N--CA 1.448 -0.515 0 N-CA-C 111.221 -0.751 . . . . 0.0 111.221 179.649 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 73.9 m -134.99 134.41 40.46 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 117.191 0.495 . . . . 0.0 111.027 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.818 HG23 ' H ' ' A' ' 19' ' ' ASP . 6.4 t -81.52 160.89 23.8 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 179.212 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.466 ' O ' HG11 ' B' ' 21' ' ' VAL . 68.2 mm-40 -56.96 -40.09 75.83 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.234 0.54 . . . . 0.0 109.753 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 38.4 tt0 -62.59 -38.92 92.04 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.46 -0.791 . . . . 0.0 109.83 178.113 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.818 ' H ' HG23 ' A' ' 16' ' ' THR . 11.3 t0 -57.33 -47.49 81.42 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.006 -0.997 . . . . 0.0 109.183 178.848 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.718 HD21 HD11 ' B' ' 9' ' ' LEU . 4.4 mm? -62.18 -43.19 99.39 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.303 178.605 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 39.4 tp -54.71 -51.47 65.47 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.663 179.816 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 6.8 p -62.83 -16.02 56.68 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.546 ' HG ' ' O ' ' A' ' 19' ' ' ASP . 89.2 mt -80.26 -27.43 38.63 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.948 0.404 . . . . 0.0 110.235 179.08 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 88.6 m . . . . . 0 C--N 1.327 -0.387 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.187 179.941 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 62.2 tt0 . . . . . 0 C--O 1.237 0.414 0 CA-C-O 121.087 0.47 . . . . 0.0 111.123 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 10.1 mmtp -81.61 96.17 7.4 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 177.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . 0.996 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 21.5 mt -76.41 56.42 1.08 Allowed 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 112.848 0.684 . . . . 0.0 112.848 -178.079 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 99.4 m -75.94 121.45 22.7 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.164 -0.471 . . . . 0.0 109.807 178.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 62.35 -123.64 31.48 Favored Glycine 0 CA--C 1.521 0.462 0 C-N-CA 121.262 -0.494 . . . . 0.0 114.015 179.382 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 12' ' ' HIS . . . . . 0.485 ' O ' ' HG2' ' B' ' 16' ' ' ARG . 20.7 t-160 -51.44 -32.37 26.56 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 112.894 0.701 . . . . 0.0 112.894 -178.526 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 13' ' ' HIS . . . . . 0.628 ' HB3' ' HA ' ' B' ' 9' ' ' LEU . 28.7 m170 -57.75 -42.9 84.89 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 120.905 -0.318 . . . . 0.0 110.799 -179.433 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 14' ' ' PHE . . . . . 0.683 ' HA ' HD13 ' B' ' 9' ' ' LEU . 43.3 t80 -61.42 -45.9 92.39 Favored 'General case' 0 C--N 1.327 -0.396 0 O-C-N 123.418 0.449 . . . . 0.0 110.0 178.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 59.3 t -55.7 -56.61 11.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.568 -0.742 . . . . 0.0 112.108 -179.62 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . 0.485 ' HG2' ' O ' ' B' ' 12' ' ' HIS . 2.5 ptm180 -59.91 -47.71 84.68 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -179.147 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.79 -43.76 83.06 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.146 0.425 . . . . 0.0 112.146 -178.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 36.9 tp -59.34 -48.76 80.42 Favored 'General case' 0 C--N 1.327 -0.406 0 O-C-N 123.156 0.285 . . . . 0.0 110.698 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 72.7 t -61.31 -44.16 97.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.744 179.728 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.5 -47.07 86.94 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.595 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 21' ' ' VAL . . . . . 0.445 HG21 ' HA ' ' A' ' 17' ' ' GLN . 69.1 t -76.08 -45.95 35.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 N-CA-C 113.013 0.746 . . . . 0.0 113.013 -177.815 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 95.6 m . . . . . 0 C--N 1.324 -0.51 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 -178.464 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.64 ' HB3' HD13 ' A' ' 23' ' ' LEU . 33.5 Cg_exo . . . . . 0 N--CA 1.47 0.125 0 N-CA-C 113.448 0.519 . . . . 0.0 113.448 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.53 -39.42 87.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.499 0.666 . . . . 0.0 110.35 179.637 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.45 ' HA ' ' NE ' ' A' ' 8' ' ' ARG . 0.4 OUTLIER -67.93 -49.92 59.01 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.262 -0.881 . . . . 0.0 109.809 179.317 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 17.0 t80 -56.34 -51.59 67.7 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.031 -0.986 . . . . 0.0 111.1 179.684 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.996 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 57.6 m -61.92 -28.56 69.61 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.124 -179.588 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 42.3 t -82.52 -55.3 4.56 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.375 0.607 . . . . 0.0 111.124 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 91.6 mt -64.22 -58.73 5.74 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.157 -0.929 . . . . 0.0 112.417 -178.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 8.9 m -89.98 -43.75 10.34 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.999 0.428 . . . . 0.0 111.194 -179.17 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.688 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 103.81 149.46 20.47 Favored Glycine 0 N--CA 1.446 -0.635 0 N-CA-C 110.86 -0.896 . . . . 0.0 110.86 -178.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.556 ' HB2' ' CB ' ' A' ' 19' ' ' ASP . 28.2 p -139.95 -161.44 1.2 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 117.443 0.622 . . . . 0.0 110.944 -179.513 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.693 ' H ' ' HB2' ' A' ' 19' ' ' ASP . 6.9 t -160.1 -166.47 1.71 Allowed 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 -179.757 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.445 ' HA ' HG21 ' B' ' 21' ' ' VAL . 36.4 tt0 -59.0 -53.8 54.35 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.176 0.435 . . . . 0.0 112.176 -179.008 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -57.34 -45.85 83.87 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.819 0.343 . . . . 0.0 110.591 179.549 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.693 ' HB2' ' H ' ' A' ' 16' ' ' THR . 1.1 m-20 -56.53 -43.39 79.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.312 179.122 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.519 HD11 HD11 ' B' ' 9' ' ' LEU . 84.2 mt -72.04 -37.54 69.69 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.1 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 6.1 tt -57.13 -46.08 82.98 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.951 -179.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.5 p -64.98 -13.8 58.53 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.95 0.405 . . . . 0.0 111.73 179.076 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.64 HD13 ' HB3' ' A' ' 6' ' ' PRO . 90.5 mt -94.19 -18.24 21.92 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.822 179.435 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 69.9 m . . . . . 0 C--N 1.333 -0.149 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.886 -179.538 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 69.1 tt0 . . . . . 0 N--CA 1.447 -0.612 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 11.5 mmmm -76.23 93.01 3.33 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 178.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . 0.964 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 34.1 mt -78.2 57.47 1.86 Allowed 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 113.057 0.762 . . . . 0.0 113.057 -177.714 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 10' ' ' CYS . . . . . 0.405 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 87.4 m -73.43 121.6 20.78 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.192 178.413 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 58.65 -119.75 19.07 Favored Glycine 0 CA--C 1.52 0.391 0 N-CA-C 114.38 0.512 . . . . 0.0 114.38 179.22 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 12' ' ' HIS . . . . . 0.518 ' O ' ' HG3' ' B' ' 16' ' ' ARG . 16.5 t-160 -50.06 -32.46 15.6 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 -178.33 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 13' ' ' HIS . . . . . 0.644 ' HB3' ' HA ' ' B' ' 9' ' ' LEU . 23.6 m170 -59.36 -41.38 89.12 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 120.875 -0.33 . . . . 0.0 111.026 -179.267 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 14' ' ' PHE . . . . . 0.627 ' HA ' HD13 ' B' ' 9' ' ' LEU . 22.7 t80 -60.91 -44.42 97.19 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.171 0.51 . . . . 0.0 109.688 178.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . 0.463 ' O ' HG23 ' B' ' 19' ' ' VAL . 60.0 t -58.55 -58.65 5.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.162 -0.926 . . . . 0.0 112.508 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . 0.624 ' HD3' ' N ' ' B' ' 17' ' ' ALA . 0.0 OUTLIER -62.5 -31.92 72.75 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 120.732 -0.387 . . . . 0.0 111.916 -179.123 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . 0.624 ' N ' ' HD3' ' B' ' 16' ' ' ARG . . . -65.77 -47.56 74.79 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.545 179.329 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 18' ' ' LEU . . . . . 0.401 ' O ' ' HB2' ' B' ' 22' ' ' CYS . 57.9 mt -61.19 -49.6 76.52 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.838 179.302 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 19' ' ' VAL . . . . . 0.463 HG23 ' O ' ' B' ' 15' ' ' VAL . 87.1 t -57.33 -40.98 77.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.789 -179.813 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . 0.573 ' HA ' ' NE ' ' B' ' 20' ' ' ARG . 4.5 tpm_? -80.55 -59.78 2.56 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 -178.737 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 92.2 t -61.14 -44.22 97.88 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 CA-C-N 115.085 -0.962 . . . . 0.0 113.295 -177.132 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 22' ' ' CYS . . . . . 0.401 ' HB2' ' O ' ' B' ' 18' ' ' LEU . 75.9 m . . . . . 0 C--N 1.324 -0.509 0 CA-C-O 121.83 0.824 . . . . 0.0 111.684 -179.07 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.422 ' HB2' ' CZ ' ' B' ' 14' ' ' PHE . 23.3 Cg_exo . . . . . 0 N--CA 1.466 -0.135 0 N-CA-C 113.265 0.448 . . . . 0.0 113.265 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.59 -44.25 85.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.104 0.478 . . . . 0.0 110.424 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 35.6 ttp180 -63.31 -52.2 62.91 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.431 -0.804 . . . . 0.0 109.807 179.085 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 60.8 t80 -55.22 -49.56 71.67 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.369 -1.287 . . . . 0.0 111.27 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.964 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 72.4 m -64.64 -31.95 73.4 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.986 -0.552 . . . . 0.0 112.173 -179.323 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.405 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 42.6 t -76.89 -54.17 6.93 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.301 0.572 . . . . 0.0 110.952 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 11.0 mp -69.84 -59.61 2.83 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.296 -0.866 . . . . 0.0 112.547 -178.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.2 m -86.06 -45.6 11.27 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.767 0.318 . . . . 0.0 111.827 -178.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.607 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 104.72 149.71 19.69 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.841 -0.695 . . . . 0.0 111.421 -179.349 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.519 ' SG ' HD12 ' B' ' 9' ' ' LEU . 27.0 p -143.29 145.07 32.4 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.137 0.494 . . . . 0.0 111.509 -179.044 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 8.8 t -94.95 168.57 10.7 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.43 -179.261 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 5.6 mp0 -49.61 -45.31 48.02 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 122.772 0.429 . . . . 0.0 111.464 -179.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 4.2 tp60 -61.14 -40.01 92.2 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.254 0.55 . . . . 0.0 110.14 179.508 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.494 ' HB3' ' HB2' ' A' ' 15' ' ' CYS . 1.7 t70 -60.3 -43.95 95.85 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.584 179.286 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.481 HD21 HD11 ' B' ' 9' ' ' LEU . 1.8 mm? -67.49 -44.32 78.8 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.685 178.731 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 31.1 tp -55.87 -44.57 78.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.61 -179.327 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 21.7 m -60.55 -24.07 65.11 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.489 179.535 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 97.3 mt -85.14 -22.51 28.8 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.304 179.79 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 89.2 m . . . . . 0 C--N 1.326 -0.426 0 CA-C-O 121.112 0.482 . . . . 0.0 111.738 -179.419 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . 0.413 ' HG2' ' N ' ' B' ' 8' ' ' LYS . 55.2 tt0 . . . . . 0 N--CA 1.45 -0.45 0 CA-C-O 121.106 0.479 . . . . 0.0 110.792 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . 0.413 ' N ' ' HG2' ' B' ' 7' ' ' GLU . 41.3 mttm -87.63 96.47 10.43 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 108.031 -1.1 . . . . 0.0 108.031 177.528 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . 0.636 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 3.1 mm? -75.31 55.21 0.76 Allowed 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 -177.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 10' ' ' CYS . . . . . 0.432 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 73.4 m -76.24 121.8 23.44 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.697 179.018 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 55.26 -116.96 7.54 Favored Glycine 0 CA--C 1.52 0.4 0 CA-C-N 116.074 -0.512 . . . . 0.0 114.321 178.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 19.5 t-160 -50.89 -32.62 21.08 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 112.794 0.665 . . . . 0.0 112.794 -178.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 13' ' ' HIS . . . . . 0.635 ' HB3' ' HA ' ' B' ' 9' ' ' LEU . 20.7 m170 -59.48 -46.25 89.33 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.892 -179.273 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 14' ' ' PHE . . . . . . . . . . . . . 44.8 t80 -59.97 -40.88 90.59 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.076 0.465 . . . . 0.0 109.948 179.135 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . 0.471 ' O ' HG23 ' B' ' 19' ' ' VAL . 46.3 t -59.09 -55.35 24.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.46 -0.791 . . . . 0.0 111.439 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . 0.438 ' HG3' ' O ' ' B' ' 13' ' ' HIS . 2.8 ptm180 -63.18 -38.04 89.59 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.533 -179.484 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . 0.618 ' HB1' ' HG ' ' A' ' 20' ' ' LEU . . . -64.24 -47.46 79.54 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.714 0.293 . . . . 0.0 110.929 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 18' ' ' LEU . . . . . 0.443 HD23 ' HB2' ' B' ' 22' ' ' CYS . 1.5 tt -60.46 -51.43 69.51 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.688 -179.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 19' ' ' VAL . . . . . 0.471 HG23 ' O ' ' B' ' 15' ' ' VAL . 67.8 t -59.85 -38.19 75.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -179.511 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . 0.756 ' NE ' ' HA ' ' B' ' 20' ' ' ARG . 0.3 OUTLIER -83.24 -54.83 4.71 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -178.326 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 60.9 t -64.14 -50.72 75.66 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.554 -178.458 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 22' ' ' CYS . . . . . 0.443 ' HB2' HD23 ' B' ' 18' ' ' LEU . 60.8 m . . . . . 0 C--O 1.217 -0.616 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 178.541 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_exo . . . . . 0 CA--C 1.526 0.077 0 N-CA-C 113.203 0.424 . . . . 0.0 113.203 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.3 -44.45 95.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.395 0.617 . . . . 0.0 110.142 179.642 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.403 ' HA ' ' HD2' ' A' ' 8' ' ' ARG . 17.8 tpt180 -66.5 -48.86 68.48 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.617 179.091 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 23.6 t80 -55.52 -50.97 68.57 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 114.203 -1.362 . . . . 0.0 111.354 -179.695 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.694 ' O ' ' HA2' ' A' ' 14' ' ' GLY . 41.6 m -69.8 -16.04 63.22 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.796 179.99 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.432 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 24.0 t -85.3 -53.81 4.99 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.764 0.792 . . . . 0.0 109.605 178.821 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 98.6 mt -66.88 -60.38 2.71 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 114.635 -1.166 . . . . 0.0 111.642 -179.608 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 24.8 m -82.08 -42.42 19.23 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.425 -179.679 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.694 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 91.72 142.89 11.14 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.762 -0.732 . . . . 0.0 111.421 -178.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.623 ' HB2' ' CB ' ' A' ' 19' ' ' ASP . 29.9 p -141.06 151.5 44.08 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.579 0.228 . . . . 0.0 110.438 -179.117 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.504 ' O ' ' HB2' ' A' ' 19' ' ' ASP . 27.8 p -76.63 170.59 16.14 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.607 -179.278 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 84.9 mm-40 -62.15 -38.0 87.34 Favored 'General case' 0 C--O 1.234 0.245 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 178.509 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 90.7 mm-40 -62.78 -37.5 86.9 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 115.397 -0.82 . . . . 0.0 109.147 177.429 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.623 ' CB ' ' HB2' ' A' ' 15' ' ' CYS . 91.8 m-20 -59.67 -43.41 94.0 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.342 -0.844 . . . . 0.0 109.022 178.355 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.618 ' HG ' ' HB1' ' B' ' 17' ' ' ALA . 1.8 mm? -61.25 -42.13 98.1 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 177.299 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.569 ' HA ' ' SG ' ' A' ' 24' ' ' CYS . 32.1 tp -57.98 -40.46 80.73 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.54 179.76 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 3.9 m -63.12 -22.17 66.68 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.27 0.557 . . . . 0.0 110.823 179.233 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 93.4 mt -82.64 -21.4 35.06 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.45 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.569 ' SG ' ' HA ' ' A' ' 21' ' ' LEU . 3.1 m . . . . . 0 CA--C 1.53 0.18 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . 0.524 ' OE2' ' HG2' ' B' ' 8' ' ' LYS . 4.7 tp10 . . . . . 0 N--CA 1.44 -0.929 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . 0.524 ' HG2' ' OE2' ' B' ' 7' ' ' GLU . 11.7 mmtm -82.72 97.8 8.75 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-O 121.372 0.605 . . . . 0.0 110.811 -177.713 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . 0.748 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 3.3 mm? -83.37 58.29 4.43 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.573 179.545 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 10' ' ' CYS . . . . . 0.512 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 71.9 m -65.07 130.95 45.24 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.857 -0.611 . . . . 0.0 112.041 -179.701 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 53.94 -122.23 22.13 Favored Glycine 0 C--N 1.332 0.325 0 CA-C-N 115.772 -0.649 . . . . 0.0 114.461 178.178 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 17.2 t-160 -52.55 -29.28 24.68 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 123.005 0.522 . . . . 0.0 112.17 -178.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 13' ' ' HIS . . . . . 0.576 ' O ' ' HG3' ' B' ' 16' ' ' ARG . 29.4 m170 -59.58 -41.86 91.19 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.736 -0.211 . . . . 0.0 110.49 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 14' ' ' PHE . . . . . 0.507 ' CZ ' ' HB2' ' A' ' 6' ' ' PRO . 8.1 t80 -62.31 -47.51 83.94 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.091 0.472 . . . . 0.0 109.931 178.387 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 56.0 t -55.58 -53.31 37.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.634 -179.645 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . 0.576 ' HG3' ' O ' ' B' ' 13' ' ' HIS . 0.0 OUTLIER -63.48 -39.03 93.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.422 -179.525 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . 0.42 ' N ' ' HE ' ' B' ' 16' ' ' ARG . . . -65.66 -52.91 47.97 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.557 0.218 . . . . 0.0 111.517 -179.681 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 18' ' ' LEU . . . . . 0.641 HD13 HD23 ' A' ' 23' ' ' LEU . 38.0 tp -57.78 -53.75 54.67 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.825 -179.329 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 19' ' ' VAL . . . . . 0.527 HG12 ' NH1' ' B' ' 20' ' ' ARG . 85.0 t -60.35 -42.85 92.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 -178.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . 0.723 HH11 ' HA ' ' B' ' 20' ' ' ARG . 2.4 mmt-85 -72.0 -47.98 48.12 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 113.159 0.8 . . . . 0.0 113.159 -178.921 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 21' ' ' VAL . . . . . 0.43 HG11 ' O ' ' A' ' 17' ' ' GLN . 76.6 t -64.74 -46.81 91.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 N-CA-C 112.197 0.443 . . . . 0.0 112.197 -178.879 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 89.5 m . . . . . 0 C--N 1.328 -0.351 0 C-N-CA 120.941 -0.304 . . . . 0.0 111.555 -179.379 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.507 ' HB2' ' CZ ' ' B' ' 14' ' ' PHE . 23.4 Cg_exo . . . . . 0 N--CA 1.462 -0.356 0 N-CA-C 112.646 0.21 . . . . 0.0 112.646 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.19 -43.92 83.12 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.972 0.415 . . . . 0.0 110.75 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -67.87 -48.93 64.7 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.095 179.505 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 33.2 t80 -56.52 -52.99 62.68 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 114.936 -1.029 . . . . 0.0 111.306 -179.702 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.748 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 22.5 m -65.46 -23.9 67.03 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.036 -0.529 . . . . 0.0 112.32 -179.73 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.512 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 53.7 t -82.12 -52.89 6.55 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.413 0.625 . . . . 0.0 110.598 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 15.3 tp -69.71 -63.39 1.08 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.041 -0.982 . . . . 0.0 112.182 -178.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 36.3 t -81.3 -33.97 32.27 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.395 -178.682 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.687 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 88.6 158.47 33.82 Favored Glycine 0 N--CA 1.443 -0.887 0 C-N-CA 120.57 -0.824 . . . . 0.0 111.156 -178.541 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.5 ' SG ' HD23 ' B' ' 9' ' ' LEU . 26.5 p -151.04 166.8 29.61 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.818 0.309 . . . . 0.0 110.795 -179.204 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.449 ' H ' ' HB2' ' A' ' 19' ' ' ASP . 0.2 OUTLIER -121.95 -169.97 1.97 Allowed 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 116.444 -0.343 . . . . 0.0 111.323 -179.17 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.43 ' O ' HG11 ' B' ' 21' ' ' VAL . 23.8 pt20 -58.4 -51.71 68.67 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -178.399 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 95.4 mm-40 -63.18 -35.96 82.04 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.449 ' HB2' ' H ' ' A' ' 16' ' ' THR . 43.7 m-20 -58.68 -47.0 86.01 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.033 178.461 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -66.19 -44.68 83.28 Favored 'General case' 0 CA--C 1.522 -0.112 0 CA-C-O 120.878 0.37 . . . . 0.0 110.488 178.86 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 31.0 tp -55.36 -53.36 57.2 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.044 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 35.4 p -64.64 -12.05 41.84 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.093 -0.503 . . . . 0.0 112.24 179.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.641 HD23 HD13 ' B' ' 18' ' ' LEU . 24.6 tp -78.66 -28.74 45.44 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 179.688 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 93.2 m . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.672 179.563 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 77.4 tt0 . . . . . 0 C--O 1.238 0.48 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . 0.447 ' HA ' ' O ' ' A' ' 10' ' ' CYS . 24.5 mmtp -82.47 104.68 12.93 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 179.383 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . 0.769 ' HB2' ' SG ' ' A' ' 10' ' ' CYS . 6.5 mp -81.12 52.04 1.71 Allowed 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 -179.158 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 71.0 m -72.56 121.32 19.5 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.172 178.856 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 61.08 -120.94 24.89 Favored Glycine 0 CA--C 1.522 0.47 0 N-CA-C 114.417 0.527 . . . . 0.0 114.417 179.168 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 13.5 t-80 -50.18 -33.36 18.95 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 113.589 0.959 . . . . 0.0 113.589 -178.082 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 13' ' ' HIS . . . . . 0.604 ' HB3' ' HA ' ' B' ' 9' ' ' LEU . 24.3 m170 -58.34 -41.43 84.62 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.914 -0.315 . . . . 0.0 111.024 -179.117 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 14' ' ' PHE . . . . . 0.714 ' HA ' HD23 ' B' ' 9' ' ' LEU . 22.5 t80 -62.63 -45.09 94.44 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.014 0.435 . . . . 0.0 110.127 179.321 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 51.4 t -59.02 -58.78 5.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.407 -0.815 . . . . 0.0 112.119 -179.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . 0.402 HH21 HD11 ' B' ' 9' ' ' LEU . 0.0 OUTLIER -59.53 -39.79 85.08 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.872 -179.104 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.01 -43.27 88.17 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.967 -0.293 . . . . 0.0 111.069 -179.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 18' ' ' LEU . . . . . 0.44 ' HA ' HD23 ' B' ' 18' ' ' LEU . 9.7 mt -60.01 -56.3 23.43 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.826 179.802 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 7.8 t -65.93 -29.04 45.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -178.569 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . 0.571 ' HA ' ' NE ' ' B' ' 20' ' ' ARG . 3.3 tpm_? -80.12 -59.79 2.58 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 119.906 -0.718 . . . . 0.0 111.512 -179.828 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 60.2 t -65.19 -50.28 74.68 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 CA-C-N 115.209 -0.905 . . . . 0.0 111.739 -178.434 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 56.4 m . . . . . 0 C--N 1.322 -0.61 0 CA-C-O 120.926 0.393 . . . . 0.0 110.635 -179.669 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.417 ' HB2' ' CZ ' ' B' ' 14' ' ' PHE . 32.1 Cg_exo . . . . . 0 C--O 1.232 0.201 0 N-CA-C 113.631 0.589 . . . . 0.0 113.631 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.14 -43.32 95.8 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.347 0.594 . . . . 0.0 110.204 179.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.655 ' HA ' ' HE ' ' A' ' 8' ' ' ARG . 1.1 mmp_? -67.72 -47.59 68.92 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.956 179.147 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 9.7 t80 -58.04 -53.4 58.72 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.891 -179.88 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.769 ' SG ' ' HB2' ' B' ' 9' ' ' LEU . 9.3 t -69.42 -18.4 63.74 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 112.08 0.4 . . . . 0.0 112.08 -178.41 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 26.9 t -85.51 -51.28 6.62 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.798 0.808 . . . . 0.0 109.879 178.817 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 14.9 tp -66.06 -62.5 1.45 Allowed 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 114.559 -1.2 . . . . 0.0 111.284 -179.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 6.8 m -85.07 -45.3 12.23 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.39 -179.165 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.728 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 99.93 144.19 15.7 Favored Glycine 0 N--CA 1.452 -0.264 0 N-CA-C 111.2 -0.76 . . . . 0.0 111.2 -179.077 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.553 ' HB2' ' HB3' ' A' ' 19' ' ' ASP . 24.0 p -134.69 -151.03 0.41 Allowed 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 120.749 -0.38 . . . . 0.0 111.303 -178.475 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.553 ' H ' ' HB2' ' A' ' 19' ' ' ASP . 13.1 t -158.9 176.99 11.63 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -179.099 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 5.7 mp0 -56.62 -45.01 81.76 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 123.289 0.368 . . . . 0.0 110.823 -179.546 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -64.23 -41.61 96.93 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.965 0.412 . . . . 0.0 109.956 179.621 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.553 ' HB3' ' HB2' ' A' ' 15' ' ' CYS . 0.1 OUTLIER -58.73 -38.83 79.21 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.278 -0.873 . . . . 0.0 110.154 178.959 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.582 HD11 HD21 ' B' ' 9' ' ' LEU . 77.5 mt -75.7 -47.26 26.93 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.911 179.292 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 36.3 tp -52.08 -51.96 54.28 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.734 -0.666 . . . . 0.0 112.158 -178.581 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 15.3 t -63.48 -13.03 36.46 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 112.245 0.461 . . . . 0.0 112.245 -179.445 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 39.8 tp -102.73 -16.83 15.87 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.035 -179.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 87.4 m . . . . . 0 C--N 1.328 -0.346 0 CA-C-O 120.939 0.399 . . . . 0.0 112.046 -179.092 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 74.2 tt0 . . . . . 0 N--CA 1.444 -0.738 0 N-CA-C 108.374 -0.973 . . . . 0.0 108.374 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 18.0 mmtp -76.06 101.54 5.33 Favored 'General case' 0 C--N 1.315 -0.923 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 179.469 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . 1.023 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 8.4 mp -80.91 51.9 1.64 Allowed 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 112.57 0.581 . . . . 0.0 112.57 -178.772 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 73.5 m -70.67 120.21 15.95 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.061 178.645 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 61.65 -120.24 21.55 Favored Glycine 0 CA--C 1.523 0.545 0 N-CA-C 114.542 0.577 . . . . 0.0 114.542 179.207 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 13.3 t-80 -49.56 -33.99 16.39 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 113.751 1.019 . . . . 0.0 113.751 -177.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 13' ' ' HIS . . . . . 0.644 ' CB ' ' HA ' ' B' ' 9' ' ' LEU . 25.7 m170 -58.28 -41.27 84.02 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.795 -0.362 . . . . 0.0 110.949 -179.252 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 14' ' ' PHE . . . . . 0.992 ' HA ' HD23 ' B' ' 9' ' ' LEU . 31.7 t80 -62.51 -46.39 88.65 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.898 0.38 . . . . 0.0 110.074 178.866 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 62.1 t -55.5 -57.73 6.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.571 -0.741 . . . . 0.0 112.05 -179.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.08 -40.18 92.71 Favored 'General case' 0 N--CA 1.464 0.226 0 N-CA-C 112.342 0.497 . . . . 0.0 112.342 -178.93 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . 0.518 ' HB3' HD21 ' B' ' 9' ' ' LEU . . . -70.05 -46.82 64.19 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.612 -179.601 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 57.7 tp -56.76 -52.17 66.05 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.836 -179.877 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 89.7 t -62.47 -48.14 89.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.824 -0.625 . . . . 0.0 112.252 -179.659 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . 0.889 ' HE ' ' HA ' ' B' ' 20' ' ' ARG . 0.0 OUTLIER -70.52 -40.85 73.25 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 114.031 1.123 . . . . 0.0 114.031 -178.322 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 71.3 t -73.11 -46.77 50.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -178.233 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 80.6 m . . . . . 0 C--N 1.327 -0.403 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 -178.225 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.688 ' HB3' HD13 ' A' ' 23' ' ' LEU . 16.9 Cg_exo . . . . . 0 N--CA 1.465 -0.161 0 N-CA-C 113.179 0.415 . . . . 0.0 113.179 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.71 -42.07 78.51 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.051 0.453 . . . . 0.0 110.527 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 13.9 ttm180 -61.7 -54.45 42.41 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.012 179.367 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 35.3 t80 -57.57 -49.16 77.3 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.627 -1.17 . . . . 0.0 111.295 -179.705 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 1.023 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 54.3 m -65.23 -27.39 68.63 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.966 -0.561 . . . . 0.0 112.243 -179.365 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 52.2 t -80.83 -52.7 7.2 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.556 0.693 . . . . 0.0 110.23 179.516 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 90.8 mt -64.25 -57.9 8.1 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 114.891 -1.05 . . . . 0.0 112.44 -179.175 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 35.5 t -93.3 -44.35 8.35 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 111.725 0.269 . . . . 0.0 111.725 -179.006 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.652 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 105.26 157.82 22.94 Favored Glycine 0 N--CA 1.452 -0.26 0 N-CA-C 110.924 -0.87 . . . . 0.0 110.924 -178.814 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.533 ' HB2' ' CB ' ' A' ' 19' ' ' ASP . 25.7 p -151.28 159.75 44.18 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 117.343 0.571 . . . . 0.0 112.513 -178.295 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 48.2 p -106.73 -174.41 2.53 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.242 179.583 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 54.9 tt0 -57.42 -48.97 77.73 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 111.933 0.346 . . . . 0.0 111.933 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 60.9 tp60 -59.55 -41.96 91.29 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.109 0.481 . . . . 0.0 109.884 179.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.638 ' O ' ' HG ' ' A' ' 23' ' ' LEU . 34.2 m-20 -57.14 -44.94 83.88 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.274 -0.875 . . . . 0.0 109.629 179.061 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.667 HD13 HD12 ' A' ' 23' ' ' LEU . 3.6 mm? -59.65 -48.37 81.93 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-O 120.768 0.318 . . . . 0.0 110.527 178.228 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 8.9 tt -55.62 -47.46 76.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.68 179.472 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 8.3 m -60.59 -25.21 66.05 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.331 -0.85 . . . . 0.0 111.816 179.605 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.688 HD13 ' HB3' ' A' ' 6' ' ' PRO . 96.6 mt -73.09 -30.6 63.79 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.272 179.324 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 7.4 m . . . . . 0 C--N 1.326 -0.419 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.034 178.766 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.446 -0.635 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -80.31 86.4 5.68 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 179.365 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . 0.992 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 14.6 mt -74.11 55.1 0.56 Allowed 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 -176.891 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 10' ' ' CYS . . . . . 0.409 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 73.8 m -74.24 117.36 15.96 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 177.878 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 63.46 -121.76 24.92 Favored Glycine 0 CA--C 1.521 0.459 0 C-N-CA 121.157 -0.544 . . . . 0.0 113.78 179.813 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 23.6 t-160 -51.79 -32.08 29.71 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 112.825 0.676 . . . . 0.0 112.825 -178.706 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 13' ' ' HIS . . . . . 0.701 ' CB ' ' HA ' ' B' ' 9' ' ' LEU . 52.0 m170 -57.57 -39.76 77.43 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 120.437 -0.505 . . . . 0.0 110.74 -179.387 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 14' ' ' PHE . . . . . 0.848 ' HA ' HD13 ' B' ' 9' ' ' LEU . 34.4 t80 -62.01 -44.34 96.92 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.331 0.586 . . . . 0.0 109.823 178.766 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 55.1 t -62.02 -49.23 84.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.121 -0.945 . . . . 0.0 111.76 179.867 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . 0.649 ' HG2' ' HA ' ' B' ' 13' ' ' HIS . 19.2 ptt180 -62.51 -44.99 95.02 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.731 -178.885 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . 0.517 ' N ' ' HG3' ' B' ' 16' ' ' ARG . . . -65.54 -41.28 93.2 Favored 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 120.925 -0.31 . . . . 0.0 111.021 -179.854 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 63.6 tp -59.35 -54.72 43.51 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.175 179.89 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 22.3 m -64.67 -28.11 44.08 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.187 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -179.387 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . 0.756 ' NE ' ' HA ' ' B' ' 20' ' ' ARG . 3.5 mmp_? -84.49 -48.93 9.09 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -179.41 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 21' ' ' VAL . . . . . 0.557 HG13 ' HG3' ' A' ' 17' ' ' GLN . 58.4 t -63.54 -47.21 92.56 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.781 -179.245 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 79.3 m . . . . . 0 C--N 1.325 -0.478 0 C-N-CA 120.412 -0.515 . . . . 0.0 111.753 -179.272 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo . . . . . 0 N--CA 1.473 0.301 0 N-CA-C 114.156 0.791 . . . . 0.0 114.156 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -58.83 -41.64 87.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.404 0.621 . . . . 0.0 110.401 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.421 ' HD3' ' HA ' ' A' ' 8' ' ' ARG . 13.4 mmt180 -66.21 -44.45 83.84 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.722 179.051 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 7.1 t80 -58.58 -46.77 86.24 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.093 0.473 . . . . 0.0 110.188 178.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.992 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 55.3 m -61.17 -29.42 69.79 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.446 -0.797 . . . . 0.0 112.134 -179.913 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.409 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 44.0 t -86.96 -53.59 4.81 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.552 0.692 . . . . 0.0 111.06 -179.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 9.0 mp -62.79 -40.64 97.97 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.857 -1.065 . . . . 0.0 113.433 -178.673 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 19.6 m -113.71 -42.01 3.5 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 121.074 0.464 . . . . 0.0 111.131 -178.876 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.608 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 105.99 144.13 12.04 Favored Glycine 0 N--CA 1.442 -0.929 0 C-N-CA 120.869 -0.681 . . . . 0.0 111.512 -179.073 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.693 ' HB2' ' CB ' ' A' ' 19' ' ' ASP . 31.0 p -139.04 149.58 44.79 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 -179.453 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.533 HG22 ' OD1' ' A' ' 19' ' ' ASP . 6.2 t -111.78 -167.37 1.17 Allowed 'General case' 0 C--N 1.327 -0.384 0 O-C-N 122.256 -0.277 . . . . 0.0 110.702 -179.037 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.557 ' HG3' HG13 ' B' ' 21' ' ' VAL . 53.7 tt0 -53.28 -46.28 69.24 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.199 -0.455 . . . . 0.0 112.067 -179.186 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.404 ' H ' HG23 ' A' ' 16' ' ' THR . 70.2 mt-30 -60.23 -44.33 95.3 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.691 -0.231 . . . . 0.0 110.819 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.693 ' CB ' ' HB2' ' A' ' 15' ' ' CYS . 1.6 m-20 -58.65 -44.62 90.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.237 -0.438 . . . . 0.0 109.918 179.276 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.555 HD21 HD11 ' B' ' 9' ' ' LEU . 3.9 mm? -66.95 -44.82 79.57 Favored 'General case' 0 CA--C 1.52 -0.2 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.787 179.376 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 19.6 tp -56.86 -48.53 77.89 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.912 -179.232 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 18.2 p -63.6 -15.96 59.56 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 179.786 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 45.3 tp -87.01 -24.76 24.55 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.572 179.611 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 79.9 m . . . . . 0 C--N 1.327 -0.381 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.257 -179.539 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 . . . . . 0 N--CA 1.45 -0.466 0 CA-C-O 121.074 0.464 . . . . 0.0 109.77 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . 0.452 ' HA ' ' O ' ' A' ' 10' ' ' CYS . 1.5 mppt? -78.85 97.71 6.07 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.546 179.622 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . 0.869 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 15.1 mt -76.25 52.48 0.75 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.417 -0.81 . . . . 0.0 112.49 -178.517 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 69.4 m -72.72 120.2 18.01 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 178.649 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 61.06 -118.07 13.79 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 121.244 -0.503 . . . . 0.0 113.891 179.599 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 18.1 t-160 -54.07 -31.68 52.47 Favored 'General case' 0 N--CA 1.465 0.306 0 N-CA-C 113.06 0.763 . . . . 0.0 113.06 -178.471 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 13' ' ' HIS . . . . . 0.632 ' CB ' ' HA ' ' B' ' 9' ' ' LEU . 26.8 m170 -61.22 -38.76 87.76 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 120.164 -0.614 . . . . 0.0 111.187 -178.668 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 14' ' ' PHE . . . . . 0.793 ' HA ' HD13 ' B' ' 9' ' ' LEU . 33.0 t80 -61.19 -45.0 96.4 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 178.567 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 56.4 t -62.01 -50.92 78.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 114.972 -1.013 . . . . 0.0 111.753 179.776 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . 0.615 ' HG3' ' O ' ' B' ' 13' ' ' HIS . 4.4 ppt_? -61.88 -42.83 99.53 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 112.258 0.466 . . . . 0.0 112.258 -178.414 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -70.33 -45.85 65.35 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 121.01 -0.276 . . . . 0.0 111.406 -179.446 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 18' ' ' LEU . . . . . 0.538 ' HB2' ' O ' ' B' ' 14' ' ' PHE . 0.4 OUTLIER -56.63 -54.41 46.41 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.647 -179.869 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 90.8 t -62.26 -48.25 89.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -178.819 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 24.6 mmm-85 -67.63 -45.06 76.47 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 114.245 1.202 . . . . 0.0 114.245 -178.23 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 99.4 t -76.2 -42.95 37.68 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 N-CA-C 113.01 0.745 . . . . 0.0 113.01 -177.671 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 99.0 m . . . . . 0 C--N 1.324 -0.531 0 N-CA-C 113.347 0.869 . . . . 0.0 113.347 -177.987 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_exo . . . . . 0 N--CA 1.469 0.061 0 N-CA-C 113.351 0.481 . . . . 0.0 113.351 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -58.8 -42.56 89.4 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.303 0.573 . . . . 0.0 110.296 179.822 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.433 ' HD3' ' HA ' ' A' ' 8' ' ' ARG . 14.4 tpp180 -64.96 -50.06 67.87 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.36 -0.836 . . . . 0.0 109.742 179.026 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 31.8 t80 -55.86 -49.58 72.96 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.573 -1.194 . . . . 0.0 111.214 179.806 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.869 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 56.5 m -68.11 -29.14 68.0 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.0 -0.545 . . . . 0.0 112.398 -179.323 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 44.7 t -79.16 -55.05 5.39 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.369 0.604 . . . . 0.0 110.902 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 11.2 mp -67.14 -47.34 71.36 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.266 -0.879 . . . . 0.0 112.562 -179.024 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.5 m -100.98 -52.67 3.23 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.931 0.396 . . . . 0.0 111.323 -179.223 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.626 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 115.29 161.67 13.23 Favored Glycine 0 N--CA 1.445 -0.754 0 C-N-CA 120.36 -0.924 . . . . 0.0 112.295 -179.898 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.439 ' HB2' ' HB2' ' A' ' 19' ' ' ASP . 21.4 p -155.1 153.58 31.07 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.899 0.38 . . . . 0.0 110.206 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 72.0 p -103.08 179.9 4.14 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.319 -179.373 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 5.9 mp0 -58.04 -39.76 79.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.245 179.295 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 10.8 mm100 -63.5 -40.88 98.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.3 179.215 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.439 ' HB2' ' HB2' ' A' ' 15' ' ' CYS . 51.4 m-20 -61.23 -42.79 99.23 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.457 178.934 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.734 HD21 HD11 ' B' ' 9' ' ' LEU . 3.6 mm? -66.11 -45.6 80.56 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.365 178.541 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 25.7 tp -56.84 -42.38 79.54 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.848 -179.619 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 19.7 m -65.65 -21.07 66.53 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.345 0.593 . . . . 0.0 111.327 179.676 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 33.8 tp -86.33 -1.28 57.38 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.946 179.852 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 74.3 m . . . . . 0 C--N 1.324 -0.513 0 CA-C-O 120.947 0.403 . . . . 0.0 111.451 -179.582 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . 0.555 ' HG3' HD23 ' B' ' 9' ' ' LEU . 11.8 tp10 . . . . . 0 N--CA 1.447 -0.614 0 CA-C-O 121.46 0.648 . . . . 0.0 110.309 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . 0.439 ' HD3' ' N ' ' B' ' 8' ' ' LYS . 0.7 OUTLIER -82.87 95.33 7.91 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 179.876 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . 0.787 HD13 ' HA ' ' B' ' 14' ' ' PHE . 18.8 mt -77.45 54.47 1.16 Allowed 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 -177.561 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 10' ' ' CYS . . . . . 0.413 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 74.4 m -72.51 121.06 19.02 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.039 178.307 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 57.97 -120.21 20.57 Favored Glycine 0 CA--C 1.52 0.392 0 C-N-CA 121.34 -0.457 . . . . 0.0 113.892 179.323 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 23.6 t-160 -52.77 -30.71 34.42 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -178.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 13' ' ' HIS . . . . . 0.628 ' HA ' ' HG2' ' B' ' 16' ' ' ARG . 46.9 m170 -58.46 -41.84 86.08 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 120.438 -0.505 . . . . 0.0 110.682 -179.456 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 14' ' ' PHE . . . . . 0.787 ' HA ' HD13 ' B' ' 9' ' ' LEU . 34.3 t80 -60.88 -44.39 97.14 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.217 0.532 . . . . 0.0 109.753 178.766 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 46.9 t -61.15 -50.59 79.87 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.254 -0.885 . . . . 0.0 111.751 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . 0.628 ' HG2' ' HA ' ' B' ' 13' ' ' HIS . 18.5 ptt180 -62.05 -45.31 94.1 Favored 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -178.723 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . 0.537 ' N ' ' HG3' ' B' ' 16' ' ' ARG . . . -67.53 -43.43 80.8 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 111.76 0.281 . . . . 0.0 111.76 -179.216 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 18' ' ' LEU . . . . . 0.571 ' O ' ' HB2' ' B' ' 22' ' ' CYS . 3.7 tt -60.61 -55.38 34.04 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 110.118 -0.327 . . . . 0.0 110.118 -179.799 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 83.5 t -57.28 -41.43 78.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.166 -0.47 . . . . 0.0 112.217 -179.605 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . 0.593 ' NE ' ' HA ' ' B' ' 20' ' ' ARG . 4.0 tpm_? -78.95 -60.87 2.21 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 113.32 0.859 . . . . 0.0 113.32 -178.517 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 63.0 t -65.44 -45.68 92.22 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.85 0 N-CA-C 114.004 1.113 . . . . 0.0 114.004 -176.489 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 22' ' ' CYS . . . . . 0.571 ' HB2' ' O ' ' B' ' 18' ' ' LEU . 73.0 m . . . . . 0 C--N 1.327 -0.408 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -178.271 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo . . . . . 0 N--CA 1.472 0.216 0 N-CA-C 114.091 0.766 . . . . 0.0 114.091 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.86 -43.25 98.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.4 0.619 . . . . 0.0 110.169 179.79 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 26.1 ttm180 -66.28 -49.07 68.34 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.258 -0.883 . . . . 0.0 109.885 179.212 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 16.2 t80 -54.93 -50.76 68.05 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 114.452 -1.249 . . . . 0.0 111.33 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.656 ' SG ' ' HG ' ' B' ' 9' ' ' LEU . 35.5 t -73.01 -12.67 61.01 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.798 0.332 . . . . 0.0 111.713 -179.15 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.413 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 16.0 t -83.99 -53.55 5.48 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 121.723 0.773 . . . . 0.0 109.075 178.36 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.9 mp -69.81 -45.21 68.41 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.376 -1.283 . . . . 0.0 112.67 -179.73 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 8.3 m -98.36 -34.78 10.54 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 112.174 0.435 . . . . 0.0 112.174 -178.218 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.604 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 87.76 150.52 19.73 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.642 -0.79 . . . . 0.0 112.105 -179.026 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.62 ' HB2' ' CB ' ' A' ' 19' ' ' ASP . 32.1 p -148.28 148.73 30.77 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.845 0.355 . . . . 0.0 110.152 -179.216 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 65.1 p -94.13 -176.63 4.05 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.95 0.405 . . . . 0.0 111.448 -178.545 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.453 ' H ' ' CD ' ' A' ' 17' ' ' GLN . 2.0 pm0 -60.78 -40.2 91.71 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 115.956 -0.566 . . . . 0.0 109.785 178.321 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 37.2 tt0 -60.29 -45.04 94.72 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.25 -0.886 . . . . 0.0 109.531 178.498 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.62 ' CB ' ' HB2' ' A' ' 15' ' ' CYS . 12.3 m-20 -56.26 -45.84 79.9 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 114.997 -1.001 . . . . 0.0 109.762 178.897 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.638 HD21 HD11 ' B' ' 9' ' ' LEU . 3.2 mm? -63.96 -44.7 91.99 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.543 178.491 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 32.0 tp -56.7 -45.85 81.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.413 -179.284 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.0 p -66.19 -10.75 44.47 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -179.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.411 HD13 ' HA ' ' A' ' 23' ' ' LEU . 4.0 mm? -109.39 12.42 24.66 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.601 -0.272 . . . . 0.0 111.26 179.57 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 96.1 m . . . . . 0 C--N 1.328 -0.339 0 CA-C-O 121.192 0.52 . . . . 0.0 111.491 179.709 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.237 0.417 0 N-CA-C 109.533 -0.544 . . . . 0.0 109.533 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . 0.476 ' NZ ' ' HB2' ' B' ' 8' ' ' LYS . 4.8 mtmp? -73.17 96.29 2.21 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.293 179.943 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . 0.684 ' HB2' ' SG ' ' A' ' 10' ' ' CYS . 96.6 mt -88.01 58.9 5.05 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.4 0.619 . . . . 0.0 111.307 -179.723 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 10' ' ' CYS . . . . . 0.453 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 99.5 m -64.45 136.86 57.5 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.611 -0.722 . . . . 0.0 112.001 179.827 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 57.42 -125.05 37.96 Favored Glycine 0 CA--C 1.518 0.266 0 CA-C-N 115.644 -0.707 . . . . 0.0 114.809 177.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 15.4 t-160 -50.69 -31.45 16.46 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 123.325 0.65 . . . . 0.0 112.736 -178.228 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 13' ' ' HIS . . . . . 0.419 ' HB3' ' CD2' ' B' ' 9' ' ' LEU . 22.6 m170 -59.51 -43.68 93.31 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 121.216 -0.194 . . . . 0.0 111.134 -179.42 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 14' ' ' PHE . . . . . . . . . . . . . 34.6 t80 -64.05 -42.3 97.09 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.168 0.509 . . . . 0.0 109.86 178.927 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . 0.651 ' O ' HG23 ' B' ' 19' ' ' VAL . 39.3 t -58.84 -56.67 15.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.379 -179.935 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . 0.533 ' HD3' ' N ' ' B' ' 17' ' ' ALA . 0.0 OUTLIER -61.07 -35.06 75.95 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-O 120.754 0.311 . . . . 0.0 110.971 -179.676 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . 0.533 ' N ' ' HD3' ' B' ' 16' ' ' ARG . . . -64.15 -46.76 82.61 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.48 179.109 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 21.2 mt -60.51 -45.92 92.03 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.433 179.452 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 19' ' ' VAL . . . . . 0.651 HG23 ' O ' ' B' ' 15' ' ' VAL . 14.7 t -60.62 -39.55 81.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-O 120.939 0.4 . . . . 0.0 110.8 -179.737 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 31.4 tpt85 -74.27 -57.67 3.8 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.286 0.565 . . . . 0.0 112.081 -179.657 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 21' ' ' VAL . . . . . 0.672 HG22 ' HG3' ' A' ' 17' ' ' GLN . 65.2 t -65.9 -57.36 10.95 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.892 0 CA-C-N 114.706 -1.134 . . . . 0.0 113.502 -177.019 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 56.8 m . . . . . 0 C--N 1.324 -0.542 0 CA-C-O 120.883 0.373 . . . . 0.0 111.527 -178.219 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo . . . . . 0 C--O 1.235 0.338 0 N-CA-C 113.446 0.518 . . . . 0.0 113.446 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.31 -46.35 90.19 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.202 0.525 . . . . 0.0 110.64 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.442 ' HD3' ' HA ' ' A' ' 8' ' ' ARG . 3.6 mmt180 -68.8 -39.35 80.16 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.121 179.484 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 31.3 t80 -57.93 -53.43 58.34 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.081 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.684 ' SG ' ' HB2' ' B' ' 9' ' ' LEU . 49.0 t -69.46 -18.35 63.71 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.018 0.437 . . . . 0.0 111.487 -179.64 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.453 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 16.2 t -81.09 -53.02 6.76 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.474 0.654 . . . . 0.0 110.47 179.401 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 94.2 mt -75.37 -57.88 3.62 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.044 -0.98 . . . . 0.0 112.51 -179.131 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 14.2 m -81.98 -29.4 32.15 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.823 0.344 . . . . 0.0 111.72 -178.783 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.58 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 86.13 147.66 10.71 Favored Glycine 0 N--CA 1.447 -0.59 0 C-N-CA 120.533 -0.841 . . . . 0.0 111.648 -178.914 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 18.1 p -139.84 -160.03 1.02 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.885 0.342 . . . . 0.0 110.529 -179.885 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.615 ' CG2' ' HB2' ' A' ' 19' ' ' ASP . 2.8 t -160.19 -178.65 7.12 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 -179.086 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.672 ' HG3' HG22 ' B' ' 21' ' ' VAL . 38.1 tt0 -62.7 -54.5 38.33 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -179.341 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -63.11 -34.17 77.02 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 179.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.615 ' HB2' ' CG2' ' A' ' 16' ' ' THR . 13.7 t70 -61.95 -45.77 92.2 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.949 179.076 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 53.2 mt -69.15 -42.72 75.57 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.523 179.498 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 32.4 tp -55.84 -52.48 63.88 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.349 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 16.1 p -65.37 -11.5 42.86 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.971 179.364 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 48.8 tp -93.6 -26.8 16.94 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.188 -0.46 . . . . 0.0 109.965 179.108 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 80.5 m . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.874 -179.868 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 . . . . . 0 N--CA 1.45 -0.461 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . 0.43 ' HE2' ' HB2' ' B' ' 8' ' ' LYS . 25.3 mtmm -67.91 97.44 0.66 Allowed 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.957 -178.981 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . 0.639 ' HB2' ' SG ' ' A' ' 10' ' ' CYS . 84.1 mt -88.9 53.24 2.63 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.275 0.559 . . . . 0.0 110.752 179.581 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 10' ' ' CYS . . . . . 0.405 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 96.6 m -60.18 138.72 57.86 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.788 -179.931 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 66.95 -133.88 31.73 Favored Glycine 0 N--CA 1.451 -0.327 0 CA-C-N 115.668 -0.696 . . . . 0.0 114.824 178.334 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 17.5 t-160 -52.47 -29.25 23.85 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 -178.077 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 13' ' ' HIS . . . . . 0.591 ' HB3' HD22 ' B' ' 9' ' ' LEU . 22.7 m170 -58.6 -46.11 87.71 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.471 0.177 . . . . 0.0 111.286 -179.147 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 14' ' ' PHE . . . . . 0.581 ' CZ ' ' HB2' ' A' ' 6' ' ' PRO . 54.0 t80 -63.22 -45.19 92.82 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 178.509 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 40.6 t -54.2 -54.56 20.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.473 -179.608 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . 0.58 ' HG3' ' O ' ' B' ' 13' ' ' HIS . 0.0 OUTLIER -61.75 -42.74 99.36 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.852 -0.339 . . . . 0.0 111.598 -179.481 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . 0.509 ' N ' ' HE ' ' B' ' 16' ' ' ARG . . . -63.68 -52.39 60.88 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 -179.953 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 18' ' ' LEU . . . . . 0.503 HD22 ' CZ ' ' B' ' 14' ' ' PHE . 16.2 tp -64.57 -53.84 41.59 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.264 -179.044 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 83.1 t -58.31 -40.31 77.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -178.295 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . 0.999 ' HA ' ' HE ' ' B' ' 20' ' ' ARG . 1.0 OUTLIER -82.29 -46.53 13.53 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 114.183 1.179 . . . . 0.0 114.183 -178.658 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 21' ' ' VAL . . . . . 0.489 HG21 ' HB3' ' A' ' 17' ' ' GLN . 72.8 t -73.83 -45.49 49.53 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 N-CA-C 113.447 0.906 . . . . 0.0 113.447 -177.778 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 22' ' ' CYS . . . . . 0.44 ' SG ' HD12 ' B' ' 18' ' ' LEU . 63.6 m . . . . . 0 C--N 1.328 -0.355 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 -178.4 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.581 ' HB2' ' CZ ' ' B' ' 14' ' ' PHE . 24.0 Cg_exo . . . . . 0 N--CA 1.463 -0.266 0 N-CA-C 112.853 0.29 . . . . 0.0 112.853 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.94 -47.12 83.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.212 0.529 . . . . 0.0 110.527 179.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.409 ' HA ' ' HD2' ' A' ' 8' ' ' ARG . 14.0 tpt85 -66.73 -48.07 70.33 Favored 'General case' 0 CA--C 1.511 -0.532 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.698 179.222 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 10.5 t80 -52.23 -57.07 10.8 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 114.33 -1.305 . . . . 0.0 112.0 -179.518 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.65 ' O ' ' HA2' ' A' ' 14' ' ' GLY . 18.1 t -66.25 -19.83 65.94 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -178.535 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.405 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 14.4 t -84.89 -53.08 5.55 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.641 0.734 . . . . 0.0 110.427 179.453 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 15.0 tp -72.28 -62.52 1.41 Allowed 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 114.89 -1.05 . . . . 0.0 111.923 -179.138 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 14.7 m -79.86 -28.25 40.02 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.339 -178.829 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.65 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 85.7 152.52 19.28 Favored Glycine 0 N--CA 1.445 -0.714 0 C-N-CA 120.669 -0.777 . . . . 0.0 111.84 -179.267 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 9.1 p -151.57 -163.05 1.66 Allowed 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 179.451 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.612 HG22 ' HB2' ' A' ' 19' ' ' ASP . 13.4 t -153.33 168.52 25.78 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 108.37 -0.974 . . . . 0.0 108.37 179.493 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.49 ' NE2' ' H ' ' A' ' 17' ' ' GLN . 0.0 OUTLIER -55.25 -48.27 74.21 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.616 0.246 . . . . 0.0 111.39 -178.858 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 8.7 mp0 -62.78 -38.07 89.15 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.475 179.712 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.612 ' HB2' HG22 ' A' ' 16' ' ' THR . 30.3 t70 -61.5 -44.03 97.8 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.782 179.371 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 67.9 mt -68.1 -39.91 82.72 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.258 178.687 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 49.9 tp -57.93 -43.55 86.35 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.704 179.469 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 36.3 p -69.61 0.77 4.9 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 120.964 0.411 . . . . 0.0 111.865 179.762 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 89.1 mt -117.01 9.92 13.82 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.007 179.241 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 75.4 m . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.331 -179.221 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . 0.4 ' HG2' ' N ' ' B' ' 8' ' ' LYS . 22.3 tt0 . . . . . 0 N--CA 1.448 -0.565 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . 0.444 ' HA ' ' O ' ' A' ' 10' ' ' CYS . 55.2 mttm -86.8 95.52 9.87 Favored 'General case' 0 C--N 1.312 -1.065 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 178.447 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . 0.739 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 2.8 mm? -76.65 57.08 1.21 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.81 -0.632 . . . . 0.0 112.249 -178.472 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 10' ' ' CYS . . . . . 0.442 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 93.7 m -74.26 124.91 27.3 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.158 179.313 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 52.25 -115.04 3.77 Favored Glycine 0 CA--C 1.519 0.304 0 CA-C-N 115.897 -0.592 . . . . 0.0 114.326 178.617 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 12' ' ' HIS . . . . . 0.424 ' O ' ' HG3' ' B' ' 16' ' ' ARG . 15.6 t-160 -51.29 -31.69 22.27 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 123.131 0.573 . . . . 0.0 112.396 -178.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 13' ' ' HIS . . . . . 0.672 ' HB3' ' HA ' ' B' ' 9' ' ' LEU . 27.0 m170 -62.39 -42.82 99.72 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 120.695 -0.402 . . . . 0.0 110.589 -179.67 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 14' ' ' PHE . . . . . . . . . . . . . 19.3 t80 -60.49 -38.85 85.61 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 178.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . 0.417 ' O ' HG23 ' B' ' 19' ' ' VAL . 65.1 t -60.97 -57.5 11.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.386 -0.825 . . . . 0.0 111.4 179.497 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . 0.492 ' HD3' ' N ' ' B' ' 17' ' ' ALA . 0.0 OUTLIER -63.85 -28.54 69.92 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 120.964 -0.295 . . . . 0.0 111.322 179.93 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . 0.698 ' HB1' HD13 ' A' ' 20' ' ' LEU . . . -63.75 -53.08 56.65 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.29 179.188 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 100.0 mt -60.77 -46.79 89.09 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.732 179.285 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 19' ' ' VAL . . . . . 0.645 HG12 ' HE ' ' B' ' 20' ' ' ARG . 71.8 t -58.43 -38.51 70.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.621 -0.718 . . . . 0.0 112.825 -179.35 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . 0.645 ' HE ' HG12 ' B' ' 19' ' ' VAL . 0.0 OUTLIER -93.27 -43.75 8.65 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 -178.171 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 94.7 t -70.7 -40.82 77.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -178.75 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 52.5 m . . . . . 0 C--N 1.323 -0.558 0 C-N-CA 120.907 -0.317 . . . . 0.0 111.538 -179.126 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.565 ' HB3' HD13 ' A' ' 23' ' ' LEU . 27.8 Cg_exo . . . . . 0 CA--C 1.527 0.136 0 N-CA-C 113.487 0.533 . . . . 0.0 113.487 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -58.73 -44.86 90.57 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.402 0.62 . . . . 0.0 110.408 179.781 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.455 ' HD3' ' HA ' ' A' ' 8' ' ' ARG . 12.0 mmt85 -67.47 -45.48 75.81 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.698 178.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 26.9 t80 -58.44 -48.73 79.76 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.088 179.784 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.739 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 61.9 m -65.9 -23.42 66.63 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.968 -179.811 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.442 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 37.6 t -88.2 -59.58 2.2 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.433 0.635 . . . . 0.0 110.475 179.531 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 13.0 tp -55.3 -54.2 46.5 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.848 -1.069 . . . . 0.0 111.083 -179.629 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 14.3 m -96.48 -59.52 1.81 Allowed 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.977 -179.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.696 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 121.48 156.14 9.67 Favored Glycine 0 N--CA 1.452 -0.29 0 N-CA-C 110.82 -0.912 . . . . 0.0 110.82 -179.692 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.683 ' SG ' HD23 ' B' ' 9' ' ' LEU . 31.3 p -150.56 155.75 40.05 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 117.546 0.673 . . . . 0.0 111.574 -178.985 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 72.8 p -91.01 -173.28 3.61 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.017 -179.495 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 -69.14 -40.13 78.43 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 177.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 62.6 mt-30 -65.79 -39.55 91.07 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.535 178.674 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.589 ' CB ' ' HB2' ' A' ' 15' ' ' CYS . 38.5 m-20 -59.51 -47.19 86.48 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 178.212 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.698 HD13 ' HB1' ' B' ' 17' ' ' ALA . 30.6 mt -63.8 -45.99 87.19 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.804 179.026 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -55.04 -45.14 75.19 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.237 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 23.9 m -60.93 -25.04 66.49 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.557 179.658 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.565 HD13 ' HB3' ' A' ' 6' ' ' PRO . 85.2 mt -79.48 -24.64 42.22 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.593 179.301 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 56.5 m . . . . . 0 C--N 1.325 -0.481 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.126 -179.623 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 1' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo . . . . . 0 N--CA 1.478 0.612 0 N-CA-C 110.435 -0.64 . . . . 0.0 110.435 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 2' ' ' THR . . . . . 0.653 ' O ' ' HG2' ' B' ' 4' ' ' GLU . 0.2 OUTLIER -152.55 176.12 2.57 Favored Pre-proline 0 C--N 1.32 -0.702 0 CA-C-N 115.171 -0.922 . . . . 0.0 108.958 -178.761 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . 0.567 ' HD2' ' HB ' ' B' ' 2' ' ' THR . 57.0 Cg_endo -69.91 53.34 1.13 Allowed 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 122.645 2.23 . . . . 0.0 111.69 179.214 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . 0.653 ' HG2' ' O ' ' B' ' 2' ' ' THR . 5.9 pt-20 -79.22 142.27 36.39 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 114.175 -1.375 . . . . 0.0 111.817 -178.824 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 5' ' ' MET . . . . . . . . . . . . . 59.5 ttp -84.8 129.45 34.82 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.683 179.234 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 6' ' ' ARG . . . . . 0.646 ' HG2' HG23 ' A' ' 16' ' ' THR . 52.5 mtt180 -64.15 122.6 16.99 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.186 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 -88.46 133.07 34.23 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 179.384 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 65.5 mttm -72.97 97.15 2.24 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.643 0.735 . . . . 0.0 109.324 179.261 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . 0.769 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 61.1 mt -79.1 56.22 1.97 Allowed 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 114.85 -1.068 . . . . 0.0 113.295 -177.407 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 10' ' ' CYS . . . . . 0.496 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 88.8 m -74.06 125.09 27.54 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.266 178.42 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 61.05 -126.47 40.65 Favored Glycine 0 N--CA 1.452 -0.296 0 CA-C-N 116.075 -0.511 . . . . 0.0 113.697 179.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 12' ' ' HIS . . . . . 0.597 ' O ' ' HG2' ' B' ' 16' ' ' ARG . 16.0 t-160 -55.01 -25.73 32.22 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -179.117 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 13' ' ' HIS . . . . . 0.603 ' HB3' ' HA ' ' B' ' 9' ' ' LEU . 51.6 m170 -56.12 -42.16 76.43 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.908 -0.317 . . . . 0.0 111.03 -179.255 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 14' ' ' PHE . . . . . 0.583 ' HA ' ' HB3' ' B' ' 9' ' ' LEU . 36.0 t80 -60.18 -45.83 91.79 Favored 'General case' 0 C--N 1.328 -0.34 0 O-C-N 123.43 0.456 . . . . 0.0 110.235 178.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . 0.563 ' O ' HG23 ' B' ' 19' ' ' VAL . 93.1 t -59.12 -56.89 14.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.496 -0.774 . . . . 0.0 112.228 -179.777 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . 0.597 ' HG2' ' O ' ' B' ' 12' ' ' HIS . 1.9 ptm180 -60.0 -38.56 82.97 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 120.736 0.303 . . . . 0.0 111.603 -179.727 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . 0.817 ' HA ' ' HE ' ' B' ' 20' ' ' ARG . . . -66.43 -41.57 88.99 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.823 0.344 . . . . 0.0 110.381 179.31 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 18' ' ' LEU . . . . . 0.898 ' HG ' ' HE1' ' B' ' 27' ' ' TRP . 53.0 tp -58.02 -45.44 86.89 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.727 179.056 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 19' ' ' VAL . . . . . 0.563 HG23 ' O ' ' B' ' 15' ' ' VAL . 40.6 t -62.39 -44.77 99.58 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.609 178.885 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . 0.817 ' HE ' ' HA ' ' B' ' 17' ' ' ALA . 81.5 mtm180 -57.0 -50.18 73.5 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.67 -0.696 . . . . 0.0 112.801 -179.309 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 21' ' ' VAL . . . . . 0.54 HG22 ' HG3' ' A' ' 17' ' ' GLN . 74.2 t -76.84 -53.19 15.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 N-CA-C 113.888 1.07 . . . . 0.0 113.888 -177.131 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 81.9 m -65.61 -43.53 89.36 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 111.94 0.348 . . . . 0.0 111.94 -178.103 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 144.97 125.4 1.8 Allowed Glycine 0 N--CA 1.446 -0.668 0 C-N-CA 120.177 -1.011 . . . . 0.0 112.755 179.755 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -63.86 -58.92 9.46 Favored Glycine 0 CA--C 1.522 0.492 0 C-N-CA 121.128 -0.558 . . . . 0.0 112.668 179.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_exo -72.04 57.57 2.68 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 123.052 2.501 . . . . 0.0 112.799 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -166.26 -34.06 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.339 179.582 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 27' ' ' TRP . . . . . 0.898 ' HE1' ' HG ' ' B' ' 18' ' ' LEU . 0.1 OUTLIER -75.41 58.67 1.01 Allowed 'General case' 0 CA--C 1.507 -0.688 0 CA-C-O 122.837 1.303 . . . . 0.0 111.032 -179.701 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 23.0 t -93.66 23.99 4.36 Favored 'General case' 0 C--N 1.3 -1.555 0 CA-C-N 112.622 -2.081 . . . . 0.0 110.636 -179.371 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 11.4 t -178.55 -33.0 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.08 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -86.46 32.04 0.65 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.71 -178.852 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 31' ' ' ALA . . . . . 0.52 ' HB2' ' CD1' ' B' ' 27' ' ' TRP . . . . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.578 -0.725 . . . . 0.0 109.863 -179.623 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.138 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -69.36 148.6 49.45 Favored 'General case' 0 C--N 1.328 -0.343 0 O-C-N 123.171 0.294 . . . . 0.0 110.607 179.423 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -168.24 122.31 0.92 Allowed 'General case' 0 N--CA 1.45 -0.425 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.6 m -75.29 54.72 0.73 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.859 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -173.73 116.11 0.35 Allowed Pre-proline 0 C--N 1.325 -0.467 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 -179.419 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -57.08 -48.36 18.52 Favored 'Trans proline' 0 CA--C 1.528 0.181 0 C-N-CA 123.132 2.555 . . . . 0.0 113.473 -178.509 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -59.3 -42.78 92.13 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.309 0.576 . . . . 0.0 110.456 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 5.7 tpt85 -67.89 -45.8 73.43 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.973 179.273 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 32.0 t80 -57.39 -47.46 81.62 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 114.78 -1.1 . . . . 0.0 110.78 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.769 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 89.3 m -65.45 -30.8 71.63 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.139 179.813 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.496 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 26.7 t -75.87 -57.18 4.03 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.583 0.706 . . . . 0.0 110.706 179.63 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 92.8 mt -59.91 -55.93 28.01 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 114.932 -1.031 . . . . 0.0 112.1 -179.3 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.2 m -92.02 -63.65 1.21 Allowed 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.194 -179.373 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.571 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 133.85 158.07 8.48 Favored Glycine 0 N--CA 1.451 -0.345 0 N-CA-C 110.686 -0.966 . . . . 0.0 110.686 -179.521 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 93.2 m -140.33 145.16 36.84 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 117.43 0.615 . . . . 0.0 111.79 -179.449 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.646 HG23 ' HG2' ' B' ' 6' ' ' ARG . 63.5 p -100.89 -168.64 1.59 Allowed 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.544 179.702 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.54 ' HG3' HG22 ' B' ' 21' ' ' VAL . 49.8 tt0 -69.78 -41.4 75.18 Favored 'General case' 0 CA--C 1.512 -0.487 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 177.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 66.7 tp60 -62.96 -45.92 90.15 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.801 179.197 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 63.1 m-20 -57.04 -46.72 82.2 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.326 -0.852 . . . . 0.0 109.9 179.177 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.534 HD11 ' HB1' ' B' ' 17' ' ' ALA . 54.7 mt -69.11 -39.81 78.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.925 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 30.3 tp -58.42 -39.45 79.8 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.99 0.424 . . . . 0.0 110.539 -179.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.6 m -63.99 -21.38 66.47 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.062 179.408 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -97.69 -4.43 37.31 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.685 179.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.433 ' HA ' ' HD3' ' A' ' 25' ' ' PRO . 93.1 m -72.51 132.77 83.38 Favored Pre-proline 0 C--N 1.33 -0.251 0 CA-C-O 121.075 0.465 . . . . 0.0 110.831 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 24' ' ' CYS . 73.0 Cg_endo -93.72 -160.72 0.08 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.136 0 C-N-CA 123.474 2.783 . . . . 0.0 112.28 179.777 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 3.2 p90 . . . . . 0 C--O 1.247 0.95 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.995 178.844 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 1' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo . . . . . 0 N--CA 1.483 0.866 0 N-CA-C 110.699 -0.539 . . . . 0.0 110.699 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 2' ' ' THR . . . . . 0.422 ' HA ' ' HD3' ' B' ' 3' ' ' PRO . 11.1 m -90.4 134.82 30.41 Favored Pre-proline 0 C--N 1.318 -0.764 0 CA-C-N 115.3 -0.864 . . . . 0.0 110.144 179.832 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' B' ' 2' ' ' THR . 32.8 Cg_exo -58.64 115.2 2.38 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.646 2.231 . . . . 0.0 111.922 -179.633 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . 0.719 ' HG2' ' H ' ' B' ' 5' ' ' MET . 35.1 tt0 -176.28 -169.04 0.28 Allowed 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 -179.281 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 5' ' ' MET . . . . . 0.719 ' H ' ' HG2' ' B' ' 4' ' ' GLU . 26.4 ttt -82.98 112.92 20.19 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 178.661 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 6' ' ' ARG . . . . . 0.992 ' HG2' HG23 ' A' ' 16' ' ' THR . 40.2 mtp85 -86.81 111.16 20.48 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.951 -0.388 . . . . 0.0 109.951 179.863 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -88.32 129.73 35.31 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.287 -0.635 . . . . 0.0 109.287 179.326 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . 0.447 ' HA ' ' O ' ' A' ' 10' ' ' CYS . 65.6 mttm -73.98 94.82 2.4 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 178.818 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . 0.729 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 28.7 mt -76.18 55.33 0.94 Allowed 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 114.794 -1.093 . . . . 0.0 113.93 -176.643 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 10' ' ' CYS . . . . . 0.445 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 75.1 m -74.87 117.69 17.0 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 177.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 61.18 -121.64 27.02 Favored Glycine 0 CA--C 1.521 0.411 0 C-N-CA 121.09 -0.576 . . . . 0.0 113.695 179.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 14.8 t-160 -53.47 -28.67 31.79 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -178.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 13' ' ' HIS . . . . . 0.624 ' CB ' ' HA ' ' B' ' 9' ' ' LEU . 49.6 m170 -58.37 -40.71 83.04 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.766 -0.373 . . . . 0.0 110.707 -179.288 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 14' ' ' PHE . . . . . 0.653 ' HA ' HD13 ' B' ' 9' ' ' LEU . 21.4 t80 -58.55 -45.79 88.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.347 0.594 . . . . 0.0 109.8 178.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . 0.541 ' O ' HG23 ' B' ' 19' ' ' VAL . 94.6 t -63.04 -53.76 42.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.892 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . 0.605 ' O ' ' HG3' ' B' ' 20' ' ' ARG . 0.0 OUTLIER -61.27 -40.35 93.76 Favored 'General case' 0 N--CA 1.462 0.154 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 -179.038 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.41 -41.05 89.85 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 121.027 -0.269 . . . . 0.0 110.436 179.41 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 10.7 mt -56.45 -49.81 73.53 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.342 178.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 19' ' ' VAL . . . . . 0.541 HG23 ' O ' ' B' ' 15' ' ' VAL . 11.5 t -64.95 -38.07 81.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.748 179.691 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . 0.605 ' HG3' ' O ' ' B' ' 16' ' ' ARG . 33.4 mtm105 -62.07 -51.99 65.73 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 49.1 t -73.46 -53.95 16.72 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 -177.295 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 60.3 m -63.63 -52.34 61.26 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 121.182 -0.207 . . . . 0.0 110.918 -178.605 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 49.46 -132.55 25.95 Favored Glycine 0 C--N 1.333 0.411 0 CA-C-N 116.137 -0.483 . . . . 0.0 113.714 178.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 64.87 -150.91 51.47 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 121.618 -0.325 . . . . 0.0 112.716 179.846 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -76.76 -31.8 3.86 Favored 'Trans proline' 0 N--CA 1.464 -0.241 0 C-N-CA 122.652 2.234 . . . . 0.0 111.886 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . 0.471 ' HB2' ' C ' ' B' ' 31' ' ' ALA . 7.5 ptm180 -171.93 178.51 2.97 Favored 'General case' 0 N--CA 1.443 -0.807 0 N-CA-C 107.842 -1.169 . . . . 0.0 107.842 179.778 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 27' ' ' TRP . . . . . 0.654 ' HD1' ' HD2' ' A' ' 25' ' ' PRO . 0.0 OUTLIER -154.28 -18.93 0.13 Allowed 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 -178.142 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 84.2 p -157.58 -146.2 0.16 Allowed 'General case' 0 C--N 1.318 -0.786 0 C-N-CA 119.304 -0.958 . . . . 0.0 113.308 -177.398 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -83.42 -33.66 25.66 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 114.879 -1.055 . . . . 0.0 109.501 -179.878 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 6.6 mp0 -67.84 -29.54 68.71 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 114.623 -1.172 . . . . 0.0 109.519 179.352 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 31' ' ' ALA . . . . . 0.471 ' C ' ' HB2' ' B' ' 26' ' ' ARG . . . . . . . . 0 C--O 1.25 1.082 0 CA-C-N 114.694 -1.139 . . . . 0.0 108.917 179.486 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.057 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -159.53 135.17 8.5 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 123.365 0.416 . . . . 0.0 110.268 -179.723 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -161.17 55.21 0.29 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.243 0.545 . . . . 0.0 110.13 -179.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.5 m -73.83 60.64 0.73 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.307 -0.86 . . . . 0.0 111.185 -179.74 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -170.09 116.05 0.5 Allowed Pre-proline 0 C--N 1.323 -0.55 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 -179.68 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -57.12 -47.86 20.76 Favored 'Trans proline' 0 C--O 1.226 -0.116 0 C-N-CA 123.205 2.603 . . . . 0.0 113.262 -178.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -58.07 -40.98 82.43 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.169 0.509 . . . . 0.0 110.116 179.491 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 43.6 ttt85 -64.61 -54.69 27.93 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.134 178.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 26.7 t80 -56.04 -48.44 75.99 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 114.162 -1.381 . . . . 0.0 111.284 -179.583 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.729 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 91.0 m -64.6 -30.03 71.05 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.551 -179.834 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.445 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 35.5 t -77.83 -57.87 3.57 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.336 0.588 . . . . 0.0 110.641 179.708 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 88.6 mt -57.13 -58.69 7.09 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 114.94 -1.027 . . . . 0.0 111.976 -179.117 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 34.6 t -92.56 -63.21 1.26 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 120.927 0.394 . . . . 0.0 110.672 -179.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.628 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 132.01 155.73 8.1 Favored Glycine 0 N--CA 1.446 -0.691 0 N-CA-C 110.56 -1.016 . . . . 0.0 110.56 -179.454 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 90.8 m -131.85 135.48 46.74 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 117.191 0.495 . . . . 0.0 111.097 -179.186 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.992 HG23 ' HG2' ' B' ' 6' ' ' ARG . 31.4 p -80.6 170.07 16.81 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.054 179.372 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 23.2 mt-30 -66.62 -40.49 88.83 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 178.243 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.458 ' HG2' ' OE1' ' B' ' 4' ' ' GLU . 77.6 mm-40 -63.16 -43.53 98.05 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 178.593 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -58.82 -43.5 90.63 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.947 178.826 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.683 HD11 HD11 ' B' ' 9' ' ' LEU . 96.9 mt -69.41 -41.75 75.98 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.275 179.464 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 40.8 tp -57.55 -44.04 84.88 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.216 0.531 . . . . 0.0 110.55 -179.727 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.1 m -64.49 -16.63 62.83 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.219 179.615 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 23.8 tp -113.61 16.61 18.64 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.321 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.462 ' HA ' ' HD3' ' A' ' 25' ' ' PRO . 43.5 m -76.34 129.02 81.21 Favored Pre-proline 0 C--N 1.332 -0.191 0 C-N-CA 120.208 -0.597 . . . . 0.0 111.015 179.375 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.654 ' HD2' ' HD1' ' B' ' 27' ' ' TRP . 55.6 Cg_endo -90.29 -157.43 0.06 OUTLIER 'Trans proline' 0 N--CA 1.451 -1.029 0 C-N-CA 123.798 2.999 . . . . 0.0 111.402 178.806 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 5.1 t80 . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.167 -0.92 . . . . 0.0 109.672 179.09 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 1' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo . . . . . 0 N--CA 1.484 0.928 0 N-CA-C 110.394 -0.656 . . . . 0.0 110.394 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -149.69 153.68 36.79 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.483 -179.166 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -71.71 55.13 2.12 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.849 2.366 . . . . 0.0 113.665 -179.004 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -91.96 138.27 31.68 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.9 179.148 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 5' ' ' MET . . . . . . . . . . . . . 70.1 mtm -82.37 -169.51 2.47 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.055 0.455 . . . . 0.0 110.957 -179.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 6' ' ' ARG . . . . . 0.597 ' HA ' ' HB ' ' A' ' 16' ' ' THR . 0.2 OUTLIER -70.11 135.17 48.93 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.108 179.327 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . 0.42 ' HG2' ' N ' ' B' ' 8' ' ' LYS . 26.3 tt0 -148.99 150.92 33.65 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.037 0.446 . . . . 0.0 111.028 -178.699 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . 0.42 ' N ' ' HG2' ' B' ' 7' ' ' GLU . 47.3 mttm -79.48 98.22 6.73 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 177.572 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . 0.918 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 38.6 mt -78.89 57.45 2.14 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 112.805 0.669 . . . . 0.0 112.805 -177.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 10' ' ' CYS . . . . . 0.438 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 80.1 m -72.66 124.22 24.85 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.03 178.638 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 61.28 -124.3 34.66 Favored Glycine 0 CA--C 1.52 0.382 0 C-N-CA 121.334 -0.46 . . . . 0.0 114.077 179.272 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 23.5 t-160 -51.99 -31.2 28.33 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 123.233 0.613 . . . . 0.0 112.634 -178.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 13' ' ' HIS . . . . . 0.616 ' HB3' ' HA ' ' B' ' 9' ' ' LEU . 43.2 m170 -57.09 -42.64 81.09 Favored 'General case' 0 C--N 1.32 -0.712 0 C-N-CA 120.714 -0.395 . . . . 0.0 110.793 -179.339 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 14' ' ' PHE . . . . . 0.566 ' HA ' HD13 ' B' ' 9' ' ' LEU . 54.7 t80 -61.39 -46.26 90.9 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.183 0.516 . . . . 0.0 109.866 178.61 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . 0.468 ' O ' HG23 ' B' ' 19' ' ' VAL . 40.5 t -59.82 -52.35 62.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.276 -0.874 . . . . 0.0 111.674 -179.754 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . 0.681 ' HG3' ' N ' ' B' ' 17' ' ' ALA . 0.1 OUTLIER -58.65 -45.29 89.65 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.084 -178.936 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . 0.681 ' N ' ' HG3' ' B' ' 16' ' ' ARG . . . -68.41 -42.94 78.25 Favored 'General case' 0 C--O 1.218 -0.589 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.445 -179.453 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 50.2 tp -55.09 -51.1 67.45 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.731 0.301 . . . . 0.0 110.455 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 19' ' ' VAL . . . . . 0.468 HG23 ' O ' ' B' ' 15' ' ' VAL . 59.2 t -60.75 -44.82 98.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.048 179.337 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 65.7 mtp85 -66.33 -47.93 71.92 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 -179.344 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 21' ' ' VAL . . . . . 0.542 HG23 ' O ' ' B' ' 17' ' ' ALA . 95.5 t -62.01 -61.13 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 -178.882 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 68.2 m -90.4 41.16 1.04 Allowed 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.153 0.501 . . . . 0.0 111.424 -178.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 169.62 -122.22 0.98 Allowed Glycine 0 N--CA 1.443 -0.872 0 C-N-CA 120.889 -0.672 . . . . 0.0 112.039 179.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 178.04 -117.41 0.58 Allowed Glycine 0 N--CA 1.446 -0.645 0 N-CA-C 110.965 -0.854 . . . . 0.0 110.965 179.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -79.5 17.81 1.19 Allowed 'Trans proline' 0 CA--C 1.528 0.188 0 C-N-CA 122.651 2.234 . . . . 0.0 111.796 178.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' B' ' 26' ' ' ARG . 8.8 mmm180 -155.49 140.43 17.28 Favored 'General case' 0 CA--C 1.499 -0.983 0 CA-C-N 115.156 -0.929 . . . . 0.0 109.992 179.829 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 27' ' ' TRP . . . . . 0.716 ' HA ' ' CE3' ' B' ' 27' ' ' TRP . 0.0 OUTLIER -98.03 49.92 1.02 Allowed 'General case' 0 C--N 1.305 -1.329 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 177.596 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 1.9 p -63.56 62.97 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 114.929 -1.032 . . . . 0.0 113.284 -178.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 48.5 m -169.84 -37.61 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.71 0 C-N-CA 124.034 0.934 . . . . 0.0 108.585 179.805 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 30' ' ' GLU . . . . . 0.501 ' HB3' ' NE1' ' B' ' 27' ' ' TRP . 35.9 tt0 -127.77 -31.09 2.46 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 114.975 -1.011 . . . . 0.0 111.315 -178.534 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 31' ' ' ALA . . . . . 0.557 ' HB3' ' HB3' ' B' ' 27' ' ' TRP . . . . . . . . 0 C--O 1.251 1.182 0 CA-C-O 118.727 -0.654 . . . . 0.0 111.268 -179.064 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.095 0 N-CA-C 110.381 -0.229 . . . . 0.0 110.381 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -72.13 143.37 49.0 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.318 179.743 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.607 ' HB1' ' HD3' ' A' ' 8' ' ' ARG . . . -168.62 122.75 0.88 Allowed 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 120.824 0.345 . . . . 0.0 110.216 -179.812 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.7 m -74.23 60.66 0.83 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.649 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -169.14 117.14 0.57 Allowed Pre-proline 0 C--N 1.324 -0.54 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 -179.174 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_exo -55.3 -49.14 17.25 Favored 'Trans proline' 0 CA--C 1.528 0.203 0 C-N-CA 123.37 2.713 . . . . 0.0 113.666 -178.399 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -59.27 -42.77 91.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.401 0.619 . . . . 0.0 110.303 179.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.607 ' HD3' ' HB1' ' A' ' 3' ' ' ALA . 25.0 ttt85 -65.74 -49.08 69.7 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.188 -0.915 . . . . 0.0 109.944 179.178 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 13.6 t80 -55.85 -48.17 75.99 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.833 -1.076 . . . . 0.0 110.889 179.534 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.918 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 69.0 m -63.69 -27.73 69.41 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.789 -0.641 . . . . 0.0 112.083 -179.748 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.438 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 52.7 t -86.56 -59.71 2.2 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.311 0.577 . . . . 0.0 110.792 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 53.2 mt -54.66 -51.6 64.96 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.158 -0.928 . . . . 0.0 111.785 -179.64 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 9.7 m -99.68 -63.07 1.16 Allowed 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 120.989 0.423 . . . . 0.0 110.546 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.634 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 127.67 149.62 7.17 Favored Glycine 0 N--CA 1.448 -0.503 0 N-CA-C 110.216 -1.154 . . . . 0.0 110.216 -179.403 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.684 ' HB2' ' CB ' ' A' ' 19' ' ' ASP . 28.3 p -144.07 -157.93 0.83 Allowed 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 117.485 0.642 . . . . 0.0 110.292 -179.01 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.631 ' H ' ' HB2' ' A' ' 19' ' ' ASP . 14.3 t -171.32 -162.77 0.25 Allowed 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 110.321 -0.251 . . . . 0.0 110.321 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.489 ' CD ' HG22 ' B' ' 21' ' ' VAL . 53.2 mm-40 -57.55 -50.29 73.57 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.674 -179.25 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 11.4 mm100 -62.02 -43.65 98.39 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.853 0.359 . . . . 0.0 110.852 -179.523 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.684 ' CB ' ' HB2' ' A' ' 15' ' ' CYS . 2.9 m-20 -58.16 -41.6 84.16 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.459 179.443 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.452 HD12 HG21 ' B' ' 21' ' ' VAL . 69.0 mt -78.78 -40.36 33.36 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 -179.376 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 21.2 tp -56.59 -44.29 80.94 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.561 -179.456 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 19.1 m -60.34 -22.93 63.81 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.597 179.716 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 94.2 mt -80.6 -26.79 37.63 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.157 179.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.445 ' HA ' ' HD3' ' A' ' 25' ' ' PRO . 97.9 m -86.96 139.5 32.72 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-O 121.082 0.468 . . . . 0.0 111.159 -179.62 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' A' ' 24' ' ' CYS . 40.0 Cg_endo -85.68 137.54 5.76 Favored 'Trans proline' 0 N--CA 1.45 -1.056 0 C-N-CA 123.257 2.638 . . . . 0.0 112.604 -179.584 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.247 0.922 0 CA-C-N 114.979 -1.01 . . . . 0.0 109.255 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 1' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo . . . . . 0 N--CA 1.481 0.757 0 N-CA-C 110.078 -0.778 . . . . 0.0 110.078 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -72.96 132.65 82.61 Favored Pre-proline 0 C--N 1.323 -0.582 0 O-C-N 123.389 0.431 . . . . 0.0 111.104 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -71.1 137.29 31.28 Favored 'Trans proline' 0 C--O 1.233 0.245 0 C-N-CA 122.585 2.19 . . . . 0.0 112.086 -179.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . 0.668 ' OE1' ' HB ' ' A' ' 16' ' ' THR . 1.4 mm-40 -71.88 143.66 49.29 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.201 0.524 . . . . 0.0 111.385 179.764 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 5' ' ' MET . . . . . 0.404 ' O ' ' HA ' ' A' ' 16' ' ' THR . 13.0 tpt -164.49 128.49 2.55 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 114.974 -1.012 . . . . 0.0 109.858 179.854 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 6' ' ' ARG . . . . . 0.649 ' NH1' ' HA ' ' A' ' 15' ' ' CYS . 54.0 ttm-85 -89.51 101.83 14.51 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 179.72 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 78.5 tt0 -98.71 144.65 27.73 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-O 121.304 0.573 . . . . 0.0 110.75 -179.123 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 21.8 mmmt -78.48 91.95 4.59 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 107.392 -1.336 . . . . 0.0 107.392 177.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . 1.02 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 16.5 mt -75.56 57.74 0.98 Allowed 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 113.722 1.008 . . . . 0.0 113.722 -176.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 10' ' ' CYS . . . . . 0.424 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 87.8 m -77.18 123.11 25.96 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 178.028 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 64.11 -125.26 31.82 Favored Glycine 0 CA--C 1.521 0.451 0 C-N-CA 121.204 -0.522 . . . . 0.0 113.865 179.629 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 22.7 t-160 -52.24 -32.03 35.03 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 112.779 0.659 . . . . 0.0 112.779 -178.574 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 13' ' ' HIS . . . . . 0.621 ' HB3' ' HA ' ' B' ' 9' ' ' LEU . 41.0 m170 -56.41 -43.06 78.98 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 120.766 -0.374 . . . . 0.0 110.996 -179.312 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 14' ' ' PHE . . . . . 0.828 ' HA ' HD13 ' B' ' 9' ' ' LEU . 35.4 t80 -61.21 -45.73 93.38 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.176 0.513 . . . . 0.0 109.987 178.867 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 43.4 t -59.87 -51.52 71.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 115.292 -0.867 . . . . 0.0 111.866 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . 0.581 ' HG3' ' N ' ' B' ' 17' ' ' ALA . 10.7 ptt180 -62.22 -45.19 94.46 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.303 0.483 . . . . 0.0 112.303 -178.361 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . 0.581 ' N ' ' HG3' ' B' ' 16' ' ' ARG . . . -67.95 -48.27 66.34 Favored 'General case' 0 C--O 1.223 -0.324 0 N-CA-C 111.749 0.277 . . . . 0.0 111.749 -178.838 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 39.0 tp -57.01 -50.83 71.53 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.078 0.466 . . . . 0.0 110.898 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 19' ' ' VAL . . . . . 0.56 ' HA ' ' CZ2' ' B' ' 27' ' ' TRP . 46.5 t -60.56 -48.29 89.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.698 -0.683 . . . . 0.0 112.635 -179.565 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . 0.485 ' CZ ' ' HA ' ' B' ' 20' ' ' ARG . 0.1 OUTLIER -75.0 -39.3 61.31 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 113.956 1.095 . . . . 0.0 113.956 -178.145 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 21' ' ' VAL . . . . . 0.442 HG11 ' O ' ' A' ' 17' ' ' GLN . 70.0 t -71.12 -46.04 68.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -178.436 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 91.9 m -64.45 -67.26 0.45 Allowed 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.332 -0.547 . . . . 0.0 111.519 -179.041 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.62 -52.6 0.49 Allowed Glycine 0 CA--C 1.528 0.881 0 N-CA-C 114.564 0.586 . . . . 0.0 114.564 178.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -54.45 -61.15 7.55 Favored Glycine 0 C--N 1.333 0.369 0 CA-C-O 119.961 -0.355 . . . . 0.0 113.251 -179.304 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 25' ' ' PRO . . . . . 0.645 ' HG3' ' HB3' ' A' ' 24' ' ' CYS . 37.2 Cg_endo -66.53 157.76 59.04 Favored 'Trans proline' 0 N--CA 1.457 -0.654 0 C-N-CA 122.049 1.833 . . . . 0.0 110.853 178.907 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . 0.85 ' HB3' ' HA ' ' B' ' 31' ' ' ALA . 22.5 mmm180 -122.62 128.18 50.32 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 -179.934 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 27' ' ' TRP . . . . . 0.56 ' CZ2' ' HA ' ' B' ' 19' ' ' VAL . 13.2 p90 -158.62 -45.35 0.06 Allowed 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -178.183 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 9.8 t -105.92 -138.76 0.37 Allowed 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.881 -178.543 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 5.0 t -56.47 -31.1 63.69 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.531 -0.915 . . . . 0.0 108.531 178.128 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 30' ' ' GLU . . . . . 0.565 ' O ' ' HA ' ' B' ' 26' ' ' ARG . 30.2 mm-40 -84.28 70.63 10.62 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 114.708 -1.133 . . . . 0.0 108.432 176.719 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 31' ' ' ALA . . . . . 0.85 ' HA ' ' HB3' ' B' ' 26' ' ' ARG . . . . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.104 -0.95 . . . . 0.0 109.87 -179.422 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.078 0 N-CA-C 110.163 -0.31 . . . . 0.0 110.163 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -71.79 130.84 42.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.445 0.164 . . . . 0.0 110.582 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -173.62 129.5 0.42 Allowed 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 116.231 -0.44 . . . . 0.0 109.874 -179.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 10.2 t -62.64 -23.43 67.08 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.567 179.596 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -158.7 105.63 1.62 Allowed Pre-proline 0 C--N 1.323 -0.554 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 178.774 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.509 ' HB3' HD13 ' A' ' 23' ' ' LEU . 35.3 Cg_exo -58.72 -44.19 38.44 Favored 'Trans proline' 0 C--N 1.334 -0.22 0 C-N-CA 123.67 2.913 . . . . 0.0 113.693 -178.256 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.45 -45.22 85.0 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.225 0.536 . . . . 0.0 110.733 -179.804 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.427 ' HD2' ' HA ' ' A' ' 8' ' ' ARG . 10.3 tpt85 -70.01 -48.38 58.3 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.333 179.541 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 19.7 t80 -54.86 -52.53 62.49 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.945 -1.025 . . . . 0.0 111.52 -179.481 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 1.02 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 33.5 m -63.47 -32.47 73.93 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.049 -0.523 . . . . 0.0 112.198 -179.497 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.424 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 37.4 t -77.14 -57.06 4.05 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.453 0.644 . . . . 0.0 111.015 179.867 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 14.0 tp -62.48 -60.9 2.89 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 114.938 -1.028 . . . . 0.0 112.139 -178.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 9.2 m -86.02 -50.52 6.99 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.851 -178.495 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.597 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 111.16 155.41 13.63 Favored Glycine 0 N--CA 1.451 -0.35 0 N-CA-C 110.036 -1.226 . . . . 0.0 110.036 -178.543 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.703 ' HB2' ' HB3' ' A' ' 19' ' ' ASP . 18.3 p -146.0 153.92 41.31 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 118.255 1.027 . . . . 0.0 112.859 -178.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.668 ' HB ' ' OE1' ' B' ' 4' ' ' GLU . 59.7 p -95.97 -179.46 4.7 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.693 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.61 ' HG2' ' OE1' ' B' ' 4' ' ' GLU . 19.8 pt20 -61.59 -44.91 96.14 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 120.679 0.276 . . . . 0.0 110.983 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 55.6 mt-30 -63.06 -36.87 85.01 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.475 0.655 . . . . 0.0 109.697 179.072 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.703 ' HB3' ' HB2' ' A' ' 15' ' ' CYS . 5.5 t0 -61.6 -42.48 98.93 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.809 -1.087 . . . . 0.0 109.481 179.416 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.695 HD21 HD11 ' B' ' 9' ' ' LEU . 1.6 mm? -67.67 -46.26 72.88 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 121.055 0.455 . . . . 0.0 110.513 177.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 26.3 tp -55.39 -47.4 75.91 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.406 -178.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.8 p -65.01 -9.95 25.76 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 -179.755 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.523 ' HG ' ' O ' ' A' ' 19' ' ' ASP . 95.7 mt -85.32 -24.76 27.52 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.79 0.329 . . . . 0.0 110.459 179.164 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.645 ' HB3' ' HG3' ' B' ' 25' ' ' PRO . 51.4 m -85.59 139.31 35.63 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-O 120.874 0.369 . . . . 0.0 111.475 -179.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.474 ' HD3' ' HA ' ' A' ' 24' ' ' CYS . 10.6 Cg_endo -84.96 132.21 4.58 Favored 'Trans proline' 0 N--CA 1.448 -1.191 0 C-N-CA 123.274 2.649 . . . . 0.0 111.912 179.512 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.251 1.138 0 CA-C-O 117.393 -1.289 . . . . 0.0 109.351 179.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 1' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo . . . . . 0 N--CA 1.481 0.765 0 N-CA-C 110.666 -0.552 . . . . 0.0 110.666 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 2' ' ' THR . . . . . 0.541 ' HB ' ' HD2' ' B' ' 3' ' ' PRO . 0.7 OUTLIER -157.67 170.75 8.42 Favored Pre-proline 0 C--N 1.319 -0.726 0 CA-C-N 115.194 -0.912 . . . . 0.0 109.147 -179.027 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . 0.541 ' HD2' ' HB ' ' B' ' 2' ' ' THR . 58.6 Cg_endo -71.35 57.52 2.26 Favored 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 122.636 2.224 . . . . 0.0 111.383 179.077 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -65.58 133.91 52.19 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 114.187 -1.37 . . . . 0.0 111.8 -178.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 5' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.23 136.63 32.86 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.06 178.473 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 6' ' ' ARG . . . . . 0.685 ' HD2' HG23 ' A' ' 16' ' ' THR . 26.2 mmm180 -70.14 104.25 2.55 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . 0.414 ' CD ' HH21 ' B' ' 16' ' ' ARG . 40.0 tt0 -84.67 132.89 34.42 Favored 'General case' 0 CA--C 1.508 -0.643 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 -179.906 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -74.93 93.25 2.65 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 178.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . 0.908 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 2.5 mp -75.41 53.55 0.68 Allowed 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.627 -0.715 . . . . 0.0 112.906 -177.683 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 80.6 m -75.31 124.6 27.37 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.007 178.472 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 60.08 -120.87 24.66 Favored Glycine 0 CA--C 1.52 0.404 0 C-N-CA 121.301 -0.476 . . . . 0.0 114.089 179.167 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 22.4 t-160 -51.41 -35.22 38.15 Favored 'General case' 0 N--CA 1.467 0.376 0 N-CA-C 113.18 0.808 . . . . 0.0 113.18 -178.422 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 13' ' ' HIS . . . . . 0.666 ' C ' ' HG ' ' B' ' 9' ' ' LEU . 36.6 m170 -56.32 -43.01 78.57 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 120.435 -0.506 . . . . 0.0 110.581 -179.092 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 14' ' ' PHE . . . . . 0.75 ' HA ' HD23 ' B' ' 9' ' ' LEU . 27.8 t80 -61.27 -47.47 85.85 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 178.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 20.5 t -58.21 -52.24 61.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.93 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . 0.539 ' HG3' ' N ' ' B' ' 17' ' ' ALA . 15.6 ptt180 -61.84 -46.21 90.45 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -178.206 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . 0.773 ' HB3' HD21 ' B' ' 9' ' ' LEU . . . -68.56 -44.29 74.77 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 111.788 0.292 . . . . 0.0 111.788 -179.027 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 18' ' ' LEU . . . . . 0.628 ' HG ' ' CZ2' ' B' ' 27' ' ' TRP . 20.0 tp -59.77 -51.88 67.86 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.087 -179.452 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 84.6 t -63.3 -41.19 91.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 120.662 0.268 . . . . 0.0 111.606 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . 0.923 ' HE ' ' HA ' ' B' ' 20' ' ' ARG . 0.4 OUTLIER -70.87 -48.17 55.27 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -179.071 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 87.3 t -66.3 -41.05 88.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 120.538 0.208 . . . . 0.0 111.247 -179.363 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 79.2 m -79.05 36.82 0.29 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.158 0.504 . . . . 0.0 111.567 179.767 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.85 -67.88 1.65 Allowed Glycine 0 N--CA 1.449 -0.447 0 CA-C-N 115.745 -0.662 . . . . 0.0 113.954 178.712 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . 0.427 ' O ' ' HB2' ' B' ' 27' ' ' TRP . . . 126.3 -67.72 0.53 Allowed Glycine 0 N--CA 1.449 -0.481 0 N-CA-C 111.465 -0.654 . . . . 0.0 111.465 -178.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -63.03 -36.03 61.95 Favored 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 122.274 1.983 . . . . 0.0 111.732 179.302 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 18.5 mmm-85 -94.21 36.87 1.11 Allowed 'General case' 0 CA--C 1.505 -0.777 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.256 179.164 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 27' ' ' TRP . . . . . 0.798 ' HA ' ' CE3' ' B' ' 27' ' ' TRP . 0.0 OUTLIER -80.01 51.08 1.3 Allowed 'General case' 0 C--N 1.3 -1.562 0 CA-C-O 121.584 0.707 . . . . 0.0 110.657 -179.83 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 23.7 m -69.49 60.06 0.14 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 114.432 -1.258 . . . . 0.0 112.023 179.609 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . 0.529 ' HB ' ' CZ3' ' B' ' 27' ' ' TRP . 75.0 m -164.71 -46.41 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 179.741 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 30' ' ' GLU . . . . . 0.549 ' HB3' ' NE1' ' B' ' 27' ' ' TRP . 87.9 tt0 -110.9 18.5 19.46 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.029 -1.1 . . . . 0.0 108.029 178.643 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.907 0 CA-C-N 114.277 -1.329 . . . . 0.0 108.66 -179.709 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.015 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -68.0 133.44 49.04 Favored 'General case' 0 C--N 1.331 -0.206 0 O-C-N 123.04 0.212 . . . . 0.0 110.449 179.328 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -175.42 135.5 0.33 Allowed 'General case' 0 N--CA 1.444 -0.726 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 -179.552 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 2.9 p -60.18 -30.21 69.2 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.761 179.528 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 24.3 t-20 -147.16 102.73 3.81 Favored Pre-proline 0 C--N 1.32 -0.697 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.046 178.583 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_exo -58.0 -43.11 51.29 Favored 'Trans proline' 0 C--N 1.333 -0.262 0 C-N-CA 123.845 3.03 . . . . 0.0 113.416 -178.336 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.76 -43.95 85.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.136 0.493 . . . . 0.0 110.581 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.428 ' HD2' ' HA ' ' A' ' 8' ' ' ARG . 14.4 tpt180 -68.24 -51.27 47.15 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.283 179.52 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 47.0 t80 -55.57 -51.64 66.42 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 114.757 -1.11 . . . . 0.0 111.282 -179.584 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.908 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 14.1 m -62.48 -35.3 78.92 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.96 -179.725 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 38.2 t -72.43 -59.41 2.74 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.239 0.542 . . . . 0.0 111.562 -179.646 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.413 HD13 ' HA ' ' A' ' 12' ' ' LEU . 4.0 mm? -68.84 -56.6 7.46 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 113.005 0.743 . . . . 0.0 113.005 -178.416 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 13.9 m -81.74 -43.21 18.71 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 111.777 0.288 . . . . 0.0 111.777 -178.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.572 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 99.8 148.36 22.67 Favored Glycine 0 N--CA 1.45 -0.404 0 N-CA-C 110.875 -0.89 . . . . 0.0 110.875 -178.977 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.649 ' SG ' HD22 ' B' ' 9' ' ' LEU . 24.3 p -142.63 163.45 32.8 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 117.018 0.409 . . . . 0.0 111.897 -178.361 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.685 HG23 ' HD2' ' B' ' 6' ' ' ARG . 63.3 p -114.89 -172.88 2.21 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.812 -179.389 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 24.3 pt20 -57.64 -42.5 83.56 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 120.611 0.244 . . . . 0.0 111.01 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -60.8 -41.67 96.09 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.181 0.515 . . . . 0.0 110.213 179.287 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.607 ' CB ' ' HB2' ' A' ' 15' ' ' CYS . 0.5 OUTLIER -61.99 -39.76 93.34 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.92 179.696 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.411 HD21 ' CD2' ' B' ' 9' ' ' LEU . 3.4 mm? -71.67 -39.34 70.35 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.751 -0.462 . . . . 0.0 109.751 178.057 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -57.7 -41.36 81.55 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.879 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 30.9 p -65.83 -5.39 8.86 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 71.6 mt -105.7 -10.5 16.74 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.009 0.433 . . . . 0.0 110.303 179.581 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 62.9 m -79.22 145.92 65.75 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.754 -179.368 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.588 ' HD3' ' HZ3' ' B' ' 27' ' ' TRP . 86.4 Cg_endo -88.77 -157.12 0.06 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.716 0 C-N-CA 123.376 2.718 . . . . 0.0 112.24 179.418 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 23.3 t80 . . . . . 0 C--O 1.25 1.095 0 CA-C-O 117.991 -1.004 . . . . 0.0 109.258 179.364 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 1' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_exo . . . . . 0 CA--C 1.511 -0.641 0 N-CA-C 110.911 -0.457 . . . . 0.0 110.911 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 5.8 m -54.46 132.63 62.92 Favored Pre-proline 0 C--N 1.32 -0.687 0 O-C-N 124.051 0.844 . . . . 0.0 109.278 179.346 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_exo -22.92 86.77 0.0 OUTLIER 'Trans proline' 0 C--N 1.358 1.04 1 C-N-CA 125.624 4.216 . . . . 0.0 115.38 -178.566 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . 0.543 ' HB2' HG21 ' A' ' 16' ' ' THR . 5.6 mp0 -77.05 141.71 40.17 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.012 -0.995 . . . . 0.0 109.878 -179.787 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 5' ' ' MET . . . . . . . . . . . . . 96.7 mmm -53.34 114.49 1.51 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.13 0.49 . . . . 0.0 110.907 -179.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 6' ' ' ARG . . . . . 0.711 ' HD2' ' HA ' ' A' ' 15' ' ' CYS . 57.8 mmt-85 -92.89 125.44 37.49 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.825 -179.473 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -104.4 135.74 45.27 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 178.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . 0.518 ' HA ' ' O ' ' A' ' 10' ' ' CYS . 65.7 mttm -77.55 95.01 4.43 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.579 0.704 . . . . 0.0 110.285 -179.643 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . 1.108 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 7.9 mp -75.02 52.02 0.54 Allowed 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 114.961 -1.018 . . . . 0.0 112.369 -179.106 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 67.5 m -73.08 123.13 22.96 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.222 -0.444 . . . . 0.0 109.94 178.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 59.24 -118.36 14.01 Favored Glycine 0 CA--C 1.52 0.383 0 C-N-CA 121.259 -0.496 . . . . 0.0 113.826 179.359 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 11.1 t-160 -54.14 -32.11 54.35 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 -178.661 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 13' ' ' HIS . . . . . 0.664 ' CB ' ' HA ' ' B' ' 9' ' ' LEU . 30.3 m170 -60.75 -36.94 80.17 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 120.109 -0.637 . . . . 0.0 110.815 -178.751 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 14' ' ' PHE . . . . . 0.877 ' HA ' HD23 ' B' ' 9' ' ' LEU . 15.9 t80 -62.13 -45.36 93.81 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 178.524 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 47.9 t -63.72 -52.94 50.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.087 -0.96 . . . . 0.0 111.9 179.699 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . 0.546 ' HG3' ' O ' ' B' ' 13' ' ' HIS . 3.7 ppt_? -59.68 -44.4 93.63 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.896 -0.593 . . . . 0.0 112.066 -178.442 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . 0.734 ' HB3' HD21 ' B' ' 9' ' ' LEU . . . -69.62 -41.8 75.18 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 121.146 -0.222 . . . . 0.0 111.115 -179.373 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 18' ' ' LEU . . . . . 0.564 HD22 ' HE1' ' B' ' 27' ' ' TRP . 7.2 mt -56.85 -55.61 32.24 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.836 0.35 . . . . 0.0 111.259 179.502 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 41.7 t -64.26 -38.44 82.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.995 -0.548 . . . . 0.0 112.315 -178.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . 0.739 ' NE ' ' HA ' ' B' ' 20' ' ' ARG . 0.1 OUTLIER -77.06 -54.5 6.46 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.125 -0.63 . . . . 0.0 112.592 -178.563 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 21' ' ' VAL . . . . . 0.634 HG13 ' HG3' ' A' ' 17' ' ' GLN . 78.3 t -63.46 -45.73 97.11 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 CA-C-N 115.734 -0.666 . . . . 0.0 112.164 -178.502 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 22' ' ' CYS . . . . . 0.806 ' HB3' ' HB2' ' B' ' 27' ' ' TRP . 88.1 m -86.48 42.25 0.99 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.337 0.589 . . . . 0.0 112.043 -179.225 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.32 -75.72 1.74 Allowed Glycine 0 C--O 1.236 0.271 0 CA-C-N 115.797 -0.638 . . . . 0.0 114.355 178.183 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 132.63 -58.96 0.69 Allowed Glycine 0 CA--C 1.522 0.51 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.885 -179.044 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_exo -60.84 -20.95 68.75 Favored 'Trans proline' 0 C--N 1.356 0.958 0 C-N-CA 122.842 2.361 . . . . 0.0 112.545 -179.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 19.4 ttt85 -166.1 140.87 4.55 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.262 179.278 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 27' ' ' TRP . . . . . 0.806 ' HB2' ' HB3' ' B' ' 22' ' ' CYS . 0.3 OUTLIER -173.52 -15.55 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.578 0 O-C-N 123.831 0.707 . . . . 0.0 112.775 -179.918 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 93.8 p -151.59 -130.65 0.04 OUTLIER 'General case' 0 N--CA 1.441 -0.882 0 CA-C-O 121.739 0.78 . . . . 0.0 112.594 -177.201 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -95.45 -36.22 11.41 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 114.436 -1.256 . . . . 0.0 109.429 -178.84 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -65.65 -32.87 74.68 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 114.284 -1.326 . . . . 0.0 110.176 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.124 0 CA-C-O 117.836 -1.078 . . . . 0.0 109.117 179.837 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.977 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -73.38 125.47 27.93 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 110.372 -0.232 . . . . 0.0 110.372 179.404 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -173.68 127.67 0.4 Allowed 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 2.4 p -64.47 -27.59 69.09 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.836 179.485 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 33.5 t-20 -151.79 105.89 2.87 Favored Pre-proline 0 C--N 1.321 -0.667 0 CA-C-N 115.164 -0.925 . . . . 0.0 108.772 178.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_exo -57.88 -48.64 15.69 Favored 'Trans proline' 0 C--N 1.331 -0.353 0 C-N-CA 123.67 2.913 . . . . 0.0 113.431 -178.499 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.6 -44.32 81.0 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.313 0.578 . . . . 0.0 110.587 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 17.3 mmm180 -67.62 -50.24 59.09 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.073 179.296 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -57.34 -49.09 77.24 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.794 179.629 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 1.108 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 65.0 m -61.88 -38.67 89.2 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.723 -0.672 . . . . 0.0 112.074 -179.66 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 47.7 t -74.46 -59.66 2.63 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.245 0.545 . . . . 0.0 111.664 -179.398 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -61.99 -56.56 17.89 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.541 -0.754 . . . . 0.0 112.629 -178.518 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 12.5 m -91.22 -59.26 2.2 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.932 0.396 . . . . 0.0 111.144 -179.234 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.592 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 123.57 144.46 6.55 Favored Glycine 0 N--CA 1.446 -0.675 0 N-CA-C 110.894 -0.883 . . . . 0.0 110.894 -179.513 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.711 ' HA ' ' HD2' ' B' ' 6' ' ' ARG . 20.8 p -130.3 153.51 48.57 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 117.162 0.481 . . . . 0.0 110.789 -179.783 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.543 HG21 ' HB2' ' B' ' 4' ' ' GLU . 10.1 t -107.02 -176.86 3.2 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.638 -178.75 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.634 ' HG3' HG13 ' B' ' 21' ' ' VAL . 34.1 tt0 -59.0 -53.08 62.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.68 -179.737 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 8.8 mm100 -60.69 -38.43 84.93 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.392 0.615 . . . . 0.0 110.432 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.528 ' HB2' HG22 ' A' ' 16' ' ' THR . 3.0 t0 -62.12 -41.64 98.44 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.176 -0.92 . . . . 0.0 109.818 179.362 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 77.8 mt -72.81 -41.36 65.01 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.014 179.131 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 45.8 tp -56.35 -45.88 80.21 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.88 -179.486 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 11.0 p -64.27 -9.98 20.87 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 179.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 98.4 mt -96.59 -20.77 18.08 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.032 179.422 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.514 ' SG ' ' HD1' ' B' ' 27' ' ' TRP . 76.5 m -99.06 133.1 22.43 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-O 121.181 0.515 . . . . 0.0 111.872 -179.026 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.5 ' HD3' ' HA ' ' A' ' 24' ' ' CYS . 63.6 Cg_endo -92.49 -158.41 0.06 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.975 0 C-N-CA 123.578 2.852 . . . . 0.0 111.941 179.197 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 37.5 m-85 . . . . . 0 C--O 1.247 0.929 0 CA-C-O 118.701 -0.666 . . . . 0.0 109.6 179.209 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 1' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_endo . . . . . 0 N--CA 1.48 0.729 0 N-CA-C 111.178 -0.354 . . . . 0.0 111.178 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 2' ' ' THR . . . . . 0.636 ' OG1' ' HD2' ' B' ' 3' ' ' PRO . 0.6 OUTLIER -175.73 167.9 1.63 Allowed Pre-proline 0 C--N 1.325 -0.478 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 -179.137 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . 0.636 ' HD2' ' OG1' ' B' ' 2' ' ' THR . 40.5 Cg_endo -67.86 65.09 0.92 Allowed 'Trans proline' 0 C--N 1.356 0.937 0 C-N-CA 122.677 2.251 . . . . 0.0 112.202 -179.765 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . 0.559 ' OE1' ' HB ' ' A' ' 16' ' ' THR . 18.6 mt-10 -66.83 145.57 55.34 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 114.35 -1.296 . . . . 0.0 111.179 -179.084 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 5' ' ' MET . . . . . . . . . . . . . 48.5 ttm -78.1 136.23 37.85 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 178.721 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 6' ' ' ARG . . . . . 0.864 ' HD2' HG23 ' A' ' 16' ' ' THR . 27.3 mmm180 -65.25 110.41 2.57 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 179.796 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . 0.548 ' O ' HD22 ' B' ' 9' ' ' LEU . 8.8 tp10 -84.13 133.2 34.63 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-O 121.468 0.652 . . . . 0.0 109.475 179.821 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 6.0 mtmm -83.06 86.51 6.99 Favored 'General case' 0 C--N 1.308 -1.2 0 CA-C-N 115.331 -0.85 . . . . 0.0 109.555 -179.225 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . 0.638 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 1.6 mm? -74.73 54.44 0.62 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.653 -0.703 . . . . 0.0 112.878 -178.653 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 10' ' ' CYS . . . . . 0.488 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 81.2 m -71.28 119.66 15.74 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.608 178.78 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 53.47 -116.57 5.98 Favored Glycine 0 C--N 1.331 0.29 0 CA-C-N 116.161 -0.472 . . . . 0.0 113.583 179.213 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 22.6 t-160 -51.28 -34.04 31.19 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 122.978 0.511 . . . . 0.0 111.909 -179.634 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 13' ' ' HIS . . . . . 0.589 ' O ' HD12 ' B' ' 9' ' ' LEU . 46.7 m170 -55.16 -44.57 75.29 Favored 'General case' 0 C--N 1.32 -0.696 0 C-N-CA 120.495 -0.482 . . . . 0.0 110.48 -179.362 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 14' ' ' PHE . . . . . 0.461 ' CA ' ' HB3' ' B' ' 9' ' ' LEU . 25.7 t80 -62.64 -48.0 81.24 Favored 'General case' 0 C--N 1.329 -0.318 0 O-C-N 123.382 0.426 . . . . 0.0 110.229 178.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 13.0 t -56.43 -50.58 71.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.753 179.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.96 -45.08 96.17 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.016 -0.993 . . . . 0.0 112.061 -179.359 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.17 -44.56 83.7 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.769 0.319 . . . . 0.0 111.524 -179.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 29.4 tp -61.05 -51.53 68.79 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.607 -179.346 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 19' ' ' VAL . . . . . 0.419 HG12 ' CD1' ' B' ' 27' ' ' TRP . 21.1 m -64.36 -33.89 65.69 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 -179.448 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . 0.534 ' NE ' ' HA ' ' B' ' 20' ' ' ARG . 13.9 mmp_? -77.38 -52.33 9.33 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 112.395 0.517 . . . . 0.0 112.395 -179.376 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 91.1 t -71.13 -52.75 24.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -178.545 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 83.6 m -97.7 47.6 1.02 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.772 0.32 . . . . 0.0 111.282 -179.309 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -172.4 -38.71 0.03 OUTLIER Glycine 0 N--CA 1.444 -0.784 0 C-N-CA 119.986 -1.102 . . . . 0.0 112.831 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 74.23 -113.88 4.29 Favored Glycine 0 N--CA 1.445 -0.705 0 N-CA-C 110.663 -0.975 . . . . 0.0 110.663 -178.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_exo -60.4 -39.02 70.23 Favored 'Trans proline' 0 CA--C 1.531 0.351 0 C-N-CA 122.742 2.295 . . . . 0.0 112.237 179.375 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . 0.608 ' NH1' ' HB3' ' B' ' 26' ' ' ARG . 9.3 mtp-105 -152.95 156.08 38.19 Favored 'General case' 0 CA--C 1.495 -1.156 0 CA-C-O 121.597 0.713 . . . . 0.0 111.091 179.664 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 27' ' ' TRP . . . . . 0.734 ' HB3' ' HB3' ' B' ' 31' ' ' ALA . 0.0 OUTLIER -86.59 52.29 2.46 Favored 'General case' 0 C--N 1.305 -1.337 0 CA-C-N 113.972 -1.467 . . . . 0.0 107.349 176.032 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 63.6 m -61.37 63.47 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 114.827 -1.079 . . . . 0.0 113.709 -178.218 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . 0.5 ' HB ' ' CZ3' ' B' ' 27' ' ' TRP . 59.0 m -169.32 -38.77 0.02 OUTLIER 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 179.239 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 30' ' ' GLU . . . . . 0.494 ' HB3' ' NE1' ' B' ' 27' ' ' TRP . 39.7 tt0 -125.25 -31.08 3.1 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 114.862 -1.063 . . . . 0.0 110.872 -179.312 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 31' ' ' ALA . . . . . 0.734 ' HB3' ' HB3' ' B' ' 27' ' ' TRP . . . . . . . . 0 C--O 1.25 1.129 0 CA-C-O 118.733 -0.651 . . . . 0.0 111.128 -179.385 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . 0.432 ' H1 ' ' CG ' ' A' ' 19' ' ' ASP . . . . . . . . 0 N--CA 1.479 1.019 0 N-CA-C 110.299 -0.26 . . . . 0.0 110.299 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -156.05 132.93 10.48 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.639 -0.255 . . . . 0.0 110.329 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -83.0 59.61 5.01 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.401 -179.679 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 4.7 p -141.18 -62.25 0.47 Allowed 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.413 0.625 . . . . 0.0 110.501 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 30.1 t-20 -170.93 109.76 0.42 Allowed Pre-proline 0 C--N 1.317 -0.821 0 CA-C-N 115.002 -0.999 . . . . 0.0 109.123 179.258 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -60.83 -46.81 14.99 Favored 'Trans proline' 0 C--N 1.333 -0.282 0 C-N-CA 123.21 2.607 . . . . 0.0 113.416 -178.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -58.66 -43.35 89.83 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.024 0.44 . . . . 0.0 110.925 -179.747 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.404 ' HA ' ' HD3' ' A' ' 8' ' ' ARG . 3.0 mmt85 -73.25 -43.87 60.36 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.498 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 32.3 t80 -62.7 -51.42 67.27 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.115 -179.714 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.667 ' O ' ' HA2' ' A' ' 14' ' ' GLY . 86.6 m -67.32 -17.54 64.8 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.883 -179.577 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.488 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 28.8 t -82.95 -57.28 3.36 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.298 0.571 . . . . 0.0 110.341 178.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 97.2 mt -69.49 -57.85 4.71 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.885 -1.052 . . . . 0.0 112.555 -178.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 14.1 m -84.36 -29.68 26.07 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.085 0.469 . . . . 0.0 111.446 -178.787 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.667 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 83.62 151.31 11.41 Favored Glycine 0 N--CA 1.446 -0.672 0 C-N-CA 120.779 -0.724 . . . . 0.0 111.493 -178.861 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.541 ' HA ' ' NH2' ' B' ' 6' ' ' ARG . 82.9 m -134.79 143.79 47.29 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.933 0.396 . . . . 0.0 111.046 -179.162 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.864 HG23 ' HD2' ' B' ' 6' ' ' ARG . 39.7 p -80.64 167.34 20.15 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 178.559 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 4.6 pp0? -61.73 -37.64 84.97 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 179.373 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 66.9 tp60 -63.63 -43.42 96.87 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.199 178.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.432 ' CG ' ' H1 ' ' A' ' 1' ' ' ALA . 24.5 t0 -59.7 -44.18 93.78 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.464 179.654 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.509 HD11 HD21 ' B' ' 9' ' ' LEU . 81.2 mt -65.23 -46.32 81.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.344 178.723 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 30.9 tp -57.31 -41.11 79.27 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.808 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 21.2 m -62.62 -24.16 67.44 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.36 179.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 96.6 mt -77.65 -23.19 49.74 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.487 179.244 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.482 ' HA ' ' HD3' ' A' ' 25' ' ' PRO . 43.2 m -83.5 132.94 48.03 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.251 -179.541 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.482 ' HD3' ' HA ' ' A' ' 24' ' ' CYS . 3.7 Cg_exo -78.23 132.08 11.19 Favored 'Trans proline' 0 N--CA 1.455 -0.748 0 C-N-CA 123.117 2.545 . . . . 0.0 112.307 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.247 0.923 0 CA-C-N 115.176 -0.92 . . . . 0.0 109.434 179.314 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 1' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo . . . . . 0 N--CA 1.481 0.767 0 N-CA-C 110.019 -0.8 . . . . 0.0 110.019 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 6.3 m -71.81 127.13 91.17 Favored Pre-proline 0 C--N 1.324 -0.541 0 O-C-N 123.4 0.437 . . . . 0.0 110.703 -179.581 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -70.97 135.36 27.4 Favored 'Trans proline' 0 N--CA 1.463 -0.268 0 C-N-CA 122.419 2.08 . . . . 0.0 111.861 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -69.0 132.83 47.29 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.247 0.546 . . . . 0.0 111.168 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 5' ' ' MET . . . . . 0.4 ' O ' ' HA ' ' A' ' 16' ' ' THR . 53.1 ttm -79.38 68.43 5.39 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.653 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 6' ' ' ARG . . . . . 0.588 ' HA ' ' HA ' ' A' ' 16' ' ' THR . 51.2 ttm-85 -76.14 118.7 19.15 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.638 -0.505 . . . . 0.0 109.638 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -120.35 144.88 47.63 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.817 -178.398 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 25.0 mtpp -71.8 98.04 1.9 Allowed 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 107.555 -1.276 . . . . 0.0 107.555 177.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . 0.811 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 32.5 mt -77.97 59.21 2.1 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 113.974 1.102 . . . . 0.0 113.974 -176.485 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 10' ' ' CYS . . . . . 0.424 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 93.2 m -80.99 122.83 27.78 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 177.759 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 63.08 -123.28 29.64 Favored Glycine 0 CA--C 1.52 0.35 0 C-N-CA 121.107 -0.568 . . . . 0.0 113.569 179.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 23.6 t-160 -53.41 -31.03 43.24 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 112.707 0.632 . . . . 0.0 112.707 -178.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 13' ' ' HIS . . . . . 0.641 ' CB ' ' HA ' ' B' ' 9' ' ' LEU . 51.4 m170 -56.5 -43.44 79.74 Favored 'General case' 0 C--N 1.321 -0.668 0 C-N-CA 120.665 -0.414 . . . . 0.0 111.26 -179.035 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 14' ' ' PHE . . . . . 0.713 ' HA ' HD13 ' B' ' 9' ' ' LEU . 45.8 t80 -61.44 -45.64 93.43 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.257 0.551 . . . . 0.0 109.666 178.691 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 23.7 t -60.45 -49.4 84.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.023 -0.989 . . . . 0.0 111.588 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . 0.623 ' HG3' ' N ' ' B' ' 17' ' ' ALA . 12.5 ptt85 -61.03 -43.22 99.21 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.706 -0.224 . . . . 0.0 111.549 -178.587 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . 0.623 ' N ' ' HG3' ' B' ' 16' ' ' ARG . . . -66.41 -51.25 58.93 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.805 0.336 . . . . 0.0 111.43 -179.176 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 29.9 tp -60.37 -54.59 43.79 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.714 -179.394 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 19' ' ' VAL . . . . . 0.537 HG22 ' HZ2' ' B' ' 27' ' ' TRP . 77.8 t -59.9 -45.36 95.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -178.698 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . 0.491 ' HD2' ' HA ' ' B' ' 20' ' ' ARG . 23.6 tpt85 -71.71 -56.18 6.28 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -178.107 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 21' ' ' VAL . . . . . 0.466 HG11 ' O ' ' A' ' 17' ' ' GLN . 89.2 t -61.83 -45.97 97.52 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.844 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 -176.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 74.4 m -71.63 -23.05 61.63 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 -178.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 165.84 -102.92 0.2 Allowed Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.013 -1.089 . . . . 0.0 112.908 -179.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . 0.402 ' HA3' ' HD3' ' B' ' 25' ' ' PRO . . . -177.92 -99.06 0.12 Allowed Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 121.028 -0.605 . . . . 0.0 112.27 -179.863 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 25' ' ' PRO . . . . . 0.402 ' HD3' ' HA3' ' B' ' 24' ' ' GLY . 36.3 Cg_exo -60.76 -31.44 91.87 Favored 'Trans proline' 0 CA--C 1.529 0.256 0 C-N-CA 123.164 2.576 . . . . 0.0 113.038 -179.548 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . 0.566 ' HB2' ' CZ ' ' B' ' 26' ' ' ARG . 0.2 OUTLIER -163.82 152.49 13.63 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 109.562 -0.532 . . . . 0.0 109.562 179.905 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 27' ' ' TRP . . . . . 0.558 ' CZ3' ' HB2' ' B' ' 30' ' ' GLU . 0.0 OUTLIER -147.29 -90.26 0.09 Allowed 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.378 -179.33 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . 0.406 ' HB2' ' HD2' ' A' ' 25' ' ' PRO . 39.6 m -166.68 58.76 0.09 Allowed 'General case' 0 C--N 1.326 -0.43 0 O-C-N 123.315 0.384 . . . . 0.0 111.714 -179.647 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . 0.699 HG23 ' H ' ' B' ' 30' ' ' GLU . 1.6 t -166.73 -90.4 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 179.074 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 30' ' ' GLU . . . . . 0.699 ' H ' HG23 ' B' ' 29' ' ' THR . 2.0 mp0 -63.22 -27.66 69.51 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 177.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 31' ' ' ALA . . . . . 0.409 ' H ' ' HZ3' ' B' ' 27' ' ' TRP . . . . . . . . 0 C--O 1.253 1.261 0 CA-C-N 114.716 -1.129 . . . . 0.0 109.126 179.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 0.906 0 N-CA-C 109.95 -0.389 . . . . 0.0 109.95 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -66.29 130.87 44.69 Favored 'General case' 0 C--N 1.331 -0.208 0 O-C-N 123.024 0.203 . . . . 0.0 110.504 179.48 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -178.12 142.53 0.28 Allowed 'General case' 0 N--CA 1.443 -0.778 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 -179.582 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 10.0 t -59.3 -23.07 62.13 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.154 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 34.2 t-20 -148.94 103.01 3.38 Favored Pre-proline 0 C--N 1.325 -0.485 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 178.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_exo -59.11 -47.23 18.37 Favored 'Trans proline' 0 C--N 1.331 -0.354 0 C-N-CA 123.742 2.961 . . . . 0.0 113.093 -178.681 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.86 -41.88 78.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.271 0.557 . . . . 0.0 110.666 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.452 ' HD3' ' HA ' ' A' ' 8' ' ' ARG . 30.4 mmt-85 -70.35 -49.38 49.82 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.56 -0.746 . . . . 0.0 111.184 179.335 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 28.0 t80 -59.03 -49.12 79.12 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.657 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.811 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 95.0 m -63.31 -30.48 71.61 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.65 -179.416 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.424 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 36.0 t -77.04 -56.0 4.96 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.207 0.527 . . . . 0.0 110.063 178.97 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 85.5 mt -55.23 -55.08 35.33 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.078 -0.964 . . . . 0.0 110.723 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.403 ' HB2' ' H ' ' A' ' 14' ' ' GLY . 15.2 m -95.14 -92.88 0.19 Allowed 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.925 -0.579 . . . . 0.0 109.775 178.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.403 ' H ' ' HB2' ' A' ' 13' ' ' SER . . . 165.65 149.97 6.08 Favored Glycine 0 N--CA 1.448 -0.515 0 N-CA-C 111.221 -0.751 . . . . 0.0 111.221 179.649 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.504 ' HA ' ' NH1' ' B' ' 6' ' ' ARG . 73.9 m -134.99 134.41 40.46 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 117.191 0.495 . . . . 0.0 111.027 -179.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.818 HG23 ' H ' ' A' ' 19' ' ' ASP . 6.4 t -81.52 160.89 23.8 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 179.212 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.466 ' O ' HG11 ' B' ' 21' ' ' VAL . 68.2 mm-40 -56.96 -40.09 75.83 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.234 0.54 . . . . 0.0 109.753 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 38.4 tt0 -62.59 -38.92 92.04 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.46 -0.791 . . . . 0.0 109.83 178.113 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.818 ' H ' HG23 ' A' ' 16' ' ' THR . 11.3 t0 -57.33 -47.49 81.42 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.006 -0.997 . . . . 0.0 109.183 178.848 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.718 HD21 HD11 ' B' ' 9' ' ' LEU . 4.4 mm? -62.18 -43.19 99.39 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.303 178.605 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.468 ' HG ' ' HE2' ' A' ' 26' ' ' TYR . 39.4 tp -54.71 -51.47 65.47 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.663 179.816 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 6.8 p -62.83 -16.02 56.68 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.546 ' HG ' ' O ' ' A' ' 19' ' ' ASP . 89.2 mt -80.26 -27.43 38.63 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.948 0.404 . . . . 0.0 110.235 179.08 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.481 ' HA ' ' HD3' ' A' ' 25' ' ' PRO . 88.6 m -92.01 138.37 24.69 Favored Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.187 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.481 ' HD3' ' HA ' ' A' ' 24' ' ' CYS . 8.3 Cg_exo -71.11 139.28 35.28 Favored 'Trans proline' 0 N--CA 1.458 -0.601 0 C-N-CA 123.077 2.518 . . . . 0.0 112.1 179.83 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.468 ' HE2' ' HG ' ' A' ' 21' ' ' LEU . 0.5 OUTLIER . . . . . 0 C--O 1.252 1.22 0 CA-C-O 117.407 -1.282 . . . . 0.0 109.322 179.396 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 1' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo . . . . . 0 N--CA 1.482 0.799 0 N-CA-C 110.854 -0.479 . . . . 0.0 110.854 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 2' ' ' THR . . . . . 0.553 ' HB ' ' HD2' ' B' ' 3' ' ' PRO . 0.2 OUTLIER -155.6 174.65 3.74 Favored Pre-proline 0 C--N 1.319 -0.721 0 CA-C-N 115.377 -0.829 . . . . 0.0 108.778 -179.224 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . 0.553 ' HD2' ' HB ' ' B' ' 2' ' ' THR . 44.6 Cg_endo -67.82 59.94 0.87 Allowed 'Trans proline' 0 C--N 1.354 0.86 0 C-N-CA 122.872 2.382 . . . . 0.0 112.247 179.862 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . 0.508 ' OE1' ' HG3' ' A' ' 18' ' ' GLN . 22.0 mt-10 -81.32 140.71 34.63 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 114.308 -1.314 . . . . 0.0 111.155 -179.025 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 5' ' ' MET . . . . . . . . . . . . . 13.6 tpt -117.1 142.47 46.96 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.481 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 6' ' ' ARG . . . . . 0.769 ' NH1' ' HA ' ' A' ' 15' ' ' CYS . 14.1 tpp180 -73.98 122.82 23.2 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 178.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 62.2 tt0 -132.51 145.04 50.85 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-O 121.087 0.47 . . . . 0.0 111.123 -178.68 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 10.1 mmtp -81.61 96.17 7.4 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 177.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . 0.996 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 21.5 mt -76.41 56.42 1.08 Allowed 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 112.848 0.684 . . . . 0.0 112.848 -178.079 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 99.4 m -75.94 121.45 22.7 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.164 -0.471 . . . . 0.0 109.807 178.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 62.35 -123.64 31.48 Favored Glycine 0 CA--C 1.521 0.462 0 C-N-CA 121.262 -0.494 . . . . 0.0 114.015 179.382 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 12' ' ' HIS . . . . . 0.485 ' O ' ' HG2' ' B' ' 16' ' ' ARG . 20.7 t-160 -51.44 -32.37 26.56 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 112.894 0.701 . . . . 0.0 112.894 -178.526 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 13' ' ' HIS . . . . . 0.628 ' HB3' ' HA ' ' B' ' 9' ' ' LEU . 28.7 m170 -57.75 -42.9 84.89 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 120.905 -0.318 . . . . 0.0 110.799 -179.433 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 14' ' ' PHE . . . . . 0.683 ' HA ' HD13 ' B' ' 9' ' ' LEU . 43.3 t80 -61.42 -45.9 92.39 Favored 'General case' 0 C--N 1.327 -0.396 0 O-C-N 123.418 0.449 . . . . 0.0 110.0 178.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 59.3 t -55.7 -56.61 11.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.568 -0.742 . . . . 0.0 112.108 -179.62 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . 0.485 ' HG2' ' O ' ' B' ' 12' ' ' HIS . 2.5 ptm180 -59.91 -47.71 84.68 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -179.147 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.79 -43.76 83.06 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.146 0.425 . . . . 0.0 112.146 -178.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 36.9 tp -59.34 -48.76 80.42 Favored 'General case' 0 C--N 1.327 -0.406 0 O-C-N 123.156 0.285 . . . . 0.0 110.698 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 19' ' ' VAL . . . . . 0.474 HG13 ' HA ' ' B' ' 26' ' ' ARG . 72.7 t -61.31 -44.16 97.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.744 179.728 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.5 -47.07 86.94 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.595 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 21' ' ' VAL . . . . . 0.445 HG21 ' HA ' ' A' ' 17' ' ' GLN . 69.1 t -76.08 -45.95 35.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 N-CA-C 113.013 0.746 . . . . 0.0 113.013 -177.815 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 95.6 m -77.66 27.79 0.17 Allowed 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 113.239 0.829 . . . . 0.0 113.239 -178.464 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 154.94 -53.65 0.43 Allowed Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 119.853 -1.165 . . . . 0.0 113.346 178.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 122.21 -83.86 0.36 Allowed Glycine 0 N--CA 1.45 -0.409 0 N-CA-C 110.981 -0.848 . . . . 0.0 110.981 -178.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -67.74 -37.84 15.19 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.42 2.08 . . . . 0.0 110.615 178.585 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . 0.474 ' HA ' HG13 ' B' ' 19' ' ' VAL . 53.1 mtp180 -152.7 -150.26 0.33 Allowed 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 107.577 -1.268 . . . . 0.0 107.577 178.098 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 27' ' ' TRP . . . . . 0.571 ' CH2' ' HB2' ' B' ' 30' ' ' GLU . 0.0 OUTLIER -163.31 -34.67 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.886 0.374 . . . . 0.0 110.855 178.595 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 32.3 t -160.56 -147.98 0.16 Allowed 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.317 -179.497 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . 0.419 HG22 ' H ' ' B' ' 29' ' ' THR . 3.0 t -84.07 -33.55 24.39 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.456 179.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 30' ' ' GLU . . . . . 0.571 ' HB2' ' CH2' ' B' ' 27' ' ' TRP . 3.8 mp0 -59.02 -44.91 91.78 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.751 -0.658 . . . . 0.0 110.927 -179.559 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 31' ' ' ALA . . . . . 0.56 ' HB3' ' CZ3' ' B' ' 27' ' ' TRP . . . . . . . . 0 C--O 1.251 1.163 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.582 179.795 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.033 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -161.78 147.44 13.51 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 123.459 0.474 . . . . 0.0 109.939 -179.643 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -82.52 50.17 1.6 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.369 0.604 . . . . 0.0 111.058 -179.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 4.8 p -83.9 51.18 1.98 Allowed 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.774 179.54 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 23.3 t-20 -171.48 116.66 0.43 Allowed Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.135 -179.403 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.64 ' HB3' HD13 ' A' ' 23' ' ' LEU . 33.5 Cg_exo -56.88 -48.3 19.14 Favored 'Trans proline' 0 N--CA 1.47 0.125 0 C-N-CA 123.288 2.659 . . . . 0.0 113.448 -178.819 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.53 -39.42 87.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.499 0.666 . . . . 0.0 110.35 179.637 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.45 ' HA ' ' NE ' ' A' ' 8' ' ' ARG . 0.4 OUTLIER -67.93 -49.92 59.01 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.262 -0.881 . . . . 0.0 109.809 179.317 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 17.0 t80 -56.34 -51.59 67.7 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.031 -0.986 . . . . 0.0 111.1 179.684 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.996 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 57.6 m -61.92 -28.56 69.61 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.124 -179.588 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 42.3 t -82.52 -55.3 4.56 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.375 0.607 . . . . 0.0 111.124 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 91.6 mt -64.22 -58.73 5.74 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.157 -0.929 . . . . 0.0 112.417 -178.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 8.9 m -89.98 -43.75 10.34 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.999 0.428 . . . . 0.0 111.194 -179.17 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.688 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 103.81 149.46 20.47 Favored Glycine 0 N--CA 1.446 -0.635 0 N-CA-C 110.86 -0.896 . . . . 0.0 110.86 -178.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.769 ' HA ' ' NH1' ' B' ' 6' ' ' ARG . 28.2 p -139.95 -161.44 1.2 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 117.443 0.622 . . . . 0.0 110.944 -179.513 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.693 ' H ' ' HB2' ' A' ' 19' ' ' ASP . 6.9 t -160.1 -166.47 1.71 Allowed 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 -179.757 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.445 ' HA ' HG21 ' B' ' 21' ' ' VAL . 36.4 tt0 -59.0 -53.8 54.35 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.176 0.435 . . . . 0.0 112.176 -179.008 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.508 ' HG3' ' OE1' ' B' ' 4' ' ' GLU . 23.4 mt-30 -57.34 -45.85 83.87 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.819 0.343 . . . . 0.0 110.591 179.549 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.693 ' HB2' ' H ' ' A' ' 16' ' ' THR . 1.1 m-20 -56.53 -43.39 79.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.312 179.122 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.519 HD11 HD11 ' B' ' 9' ' ' LEU . 84.2 mt -72.04 -37.54 69.69 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.1 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 6.1 tt -57.13 -46.08 82.98 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.951 -179.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.5 p -64.98 -13.8 58.53 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.95 0.405 . . . . 0.0 111.73 179.076 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.64 HD13 ' HB3' ' A' ' 6' ' ' PRO . 90.5 mt -94.19 -18.24 21.92 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.822 179.435 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.46 ' HA ' ' HD3' ' A' ' 25' ' ' PRO . 69.9 m -67.39 135.89 93.29 Favored Pre-proline 0 C--N 1.333 -0.149 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.886 -179.538 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' A' ' 24' ' ' CYS . 4.4 Cg_exo -74.2 124.81 9.29 Favored 'Trans proline' 0 N--CA 1.459 -0.549 0 C-N-CA 122.924 2.416 . . . . 0.0 112.317 -179.798 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.247 0.965 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.41 179.345 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 1' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo . . . . . 0 N--CA 1.481 0.752 0 N-CA-C 110.004 -0.806 . . . . 0.0 110.004 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 2' ' ' THR . . . . . 0.59 ' HB ' ' HD2' ' B' ' 3' ' ' PRO . 0.2 OUTLIER -158.33 176.28 2.72 Favored Pre-proline 0 C--N 1.316 -0.887 0 N-CA-C 107.11 -1.441 . . . . 0.0 107.11 -178.782 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . 0.59 ' HD2' ' HB ' ' B' ' 2' ' ' THR . 13.9 Cg_endo -58.99 90.86 0.07 OUTLIER 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 121.417 1.411 . . . . 0.0 110.188 179.086 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . 0.434 ' HG2' ' O ' ' B' ' 2' ' ' THR . 41.5 mm-40 -73.19 49.84 0.27 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.466 -0.788 . . . . 0.0 112.767 -176.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 5' ' ' MET . . . . . . . . . . . . . 19.8 ptp -79.54 60.06 3.16 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-O 121.948 0.88 . . . . 0.0 109.103 178.17 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 86.1 mtt-85 -76.26 123.75 26.39 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.769 -1.105 . . . . 0.0 111.929 -178.103 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 69.1 tt0 -99.98 145.28 28.05 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 115.524 -0.762 . . . . 0.0 109.19 178.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 11.5 mmmm -76.23 93.01 3.33 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 178.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . 0.964 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 34.1 mt -78.2 57.47 1.86 Allowed 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 113.057 0.762 . . . . 0.0 113.057 -177.714 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 10' ' ' CYS . . . . . 0.405 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 87.4 m -73.43 121.6 20.78 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.192 178.413 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 58.65 -119.75 19.07 Favored Glycine 0 CA--C 1.52 0.391 0 N-CA-C 114.38 0.512 . . . . 0.0 114.38 179.22 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 12' ' ' HIS . . . . . 0.518 ' O ' ' HG3' ' B' ' 16' ' ' ARG . 16.5 t-160 -50.06 -32.46 15.6 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 -178.33 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 13' ' ' HIS . . . . . 0.644 ' HB3' ' HA ' ' B' ' 9' ' ' LEU . 23.6 m170 -59.36 -41.38 89.12 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 120.875 -0.33 . . . . 0.0 111.026 -179.267 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 14' ' ' PHE . . . . . 0.627 ' HA ' HD13 ' B' ' 9' ' ' LEU . 22.7 t80 -60.91 -44.42 97.19 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.171 0.51 . . . . 0.0 109.688 178.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . 0.463 ' O ' HG23 ' B' ' 19' ' ' VAL . 60.0 t -58.55 -58.65 5.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.162 -0.926 . . . . 0.0 112.508 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . 0.624 ' HD3' ' N ' ' B' ' 17' ' ' ALA . 0.0 OUTLIER -62.5 -31.92 72.75 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 120.732 -0.387 . . . . 0.0 111.916 -179.123 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . 0.624 ' N ' ' HD3' ' B' ' 16' ' ' ARG . . . -65.77 -47.56 74.79 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.545 179.329 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 18' ' ' LEU . . . . . 0.401 ' O ' ' HB2' ' B' ' 22' ' ' CYS . 57.9 mt -61.19 -49.6 76.52 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.838 179.302 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 19' ' ' VAL . . . . . 0.463 HG23 ' O ' ' B' ' 15' ' ' VAL . 87.1 t -57.33 -40.98 77.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.789 -179.813 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . 0.573 ' NE ' ' HA ' ' B' ' 20' ' ' ARG . 4.5 tpm_? -80.55 -59.78 2.56 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 -178.737 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 92.2 t -61.14 -44.22 97.88 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 CA-C-N 115.085 -0.962 . . . . 0.0 113.295 -177.132 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 22' ' ' CYS . . . . . 0.401 ' HB2' ' O ' ' B' ' 18' ' ' LEU . 75.9 m -80.67 44.29 0.72 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.83 0.824 . . . . 0.0 111.684 -179.07 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.57 -66.68 3.47 Favored Glycine 0 N--CA 1.447 -0.593 0 CA-C-N 114.916 -1.038 . . . . 0.0 114.172 178.341 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . 0.4 ' HA2' ' O ' ' B' ' 19' ' ' VAL . . . 126.17 -70.17 0.49 Allowed Glycine 0 N--CA 1.449 -0.452 0 N-CA-C 111.173 -0.771 . . . . 0.0 111.173 -178.644 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_exo -61.13 -20.99 70.24 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 122.777 2.318 . . . . 0.0 111.471 178.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . 0.588 ' HD3' ' O ' ' B' ' 26' ' ' ARG . 1.7 tmt_? -66.59 -19.95 65.89 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.863 179.306 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 27' ' ' TRP . . . . . 0.744 ' HA ' ' CE3' ' B' ' 27' ' ' TRP . 0.0 OUTLIER -76.93 51.34 0.78 Allowed 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 122.61 1.195 . . . . 0.0 111.523 179.502 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 12.0 t -108.46 29.23 7.57 Favored 'General case' 0 C--N 1.301 -1.511 0 CA-C-N 113.048 -1.887 . . . . 0.0 108.241 179.474 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . 0.58 HG23 ' OE1' ' B' ' 30' ' ' GLU . 0.0 OUTLIER -166.18 -61.47 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 114.824 -1.08 . . . . 0.0 110.602 -178.02 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 30' ' ' GLU . . . . . 0.58 ' OE1' HG23 ' B' ' 29' ' ' THR . 34.3 mp0 -92.79 -162.42 0.93 Allowed 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 178.632 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 31' ' ' ALA . . . . . 0.575 ' HA ' ' CD1' ' B' ' 27' ' ' TRP . . . . . . . . 0 C--O 1.249 1.062 0 CA-C-O 117.752 -1.118 . . . . 0.0 109.901 179.202 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.966 0 N-CA-C 110.218 -0.29 . . . . 0.0 110.218 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -151.81 129.53 11.58 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 110.311 -0.255 . . . . 0.0 110.311 179.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -79.84 61.53 3.8 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.92 -179.428 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -153.65 -53.33 0.1 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.223 0.535 . . . . 0.0 110.622 179.335 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.423 ' HA ' ' HD3' ' A' ' 6' ' ' PRO . 23.4 t-20 -176.02 112.88 0.26 Allowed Pre-proline 0 C--N 1.32 -0.69 0 CA-C-N 115.184 -0.916 . . . . 0.0 109.478 179.417 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 5' ' ' ASN . 23.3 Cg_exo -61.92 -46.17 14.26 Favored 'Trans proline' 0 C--N 1.334 -0.194 0 C-N-CA 123.443 2.762 . . . . 0.0 113.265 -178.887 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.59 -44.25 85.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.104 0.478 . . . . 0.0 110.424 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 35.6 ttp180 -63.31 -52.2 62.91 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.431 -0.804 . . . . 0.0 109.807 179.085 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 60.8 t80 -55.22 -49.56 71.67 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.369 -1.287 . . . . 0.0 111.27 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.964 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 72.4 m -64.64 -31.95 73.4 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.986 -0.552 . . . . 0.0 112.173 -179.323 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.405 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 42.6 t -76.89 -54.17 6.93 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.301 0.572 . . . . 0.0 110.952 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 11.0 mp -69.84 -59.61 2.83 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.296 -0.866 . . . . 0.0 112.547 -178.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.2 m -86.06 -45.6 11.27 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.767 0.318 . . . . 0.0 111.827 -178.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.607 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 104.72 149.71 19.69 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.841 -0.695 . . . . 0.0 111.421 -179.349 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.519 ' SG ' HD12 ' B' ' 9' ' ' LEU . 27.0 p -143.29 145.07 32.4 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.137 0.494 . . . . 0.0 111.509 -179.044 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 8.8 t -94.95 168.57 10.7 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.43 -179.261 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 5.6 mp0 -49.61 -45.31 48.02 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 122.772 0.429 . . . . 0.0 111.464 -179.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 4.2 tp60 -61.14 -40.01 92.2 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.254 0.55 . . . . 0.0 110.14 179.508 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.494 ' HB3' ' HB2' ' A' ' 15' ' ' CYS . 1.7 t70 -60.3 -43.95 95.85 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.584 179.286 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.481 HD21 HD11 ' B' ' 9' ' ' LEU . 1.8 mm? -67.49 -44.32 78.8 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.685 178.731 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 31.1 tp -55.87 -44.57 78.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.61 -179.327 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 21.7 m -60.55 -24.07 65.11 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.489 179.535 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 97.3 mt -85.14 -22.51 28.8 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.304 179.79 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.464 ' HA ' ' HD3' ' A' ' 25' ' ' PRO . 89.2 m -97.29 138.06 21.18 Favored Pre-proline 0 C--N 1.326 -0.426 0 CA-C-O 121.112 0.482 . . . . 0.0 111.738 -179.419 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.464 ' HD3' ' HA ' ' A' ' 24' ' ' CYS . 52.4 Cg_endo -91.33 -175.63 0.77 Allowed 'Trans proline' 0 N--CA 1.446 -1.302 0 C-N-CA 123.084 2.522 . . . . 0.0 111.882 179.525 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 23.7 t80 . . . . . 0 C--O 1.25 1.112 0 CA-C-O 117.915 -1.041 . . . . 0.0 109.549 179.065 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 1' ' ' PRO . . . . . 0.418 ' HG2' HG21 ' A' ' 22' ' ' THR . 11.6 Cg_exo . . . . . 0 N--CA 1.474 0.351 0 N-CA-C 110.915 -0.456 . . . . 0.0 110.915 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 23.9 m -149.15 129.94 6.98 Favored Pre-proline 0 C--N 1.323 -0.552 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.354 -179.371 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -60.28 124.85 16.04 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.553 2.169 . . . . 0.0 111.565 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . 0.67 ' HB3' ' HB ' ' A' ' 16' ' ' THR . 2.0 tt0 -170.85 -149.74 0.07 Allowed 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 -178.894 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 5' ' ' MET . . . . . 0.565 ' H ' ' CG ' ' B' ' 4' ' ' GLU . 60.8 mtt -79.26 88.22 4.93 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.871 0.367 . . . . 0.0 110.227 179.187 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 65.8 ttt180 -67.13 127.67 33.48 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.179 -0.464 . . . . 0.0 109.931 -179.557 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . 0.413 ' HG2' ' N ' ' B' ' 8' ' ' LYS . 55.2 tt0 -131.5 150.0 52.31 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.106 0.479 . . . . 0.0 110.792 -178.798 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . 0.413 ' N ' ' HG2' ' B' ' 7' ' ' GLU . 41.3 mttm -87.63 96.47 10.43 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 108.031 -1.1 . . . . 0.0 108.031 177.528 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . 0.636 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 3.1 mm? -75.31 55.21 0.76 Allowed 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 -177.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 10' ' ' CYS . . . . . 0.432 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 73.4 m -76.24 121.8 23.44 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.697 179.018 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 55.26 -116.96 7.54 Favored Glycine 0 CA--C 1.52 0.4 0 CA-C-N 116.074 -0.512 . . . . 0.0 114.321 178.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 19.5 t-160 -50.89 -32.62 21.08 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 112.794 0.665 . . . . 0.0 112.794 -178.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 13' ' ' HIS . . . . . 0.635 ' HB3' ' HA ' ' B' ' 9' ' ' LEU . 20.7 m170 -59.48 -46.25 89.33 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.892 -179.273 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 14' ' ' PHE . . . . . . . . . . . . . 44.8 t80 -59.97 -40.88 90.59 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.076 0.465 . . . . 0.0 109.948 179.135 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . 0.471 ' O ' HG23 ' B' ' 19' ' ' VAL . 46.3 t -59.09 -55.35 24.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.46 -0.791 . . . . 0.0 111.439 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . 0.438 ' HG3' ' O ' ' B' ' 13' ' ' HIS . 2.8 ptm180 -63.18 -38.04 89.59 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.533 -179.484 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . 0.618 ' HB1' ' HG ' ' A' ' 20' ' ' LEU . . . -64.24 -47.46 79.54 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.714 0.293 . . . . 0.0 110.929 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 18' ' ' LEU . . . . . 0.443 HD23 ' HB2' ' B' ' 22' ' ' CYS . 1.5 tt -60.46 -51.43 69.51 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.688 -179.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 19' ' ' VAL . . . . . 0.715 HG22 ' HD1' ' B' ' 27' ' ' TRP . 67.8 t -59.85 -38.19 75.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -179.511 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . 0.756 ' NE ' ' HA ' ' B' ' 20' ' ' ARG . 0.3 OUTLIER -83.24 -54.83 4.71 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -178.326 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 60.9 t -64.14 -50.72 75.66 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.554 -178.458 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 22' ' ' CYS . . . . . 0.537 ' HB3' ' OG ' ' B' ' 28' ' ' SER . 60.8 m -86.11 43.1 1.03 Allowed 'General case' 0 C--O 1.217 -0.616 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 178.541 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -69.76 135.97 27.13 Favored Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.428 -0.891 . . . . 0.0 114.179 -178.198 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -169.23 -132.71 1.48 Allowed Glycine 0 N--CA 1.449 -0.482 0 N-CA-C 109.726 -1.349 . . . . 0.0 109.726 179.305 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -59.99 -39.49 70.23 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.282 1.988 . . . . 0.0 109.801 177.952 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . 0.679 ' HG3' ' HB3' ' B' ' 31' ' ' ALA . 6.8 mmm-85 -138.76 -62.75 0.55 Allowed 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 107.286 -1.375 . . . . 0.0 107.286 177.505 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 27' ' ' TRP . . . . . 0.715 ' HD1' HG22 ' B' ' 19' ' ' VAL . 0.0 OUTLIER -168.57 -105.83 0.01 OUTLIER 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.336 177.172 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . 0.859 ' HB3' ' HD2' ' A' ' 25' ' ' PRO . 58.6 m -164.11 49.73 0.13 Allowed 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 113.063 0.764 . . . . 0.0 113.063 179.805 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 2.5 p -146.97 12.93 1.12 Allowed 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 120.986 0.422 . . . . 0.0 111.121 179.063 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 30' ' ' GLU . . . . . 0.475 ' HB3' ' CH2' ' B' ' 27' ' ' TRP . 4.1 tt0 178.37 -41.71 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 107.353 -1.351 . . . . 0.0 107.353 -179.766 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 31' ' ' ALA . . . . . 0.679 ' HB3' ' HG3' ' B' ' 26' ' ' ARG . . . . . . . . 0 N--CA 1.442 -0.834 0 CA-C-N 113.173 -1.83 . . . . 0.0 107.621 179.418 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . 0.795 ' HB3' ' HE1' ' A' ' 9' ' ' TYR . . . . . . . . 0 N--CA 1.48 1.074 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -153.83 133.92 13.26 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 179.575 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -173.32 122.26 0.37 Allowed 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 -179.867 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -76.23 47.96 0.49 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.138 0.494 . . . . 0.0 111.507 -179.378 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -176.42 113.17 0.25 Allowed Pre-proline 0 C--N 1.327 -0.398 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_exo -61.01 -42.17 38.8 Favored 'Trans proline' 0 CA--C 1.526 0.077 0 C-N-CA 123.306 2.671 . . . . 0.0 113.203 -178.778 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.3 -44.45 95.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.395 0.617 . . . . 0.0 110.142 179.642 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.403 ' HA ' ' HD2' ' A' ' 8' ' ' ARG . 17.8 tpt180 -66.5 -48.86 68.48 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.617 179.091 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . 0.795 ' HE1' ' HB3' ' A' ' 1' ' ' ALA . 23.6 t80 -55.52 -50.97 68.57 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 114.203 -1.362 . . . . 0.0 111.354 -179.695 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.694 ' O ' ' HA2' ' A' ' 14' ' ' GLY . 41.6 m -69.8 -16.04 63.22 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.796 179.99 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.432 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 24.0 t -85.3 -53.81 4.99 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.764 0.792 . . . . 0.0 109.605 178.821 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 98.6 mt -66.88 -60.38 2.71 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 114.635 -1.166 . . . . 0.0 111.642 -179.608 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 24.8 m -82.08 -42.42 19.23 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.425 -179.679 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.694 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 91.72 142.89 11.14 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.762 -0.732 . . . . 0.0 111.421 -178.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.623 ' HB2' ' CB ' ' A' ' 19' ' ' ASP . 29.9 p -141.06 151.5 44.08 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.579 0.228 . . . . 0.0 110.438 -179.117 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.67 ' HB ' ' HB3' ' B' ' 4' ' ' GLU . 27.8 p -76.63 170.59 16.14 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.607 -179.278 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 84.9 mm-40 -62.15 -38.0 87.34 Favored 'General case' 0 C--O 1.234 0.245 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 178.509 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 90.7 mm-40 -62.78 -37.5 86.9 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 115.397 -0.82 . . . . 0.0 109.147 177.429 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.623 ' CB ' ' HB2' ' A' ' 15' ' ' CYS . 91.8 m-20 -59.67 -43.41 94.0 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.342 -0.844 . . . . 0.0 109.022 178.355 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.618 ' HG ' ' HB1' ' B' ' 17' ' ' ALA . 1.8 mm? -61.25 -42.13 98.1 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 177.299 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.569 ' HA ' ' SG ' ' A' ' 24' ' ' CYS . 32.1 tp -57.98 -40.46 80.73 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.54 179.76 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.418 HG21 ' HG2' ' B' ' 1' ' ' PRO . 3.9 m -63.12 -22.17 66.68 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.27 0.557 . . . . 0.0 110.823 179.233 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 93.4 mt -82.64 -21.4 35.06 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.45 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.569 ' SG ' ' HA ' ' A' ' 21' ' ' LEU . 3.1 m -69.31 122.99 87.36 Favored Pre-proline 0 CA--C 1.53 0.18 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 -179.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.859 ' HD2' ' HB3' ' B' ' 28' ' ' SER . 6.3 Cg_exo -73.58 121.07 6.81 Favored 'Trans proline' 0 N--CA 1.459 -0.508 0 C-N-CA 122.885 2.39 . . . . 0.0 112.12 -179.781 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.408 ' CE2' ' HB2' ' A' ' 24' ' ' CYS . 0.2 OUTLIER . . . . . 0 C--O 1.251 1.175 0 CA-C-O 117.457 -1.258 . . . . 0.0 109.533 179.467 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 1' ' ' PRO . . . . . 0.478 ' HD2' ' OG1' ' A' ' 22' ' ' THR . 5.1 Cg_exo . . . . . 0 N--CA 1.479 0.635 0 N-CA-C 110.75 -0.519 . . . . 0.0 110.75 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 2' ' ' THR . . . . . 0.566 ' HB ' ' HG3' ' B' ' 4' ' ' GLU . 1.3 p -119.52 136.63 24.77 Favored Pre-proline 0 C--N 1.322 -0.619 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.336 -179.582 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -82.47 49.45 3.11 Favored 'Trans proline' 0 N--CA 1.461 -0.41 0 C-N-CA 122.945 2.43 . . . . 0.0 112.54 -179.807 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . 0.69 ' HB2' HG21 ' A' ' 16' ' ' THR . 25.7 mt-10 -85.18 -158.23 0.36 Allowed 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.029 -0.987 . . . . 0.0 109.685 179.344 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 5' ' ' MET . . . . . . . . . . . . . 16.9 tpt -82.23 67.41 8.23 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 177.647 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 42.0 mtt180 -56.62 118.26 4.68 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.525 -0.762 . . . . 0.0 111.855 -178.396 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . 0.524 ' OE2' ' HG2' ' B' ' 8' ' ' LYS . 4.7 tp10 -107.9 158.93 16.92 Favored 'General case' 0 N--CA 1.44 -0.929 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 178.767 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . 0.524 ' HG2' ' OE2' ' B' ' 7' ' ' GLU . 11.7 mmtm -82.72 97.8 8.75 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-O 121.372 0.605 . . . . 0.0 110.811 -177.713 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . 0.748 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 3.3 mm? -83.37 58.29 4.43 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.573 179.545 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 10' ' ' CYS . . . . . 0.512 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 71.9 m -65.07 130.95 45.24 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.857 -0.611 . . . . 0.0 112.041 -179.701 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 53.94 -122.23 22.13 Favored Glycine 0 C--N 1.332 0.325 0 CA-C-N 115.772 -0.649 . . . . 0.0 114.461 178.178 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 17.2 t-160 -52.55 -29.28 24.68 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 123.005 0.522 . . . . 0.0 112.17 -178.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 13' ' ' HIS . . . . . 0.576 ' O ' ' HG3' ' B' ' 16' ' ' ARG . 29.4 m170 -59.58 -41.86 91.19 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.736 -0.211 . . . . 0.0 110.49 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 14' ' ' PHE . . . . . 0.507 ' CZ ' ' HB2' ' A' ' 6' ' ' PRO . 8.1 t80 -62.31 -47.51 83.94 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.091 0.472 . . . . 0.0 109.931 178.387 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 56.0 t -55.58 -53.31 37.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.634 -179.645 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . 0.576 ' HG3' ' O ' ' B' ' 13' ' ' HIS . 0.0 OUTLIER -63.48 -39.03 93.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.422 -179.525 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . 0.42 ' N ' ' HE ' ' B' ' 16' ' ' ARG . . . -65.66 -52.91 47.97 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.557 0.218 . . . . 0.0 111.517 -179.681 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 18' ' ' LEU . . . . . 0.641 HD13 HD23 ' A' ' 23' ' ' LEU . 38.0 tp -57.78 -53.75 54.67 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.825 -179.329 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 19' ' ' VAL . . . . . 0.527 HG12 ' NH1' ' B' ' 20' ' ' ARG . 85.0 t -60.35 -42.85 92.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 -178.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . 0.723 HH11 ' HA ' ' B' ' 20' ' ' ARG . 2.4 mmt-85 -72.0 -47.98 48.12 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 113.159 0.8 . . . . 0.0 113.159 -178.921 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 21' ' ' VAL . . . . . 0.43 HG11 ' O ' ' A' ' 17' ' ' GLN . 76.6 t -64.74 -46.81 91.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 N-CA-C 112.197 0.443 . . . . 0.0 112.197 -178.879 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 89.5 m -69.34 -40.54 77.48 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.941 -0.304 . . . . 0.0 111.555 -179.379 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 119.78 157.36 10.25 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 119.979 -1.105 . . . . 0.0 113.259 179.243 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 94.49 154.92 31.31 Favored Glycine 0 N--CA 1.446 -0.635 0 C-N-CA 120.916 -0.659 . . . . 0.0 112.788 179.596 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -59.7 -34.46 96.21 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.723 2.282 . . . . 0.0 110.854 179.563 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 49.5 mtp180 -141.12 -172.49 3.5 Favored 'General case' 0 CA--C 1.498 -1.053 0 CA-C-N 115.009 -0.996 . . . . 0.0 108.426 178.335 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 27' ' ' TRP . . . . . 1.023 ' HB3' ' HB3' ' B' ' 31' ' ' ALA . 0.0 OUTLIER -88.27 54.52 3.09 Favored 'General case' 0 N--CA 1.432 -1.342 0 N-CA-C 107.575 -1.269 . . . . 0.0 107.575 176.791 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 40.2 m -63.42 59.35 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 114.729 -1.123 . . . . 0.0 112.99 -178.607 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . 0.439 ' HB ' ' CZ3' ' B' ' 27' ' ' TRP . 97.4 m -168.31 -36.54 0.02 OUTLIER 'General case' 0 C--N 1.318 -0.793 0 C-N-CA 124.369 1.068 . . . . 0.0 108.298 179.566 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -134.51 15.75 3.7 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.333 -0.848 . . . . 0.0 111.134 -179.395 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 31' ' ' ALA . . . . . 1.023 ' HB3' ' HB3' ' B' ' 27' ' ' TRP . . . . . . . . 0 C--O 1.247 0.95 0 CA-C-O 118.234 -0.889 . . . . 0.0 109.833 -179.401 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . 0.566 ' HA ' ' O ' ' A' ' 23' ' ' LEU . . . . . . . . 0 N--CA 1.476 0.833 0 N-CA-C 110.265 -0.272 . . . . 0.0 110.265 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -82.31 56.11 3.12 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.157 -179.807 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -174.0 133.63 0.44 Allowed 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 3.6 p -56.36 -40.3 74.29 Favored 'General case' 0 C--N 1.319 -0.726 0 O-C-N 123.809 0.693 . . . . 0.0 111.374 -179.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -151.51 85.66 4.85 Favored Pre-proline 0 C--N 1.319 -0.74 0 CA-C-O 122.288 1.042 . . . . 0.0 109.517 178.451 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.507 ' HB2' ' CZ ' ' B' ' 14' ' ' PHE . 23.4 Cg_exo -59.24 -38.97 82.54 Favored 'Trans proline' 0 C--N 1.328 -0.525 0 C-N-CA 123.999 3.132 . . . . 0.0 112.646 -179.061 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.19 -43.92 83.12 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.972 0.415 . . . . 0.0 110.75 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -67.87 -48.93 64.7 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.095 179.505 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 33.2 t80 -56.52 -52.99 62.68 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 114.936 -1.029 . . . . 0.0 111.306 -179.702 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.748 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 22.5 m -65.46 -23.9 67.03 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.036 -0.529 . . . . 0.0 112.32 -179.73 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.512 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 53.7 t -82.12 -52.89 6.55 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.413 0.625 . . . . 0.0 110.598 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 15.3 tp -69.71 -63.39 1.08 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.041 -0.982 . . . . 0.0 112.182 -178.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 36.3 t -81.3 -33.97 32.27 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.395 -178.682 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.687 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 88.6 158.47 33.82 Favored Glycine 0 N--CA 1.443 -0.887 0 C-N-CA 120.57 -0.824 . . . . 0.0 111.156 -178.541 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.5 ' SG ' HD23 ' B' ' 9' ' ' LEU . 26.5 p -151.04 166.8 29.61 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.818 0.309 . . . . 0.0 110.795 -179.204 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.69 HG21 ' HB2' ' B' ' 4' ' ' GLU . 0.2 OUTLIER -121.95 -169.97 1.97 Allowed 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 116.444 -0.343 . . . . 0.0 111.323 -179.17 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.43 ' O ' HG11 ' B' ' 21' ' ' VAL . 23.8 pt20 -58.4 -51.71 68.67 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -178.399 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.535 ' HB2' ' OG1' ' B' ' 2' ' ' THR . 95.4 mm-40 -63.18 -35.96 82.04 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.449 ' HB2' ' H ' ' A' ' 16' ' ' THR . 43.7 m-20 -58.68 -47.0 86.01 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.033 178.461 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -66.19 -44.68 83.28 Favored 'General case' 0 CA--C 1.522 -0.112 0 CA-C-O 120.878 0.37 . . . . 0.0 110.488 178.86 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 31.0 tp -55.36 -53.36 57.2 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.044 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.478 ' OG1' ' HD2' ' B' ' 1' ' ' PRO . 35.4 p -64.64 -12.05 41.84 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.093 -0.503 . . . . 0.0 112.24 179.919 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.641 HD23 HD13 ' B' ' 18' ' ' LEU . 24.6 tp -78.66 -28.74 45.44 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 179.688 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.424 ' HA ' ' HD3' ' A' ' 25' ' ' PRO . 93.2 m -84.34 139.18 38.79 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.672 179.563 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' A' ' 24' ' ' CYS . 16.0 Cg_exo -67.99 127.65 16.4 Favored 'Trans proline' 0 N--CA 1.461 -0.437 0 C-N-CA 123.017 2.478 . . . . 0.0 111.882 -179.855 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 23.0 t80 . . . . . 0 C--O 1.248 1.011 0 CA-C-N 115.334 -0.848 . . . . 0.0 108.806 179.941 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 1' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo . . . . . 0 N--CA 1.481 0.781 0 N-CA-C 109.615 -0.956 . . . . 0.0 109.615 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 2' ' ' THR . . . . . 0.597 ' HB ' ' HD2' ' B' ' 3' ' ' PRO . 0.1 OUTLIER -153.89 179.04 1.39 Allowed Pre-proline 0 C--N 1.314 -0.963 0 CA-C-N 114.159 -1.382 . . . . 0.0 107.636 -178.385 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . 0.597 ' HD2' ' HB ' ' B' ' 2' ' ' THR . 30.2 Cg_endo -64.74 73.97 0.21 Allowed 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 121.953 1.769 . . . . 0.0 111.531 179.508 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . 0.401 ' N ' ' O ' ' B' ' 2' ' ' THR . 0.5 OUTLIER -70.57 36.33 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 124.233 1.013 . . . . 0.0 112.439 -178.637 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 5' ' ' MET . . . . . 0.441 ' H ' ' C ' ' B' ' 3' ' ' PRO . 21.9 ptm -64.23 115.35 4.93 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.289 179.548 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 6' ' ' ARG . . . . . 0.628 ' HA ' ' O ' ' A' ' 15' ' ' CYS . 19.8 mmm180 -85.38 125.96 33.39 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.82 -179.387 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 77.4 tt0 -129.58 144.94 51.49 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 178.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . 0.447 ' HA ' ' O ' ' A' ' 10' ' ' CYS . 24.5 mmtp -82.47 104.68 12.93 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 179.383 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . 0.769 ' HB2' ' SG ' ' A' ' 10' ' ' CYS . 6.5 mp -81.12 52.04 1.71 Allowed 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 -179.158 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 71.0 m -72.56 121.32 19.5 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.172 178.856 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 61.08 -120.94 24.89 Favored Glycine 0 CA--C 1.522 0.47 0 N-CA-C 114.417 0.527 . . . . 0.0 114.417 179.168 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 13.5 t-80 -50.18 -33.36 18.95 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 113.589 0.959 . . . . 0.0 113.589 -178.082 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 13' ' ' HIS . . . . . 0.604 ' HB3' ' HA ' ' B' ' 9' ' ' LEU . 24.3 m170 -58.34 -41.43 84.62 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.914 -0.315 . . . . 0.0 111.024 -179.117 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 14' ' ' PHE . . . . . 0.714 ' HA ' HD23 ' B' ' 9' ' ' LEU . 22.5 t80 -62.63 -45.09 94.44 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.014 0.435 . . . . 0.0 110.127 179.321 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 51.4 t -59.02 -58.78 5.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.407 -0.815 . . . . 0.0 112.119 -179.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . 0.402 HH21 HD11 ' B' ' 9' ' ' LEU . 0.0 OUTLIER -59.53 -39.79 85.08 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.872 -179.104 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.01 -43.27 88.17 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.967 -0.293 . . . . 0.0 111.069 -179.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 18' ' ' LEU . . . . . 0.495 HD22 ' CH2' ' B' ' 27' ' ' TRP . 9.7 mt -60.01 -56.3 23.43 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.826 179.802 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 19' ' ' VAL . . . . . 0.661 ' O ' ' HA3' ' B' ' 23' ' ' GLY . 7.8 t -65.93 -29.04 45.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -178.569 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . 0.571 ' NE ' ' HA ' ' B' ' 20' ' ' ARG . 3.3 tpm_? -80.12 -59.79 2.58 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 119.906 -0.718 . . . . 0.0 111.512 -179.828 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 60.2 t -65.19 -50.28 74.68 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 CA-C-N 115.209 -0.905 . . . . 0.0 111.739 -178.434 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 56.4 m -101.97 37.28 1.88 Allowed 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.926 0.393 . . . . 0.0 110.635 -179.669 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . 0.661 ' HA3' ' O ' ' B' ' 19' ' ' VAL . . . -127.65 121.32 3.77 Favored Glycine 0 N--CA 1.445 -0.716 0 C-N-CA 120.486 -0.864 . . . . 0.0 112.076 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 166.02 -111.76 0.47 Allowed Glycine 0 N--CA 1.443 -0.898 0 N-CA-C 110.86 -0.896 . . . . 0.0 110.86 -179.635 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -63.07 -31.47 76.0 Favored 'Trans proline' 0 N--CA 1.465 -0.194 0 C-N-CA 122.574 2.182 . . . . 0.0 111.939 179.145 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 11.9 mmm180 -144.82 149.56 35.63 Favored 'General case' 0 CA--C 1.498 -1.033 0 CA-C-O 121.739 0.78 . . . . 0.0 111.034 179.741 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 27' ' ' TRP . . . . . 0.883 ' HB3' ' HB3' ' B' ' 31' ' ' ALA . 0.0 OUTLIER -159.18 52.22 0.38 Allowed 'General case' 0 C--N 1.305 -1.344 0 CA-C-N 113.365 -1.743 . . . . 0.0 108.06 178.837 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 73.8 m -58.2 68.48 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 114.056 1.132 . . . . 0.0 114.056 -178.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . 0.414 ' N ' ' O ' ' B' ' 27' ' ' TRP . 97.0 m -173.55 -38.95 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 179.17 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 30' ' ' GLU . . . . . 0.554 ' HB3' ' CD1' ' B' ' 27' ' ' TRP . 40.6 tt0 -119.65 -31.3 4.59 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 113.765 -1.562 . . . . 0.0 110.422 -179.492 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 31' ' ' ALA . . . . . 0.883 ' HB3' ' HB3' ' B' ' 27' ' ' TRP . . . . . . . . 0 C--O 1.248 0.995 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.813 -178.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.067 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -157.51 146.1 19.44 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 179.685 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.472 ' HB1' ' HB2' ' A' ' 9' ' ' TYR . . . -79.92 60.01 3.37 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.055 0.455 . . . . 0.0 111.104 -179.811 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 7.4 p -77.37 50.8 0.81 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.597 -179.884 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.502 ' HB3' ' HB2' ' A' ' 8' ' ' ARG . 32.0 t-20 -171.64 111.83 0.4 Allowed Pre-proline 0 C--N 1.328 -0.363 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.417 ' HB2' ' CZ ' ' B' ' 14' ' ' PHE . 32.1 Cg_exo -59.28 -47.39 17.37 Favored 'Trans proline' 0 C--N 1.334 -0.207 0 C-N-CA 123.371 2.714 . . . . 0.0 113.631 -178.675 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.14 -43.32 95.8 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.347 0.594 . . . . 0.0 110.204 179.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.655 ' HE ' ' HA ' ' A' ' 8' ' ' ARG . 1.1 mmp_? -67.72 -47.59 68.92 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.956 179.147 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . 0.472 ' HB2' ' HB1' ' A' ' 3' ' ' ALA . 9.7 t80 -58.04 -53.4 58.72 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.891 -179.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.769 ' SG ' ' HB2' ' B' ' 9' ' ' LEU . 9.3 t -69.42 -18.4 63.74 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 112.08 0.4 . . . . 0.0 112.08 -178.41 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 26.9 t -85.51 -51.28 6.62 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.798 0.808 . . . . 0.0 109.879 178.817 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 14.9 tp -66.06 -62.5 1.45 Allowed 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 114.559 -1.2 . . . . 0.0 111.284 -179.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 6.8 m -85.07 -45.3 12.23 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.39 -179.165 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.728 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 99.93 144.19 15.7 Favored Glycine 0 N--CA 1.452 -0.264 0 N-CA-C 111.2 -0.76 . . . . 0.0 111.2 -179.077 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.628 ' O ' ' HA ' ' B' ' 6' ' ' ARG . 24.0 p -134.69 -151.03 0.41 Allowed 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 120.749 -0.38 . . . . 0.0 111.303 -178.475 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.553 ' H ' ' HB2' ' A' ' 19' ' ' ASP . 13.1 t -158.9 176.99 11.63 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -179.099 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 5.7 mp0 -56.62 -45.01 81.76 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 123.289 0.368 . . . . 0.0 110.823 -179.546 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -64.23 -41.61 96.93 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.965 0.412 . . . . 0.0 109.956 179.621 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.553 ' HB2' ' H ' ' A' ' 16' ' ' THR . 0.1 OUTLIER -58.73 -38.83 79.21 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.278 -0.873 . . . . 0.0 110.154 178.959 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.582 HD11 HD21 ' B' ' 9' ' ' LEU . 77.5 mt -75.7 -47.26 26.93 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.911 179.292 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 36.3 tp -52.08 -51.96 54.28 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.734 -0.666 . . . . 0.0 112.158 -178.581 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 15.3 t -63.48 -13.03 36.46 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 112.245 0.461 . . . . 0.0 112.245 -179.445 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 39.8 tp -102.73 -16.83 15.87 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.035 -179.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.515 ' HA ' ' HD3' ' A' ' 25' ' ' PRO . 87.4 m -80.59 135.0 53.35 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 120.939 0.399 . . . . 0.0 112.046 -179.092 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.515 ' HD3' ' HA ' ' A' ' 24' ' ' CYS . 4.5 Cg_endo -82.84 134.02 7.08 Favored 'Trans proline' 0 N--CA 1.449 -1.116 0 C-N-CA 123.204 2.603 . . . . 0.0 111.361 178.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 22.4 t80 . . . . . 0 C--O 1.247 0.947 0 CA-C-O 118.14 -0.933 . . . . 0.0 109.802 179.648 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 1' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo . . . . . 0 N--CA 1.486 1.071 0 N-CA-C 110.482 -0.622 . . . . 0.0 110.482 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 2' ' ' THR . . . . . 0.572 ' HB ' ' HD2' ' B' ' 3' ' ' PRO . 0.1 OUTLIER -168.93 177.73 1.14 Allowed Pre-proline 0 C--N 1.316 -0.861 0 N-CA-C 106.256 -1.757 . . . . 0.0 106.256 -178.761 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . 0.572 ' HD2' ' HB ' ' B' ' 2' ' ' THR . 7.2 Cg_endo -53.09 96.89 0.04 OUTLIER 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 121.408 1.405 . . . . 0.0 108.76 178.689 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -58.77 127.35 31.77 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-O 122.615 1.198 . . . . 0.0 113.525 -175.006 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 5' ' ' MET . . . . . . . . . . . . . 22.1 ptt? -169.84 46.15 0.03 OUTLIER 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 112.457 -2.156 . . . . 0.0 105.786 179.464 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 21.2 mtp85 -56.38 118.62 4.94 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 113.08 -1.873 . . . . 0.0 112.082 -177.137 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 74.2 tt0 -94.15 142.08 27.81 Favored 'General case' 0 N--CA 1.444 -0.738 0 N-CA-C 108.374 -0.973 . . . . 0.0 108.374 178.151 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 18.0 mmtp -76.06 101.54 5.33 Favored 'General case' 0 C--N 1.315 -0.923 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 179.469 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . 1.023 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 8.4 mp -80.91 51.9 1.64 Allowed 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 112.57 0.581 . . . . 0.0 112.57 -178.772 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 73.5 m -70.67 120.21 15.95 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.061 178.645 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 61.65 -120.24 21.55 Favored Glycine 0 CA--C 1.523 0.545 0 N-CA-C 114.542 0.577 . . . . 0.0 114.542 179.207 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 13.3 t-80 -49.56 -33.99 16.39 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 113.751 1.019 . . . . 0.0 113.751 -177.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 13' ' ' HIS . . . . . 0.644 ' CB ' ' HA ' ' B' ' 9' ' ' LEU . 25.7 m170 -58.28 -41.27 84.02 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.795 -0.362 . . . . 0.0 110.949 -179.252 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 14' ' ' PHE . . . . . 0.992 ' HA ' HD23 ' B' ' 9' ' ' LEU . 31.7 t80 -62.51 -46.39 88.65 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.898 0.38 . . . . 0.0 110.074 178.866 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 62.1 t -55.5 -57.73 6.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.571 -0.741 . . . . 0.0 112.05 -179.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.08 -40.18 92.71 Favored 'General case' 0 N--CA 1.464 0.226 0 N-CA-C 112.342 0.497 . . . . 0.0 112.342 -178.93 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . 0.518 ' HB3' HD21 ' B' ' 9' ' ' LEU . . . -70.05 -46.82 64.19 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.612 -179.601 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 18' ' ' LEU . . . . . 0.474 ' HG ' ' CD1' ' B' ' 27' ' ' TRP . 57.7 tp -56.76 -52.17 66.05 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.836 -179.877 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 19' ' ' VAL . . . . . 0.53 ' HA ' ' O ' ' B' ' 26' ' ' ARG . 89.7 t -62.47 -48.14 89.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.824 -0.625 . . . . 0.0 112.252 -179.659 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . 0.889 ' HE ' ' HA ' ' B' ' 20' ' ' ARG . 0.0 OUTLIER -70.52 -40.85 73.25 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 114.031 1.123 . . . . 0.0 114.031 -178.322 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 71.3 t -73.11 -46.77 50.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -178.233 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 22' ' ' CYS . . . . . 0.41 ' HB3' ' OG ' ' B' ' 28' ' ' SER . 80.6 m -75.99 -36.04 59.35 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 -178.225 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -161.33 -127.24 0.87 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 119.294 -1.431 . . . . 0.0 113.993 -179.243 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -146.11 -64.49 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 121.179 -0.534 . . . . 0.0 112.143 -179.465 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 25' ' ' PRO . . . . . 0.849 ' HB2' ' HB1' ' B' ' 31' ' ' ALA . 23.9 Cg_exo -63.15 -41.95 25.45 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 122.181 1.921 . . . . 0.0 110.515 179.053 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . 0.643 ' HB2' ' HB3' ' B' ' 31' ' ' ALA . 12.0 mmt85 -140.25 -90.92 0.17 Allowed 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 115.195 -0.911 . . . . 0.0 109.376 177.723 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 27' ' ' TRP . . . . . 0.474 ' CD1' ' HG ' ' B' ' 18' ' ' LEU . 0.0 OUTLIER -156.25 -86.62 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 118.316 0.507 . . . . 0.0 111.93 179.731 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . 0.41 ' OG ' ' HB3' ' B' ' 22' ' ' CYS . 55.7 m -154.56 58.15 0.69 Allowed 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 113.551 0.945 . . . . 0.0 113.551 -178.251 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . 0.407 HG23 ' HZ3' ' B' ' 27' ' ' TRP . 4.3 t 179.9 -54.72 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.361 0 O-C-N 122.424 -0.172 . . . . 0.0 111.122 177.696 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -85.73 -39.23 17.4 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 178.485 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 31' ' ' ALA . . . . . 0.849 ' HB1' ' HB2' ' B' ' 25' ' ' PRO . . . . . . . . 0 C--O 1.252 1.204 0 CA-C-O 116.739 -1.601 . . . . 0.0 107.221 179.563 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.03 0 N-CA-C 110.416 -0.216 . . . . 0.0 110.416 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -70.42 144.71 51.44 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.706 179.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -164.78 128.6 2.44 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 5.7 t -56.44 -33.13 65.57 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.361 -179.48 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -178.0 108.68 0.22 Allowed Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.663 178.719 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.688 ' HB3' HD13 ' A' ' 23' ' ' LEU . 16.9 Cg_exo -64.33 -44.88 10.68 Favored 'Trans proline' 0 C--N 1.333 -0.283 0 C-N-CA 123.421 2.747 . . . . 0.0 113.179 -179.053 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -56.71 -42.07 78.51 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.051 0.453 . . . . 0.0 110.527 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 13.9 ttm180 -61.7 -54.45 42.41 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.012 179.367 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 35.3 t80 -57.57 -49.16 77.3 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.627 -1.17 . . . . 0.0 111.295 -179.705 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 1.023 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 54.3 m -65.23 -27.39 68.63 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.966 -0.561 . . . . 0.0 112.243 -179.365 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 52.2 t -80.83 -52.7 7.2 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.556 0.693 . . . . 0.0 110.23 179.516 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 90.8 mt -64.25 -57.9 8.1 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 114.891 -1.05 . . . . 0.0 112.44 -179.175 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 35.5 t -93.3 -44.35 8.35 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 111.725 0.269 . . . . 0.0 111.725 -179.006 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.652 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 105.26 157.82 22.94 Favored Glycine 0 N--CA 1.452 -0.26 0 N-CA-C 110.924 -0.87 . . . . 0.0 110.924 -178.814 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.533 ' HB2' ' CB ' ' A' ' 19' ' ' ASP . 25.7 p -151.28 159.75 44.18 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 117.343 0.571 . . . . 0.0 112.513 -178.295 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 48.2 p -106.73 -174.41 2.53 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.242 179.583 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 54.9 tt0 -57.42 -48.97 77.73 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 111.933 0.346 . . . . 0.0 111.933 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 60.9 tp60 -59.55 -41.96 91.29 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.109 0.481 . . . . 0.0 109.884 179.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.638 ' O ' ' HG ' ' A' ' 23' ' ' LEU . 34.2 m-20 -57.14 -44.94 83.88 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.274 -0.875 . . . . 0.0 109.629 179.061 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.667 HD13 HD12 ' A' ' 23' ' ' LEU . 3.6 mm? -59.65 -48.37 81.93 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-O 120.768 0.318 . . . . 0.0 110.527 178.228 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 8.9 tt -55.62 -47.46 76.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.68 179.472 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 8.3 m -60.59 -25.21 66.05 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.331 -0.85 . . . . 0.0 111.816 179.605 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.688 HD13 ' HB3' ' A' ' 6' ' ' PRO . 96.6 mt -73.09 -30.6 63.79 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.272 179.324 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 7.4 m -74.74 165.76 51.05 Favored Pre-proline 0 C--N 1.326 -0.419 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.034 178.766 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -47.87 112.07 0.52 Allowed 'Trans proline' 0 C--N 1.353 0.763 0 C-N-CA 122.669 2.246 . . . . 0.0 112.594 -178.796 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 24.3 t80 . . . . . 0 C--O 1.243 0.715 0 N-CA-C 107.713 -1.217 . . . . 0.0 107.713 -179.427 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 1' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo . . . . . 0 N--CA 1.485 0.98 0 N-CA-C 110.688 -0.543 . . . . 0.0 110.688 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 2' ' ' THR . . . . . 0.567 ' HB ' ' HD2' ' B' ' 3' ' ' PRO . 0.6 OUTLIER -155.72 173.33 4.99 Favored Pre-proline 0 C--N 1.318 -0.782 0 CA-C-N 115.084 -0.962 . . . . 0.0 108.671 -178.905 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . 0.567 ' HD2' ' HB ' ' B' ' 2' ' ' THR . 56.6 Cg_endo -70.62 56.05 1.71 Allowed 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.389 2.059 . . . . 0.0 112.588 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . 0.574 ' HB2' HH12 ' B' ' 6' ' ' ARG . 2.7 mp0 -68.07 131.43 45.41 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.18 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 5' ' ' MET . . . . . . . . . . . . . 49.6 ttm -66.07 112.99 4.15 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.924 0.392 . . . . 0.0 109.964 179.255 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 6' ' ' ARG . . . . . 0.747 ' HD2' ' HA ' ' A' ' 15' ' ' CYS . 47.0 mmt-85 -79.48 125.78 30.01 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.307 179.877 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -91.68 131.58 36.97 Favored 'General case' 0 N--CA 1.446 -0.635 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 -179.95 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -80.31 86.4 5.68 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 179.365 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . 0.992 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 14.6 mt -74.11 55.1 0.56 Allowed 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 -176.891 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 10' ' ' CYS . . . . . 0.409 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 73.8 m -74.24 117.36 15.96 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 177.878 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 63.46 -121.76 24.92 Favored Glycine 0 CA--C 1.521 0.459 0 C-N-CA 121.157 -0.544 . . . . 0.0 113.78 179.813 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 23.6 t-160 -51.79 -32.08 29.71 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 112.825 0.676 . . . . 0.0 112.825 -178.706 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 13' ' ' HIS . . . . . 0.701 ' CB ' ' HA ' ' B' ' 9' ' ' LEU . 52.0 m170 -57.57 -39.76 77.43 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 120.437 -0.505 . . . . 0.0 110.74 -179.387 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 14' ' ' PHE . . . . . 0.848 ' HA ' HD13 ' B' ' 9' ' ' LEU . 34.4 t80 -62.01 -44.34 96.92 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.331 0.586 . . . . 0.0 109.823 178.766 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 55.1 t -62.02 -49.23 84.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.121 -0.945 . . . . 0.0 111.76 179.867 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . 0.649 ' HG2' ' HA ' ' B' ' 13' ' ' HIS . 19.2 ptt180 -62.51 -44.99 95.02 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.731 -178.885 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . 0.517 ' N ' ' HG3' ' B' ' 16' ' ' ARG . . . -65.54 -41.28 93.2 Favored 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 120.925 -0.31 . . . . 0.0 111.021 -179.854 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 63.6 tp -59.35 -54.72 43.51 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.175 179.89 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 22.3 m -64.67 -28.11 44.08 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.187 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -179.387 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . 0.756 ' NE ' ' HA ' ' B' ' 20' ' ' ARG . 3.5 mmp_? -84.49 -48.93 9.09 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -179.41 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 21' ' ' VAL . . . . . 0.557 HG13 ' HG3' ' A' ' 17' ' ' GLN . 58.4 t -63.54 -47.21 92.56 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.781 -179.245 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 22' ' ' CYS . . . . . 0.423 ' O ' ' HZ3' ' B' ' 27' ' ' TRP . 79.3 m -102.55 37.83 1.83 Allowed 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 120.412 -0.515 . . . . 0.0 111.753 -179.272 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -172.59 121.88 0.9 Allowed Glycine 0 N--CA 1.446 -0.661 0 C-N-CA 120.085 -1.055 . . . . 0.0 112.883 179.542 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -77.86 -65.97 1.82 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.896 -0.669 . . . . 0.0 112.259 179.502 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_exo -68.63 -54.63 0.27 Allowed 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.375 2.05 . . . . 0.0 111.698 179.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 29.2 mtm105 -150.5 -140.45 0.1 Allowed 'General case' 0 CA--C 1.512 -0.484 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 179.424 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 27' ' ' TRP . . . . . 0.716 ' HA ' ' CE3' ' B' ' 27' ' ' TRP . 0.0 OUTLIER -85.07 50.7 1.99 Allowed 'General case' 0 N--CA 1.438 -1.074 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 178.074 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 24.7 m -64.87 64.74 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 114.594 -1.185 . . . . 0.0 113.347 -179.037 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . 0.507 ' HB ' ' CZ3' ' B' ' 27' ' ' TRP . 23.7 m -169.86 -44.12 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 179.143 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 30' ' ' GLU . . . . . 0.469 ' HB3' ' NE1' ' B' ' 27' ' ' TRP . 88.5 tt0 -114.08 -23.58 9.45 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.026 -0.988 . . . . 0.0 110.605 -179.819 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 31' ' ' ALA . . . . . 0.691 ' HB3' ' HB3' ' B' ' 27' ' ' TRP . . . . . . . . 0 C--O 1.246 0.915 0 CA-C-O 118.626 -0.702 . . . . 0.0 111.078 -179.047 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.236 0 N-CA-C 110.417 -0.216 . . . . 0.0 110.417 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -64.89 144.15 57.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.16 -179.761 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -169.87 124.66 0.79 Allowed 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 116.134 -0.485 . . . . 0.0 109.982 179.897 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 6.4 p -75.29 62.55 1.29 Allowed 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.814 179.616 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.564 ' HB3' ' HB2' ' A' ' 8' ' ' ARG . 13.3 t-20 -168.59 120.79 0.68 Allowed Pre-proline 0 C--N 1.325 -0.488 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 -178.585 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -53.0 -55.28 3.86 Favored 'Trans proline' 0 N--CA 1.473 0.301 0 C-N-CA 123.438 2.759 . . . . 0.0 114.156 -178.261 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -58.83 -41.64 87.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.404 0.621 . . . . 0.0 110.401 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.564 ' HB2' ' HB3' ' A' ' 5' ' ' ASN . 13.4 mmt180 -66.21 -44.45 83.84 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.722 179.051 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 7.1 t80 -58.58 -46.77 86.24 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.093 0.473 . . . . 0.0 110.188 178.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.992 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 55.3 m -61.17 -29.42 69.79 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.446 -0.797 . . . . 0.0 112.134 -179.913 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.409 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 44.0 t -86.96 -53.59 4.81 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.552 0.692 . . . . 0.0 111.06 -179.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 9.0 mp -62.79 -40.64 97.97 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.857 -1.065 . . . . 0.0 113.433 -178.673 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 19.6 m -113.71 -42.01 3.5 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 121.074 0.464 . . . . 0.0 111.131 -178.876 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.608 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 105.99 144.13 12.04 Favored Glycine 0 N--CA 1.442 -0.929 0 C-N-CA 120.869 -0.681 . . . . 0.0 111.512 -179.073 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.747 ' HA ' ' HD2' ' B' ' 6' ' ' ARG . 31.0 p -139.04 149.58 44.79 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 -179.453 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.533 HG22 ' OD1' ' A' ' 19' ' ' ASP . 6.2 t -111.78 -167.37 1.17 Allowed 'General case' 0 C--N 1.327 -0.384 0 O-C-N 122.256 -0.277 . . . . 0.0 110.702 -179.037 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.557 ' HG3' HG13 ' B' ' 21' ' ' VAL . 53.7 tt0 -53.28 -46.28 69.24 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.199 -0.455 . . . . 0.0 112.067 -179.186 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.404 ' H ' HG23 ' A' ' 16' ' ' THR . 70.2 mt-30 -60.23 -44.33 95.3 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.691 -0.231 . . . . 0.0 110.819 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.693 ' CB ' ' HB2' ' A' ' 15' ' ' CYS . 1.6 m-20 -58.65 -44.62 90.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.237 -0.438 . . . . 0.0 109.918 179.276 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.555 HD21 HD11 ' B' ' 9' ' ' LEU . 3.9 mm? -66.95 -44.82 79.57 Favored 'General case' 0 CA--C 1.52 -0.2 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.787 179.376 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 19.6 tp -56.86 -48.53 77.89 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.912 -179.232 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 18.2 p -63.6 -15.96 59.56 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 179.786 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 45.3 tp -87.01 -24.76 24.55 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.572 179.611 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.427 ' HA ' ' HD3' ' A' ' 25' ' ' PRO . 79.9 m -84.87 135.24 40.24 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.257 -179.539 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 24' ' ' CYS . 4.6 Cg_exo -77.75 133.66 12.9 Favored 'Trans proline' 0 N--CA 1.456 -0.677 0 C-N-CA 123.151 2.567 . . . . 0.0 112.349 -179.853 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.251 1.157 0 CA-C-O 117.574 -1.203 . . . . 0.0 109.271 179.317 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 1' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo . . . . . 0 N--CA 1.489 1.262 0 CA-C-O 121.579 0.575 . . . . 0.0 110.931 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 2' ' ' THR . . . . . 0.445 HG22 ' HD2' ' B' ' 3' ' ' PRO . 0.0 OUTLIER -157.84 171.42 7.47 Favored Pre-proline 0 C--N 1.316 -0.885 0 CA-C-N 114.885 -1.052 . . . . 0.0 108.421 -179.443 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . 0.557 ' HA ' ' O ' ' A' ' 13' ' ' SER . 52.8 Cg_endo -69.31 53.96 0.97 Allowed 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 122.569 2.179 . . . . 0.0 113.433 -179.168 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -78.94 -150.37 0.05 Allowed 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.339 179.564 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 5' ' ' MET . . . . . . . . . . . . . 14.0 tpt -78.19 52.0 1.06 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.968 0.89 . . . . 0.0 109.743 178.621 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 6' ' ' ARG . . . . . 0.721 ' HG2' HG23 ' A' ' 16' ' ' THR . 26.1 mtt85 -124.11 151.72 43.59 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 114.659 -1.155 . . . . 0.0 108.831 -179.836 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -84.42 131.74 34.64 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.074 0.464 . . . . 0.0 109.77 -179.636 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . 0.452 ' HA ' ' O ' ' A' ' 10' ' ' CYS . 1.5 mppt? -78.85 97.71 6.07 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.546 179.622 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . 0.869 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 15.1 mt -76.25 52.48 0.75 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.417 -0.81 . . . . 0.0 112.49 -178.517 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 69.4 m -72.72 120.2 18.01 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 178.649 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 61.06 -118.07 13.79 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 121.244 -0.503 . . . . 0.0 113.891 179.599 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 18.1 t-160 -54.07 -31.68 52.47 Favored 'General case' 0 N--CA 1.465 0.306 0 N-CA-C 113.06 0.763 . . . . 0.0 113.06 -178.471 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 13' ' ' HIS . . . . . 0.632 ' CB ' ' HA ' ' B' ' 9' ' ' LEU . 26.8 m170 -61.22 -38.76 87.76 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 120.164 -0.614 . . . . 0.0 111.187 -178.668 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 14' ' ' PHE . . . . . 0.793 ' HA ' HD13 ' B' ' 9' ' ' LEU . 33.0 t80 -61.19 -45.0 96.4 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 178.567 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 56.4 t -62.01 -50.92 78.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 114.972 -1.013 . . . . 0.0 111.753 179.776 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . 0.615 ' HG3' ' O ' ' B' ' 13' ' ' HIS . 4.4 ppt_? -61.88 -42.83 99.53 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 112.258 0.466 . . . . 0.0 112.258 -178.414 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -70.33 -45.85 65.35 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 121.01 -0.276 . . . . 0.0 111.406 -179.446 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 18' ' ' LEU . . . . . 1.005 HD22 ' HB2' ' B' ' 27' ' ' TRP . 0.4 OUTLIER -56.63 -54.41 46.41 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.647 -179.869 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 19' ' ' VAL . . . . . 0.521 ' HA ' ' HB3' ' B' ' 27' ' ' TRP . 90.8 t -62.26 -48.25 89.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -178.819 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 24.6 mmm-85 -67.63 -45.06 76.47 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 114.245 1.202 . . . . 0.0 114.245 -178.23 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 99.4 t -76.2 -42.95 37.68 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 N-CA-C 113.01 0.745 . . . . 0.0 113.01 -177.671 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 22' ' ' CYS . . . . . 0.453 ' HB2' ' HA ' ' B' ' 27' ' ' TRP . 99.0 m -81.53 36.94 0.44 Allowed 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 113.347 0.869 . . . . 0.0 113.347 -177.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 139.59 -48.0 0.87 Allowed Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.304 -0.95 . . . . 0.0 113.293 178.257 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . 0.421 ' O ' HG12 ' B' ' 19' ' ' VAL . . . 125.39 -72.99 0.43 Allowed Glycine 0 N--CA 1.448 -0.516 0 N-CA-C 110.703 -0.959 . . . . 0.0 110.703 -178.763 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -97.41 17.54 0.57 Allowed 'Trans proline' 0 N--CA 1.453 -0.905 0 C-N-CA 123.268 2.645 . . . . 0.0 111.333 178.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 17.9 mtp85 -169.27 148.07 3.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.3 -179.284 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 27' ' ' TRP . . . . . 1.005 ' HB2' HD22 ' B' ' 18' ' ' LEU . 0.0 OUTLIER -109.13 59.29 0.6 Allowed 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.533 178.553 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 16.5 m -46.3 91.77 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -178.066 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 7.2 t 178.37 -43.06 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.339 -0.846 . . . . 0.0 108.798 178.842 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -83.78 -38.02 21.84 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.057 179.137 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 31' ' ' ALA . . . . . 0.577 ' HB3' ' CH2' ' B' ' 27' ' ' TRP . . . . . . . . 0 C--O 1.253 1.238 0 CA-C-N 114.614 -1.175 . . . . 0.0 108.906 179.553 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.072 0 N-CA-C 110.104 -0.332 . . . . 0.0 110.104 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -168.16 -151.46 0.11 Allowed 'General case' 0 C--N 1.328 -0.355 0 O-C-N 123.361 0.413 . . . . 0.0 110.156 -179.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -148.71 -157.08 0.78 Allowed 'General case' 0 N--CA 1.439 -1.003 0 CA-C-O 121.552 0.691 . . . . 0.0 109.681 179.642 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 5.9 p -74.82 62.36 1.08 Allowed 'General case' 0 C--N 1.3 -1.579 0 CA-C-N 114.258 -1.337 . . . . 0.0 112.134 -179.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -165.71 111.83 0.77 Allowed Pre-proline 0 C--N 1.327 -0.397 0 CA-C-O 121.139 0.495 . . . . 0.0 109.883 179.646 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_exo -58.42 -46.57 23.72 Favored 'Trans proline' 0 N--CA 1.469 0.061 0 C-N-CA 123.549 2.833 . . . . 0.0 113.351 -178.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -58.8 -42.56 89.4 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.303 0.573 . . . . 0.0 110.296 179.822 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.433 ' HD3' ' HA ' ' A' ' 8' ' ' ARG . 14.4 tpp180 -64.96 -50.06 67.87 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.36 -0.836 . . . . 0.0 109.742 179.026 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 31.8 t80 -55.86 -49.58 72.96 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.573 -1.194 . . . . 0.0 111.214 179.806 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.869 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 56.5 m -68.11 -29.14 68.0 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.0 -0.545 . . . . 0.0 112.398 -179.323 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 44.7 t -79.16 -55.05 5.39 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.369 0.604 . . . . 0.0 110.902 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 11.2 mp -67.14 -47.34 71.36 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.266 -0.879 . . . . 0.0 112.562 -179.024 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.557 ' O ' ' HA ' ' B' ' 3' ' ' PRO . 16.5 m -100.98 -52.67 3.23 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.931 0.396 . . . . 0.0 111.323 -179.223 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.626 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 115.29 161.67 13.23 Favored Glycine 0 N--CA 1.445 -0.754 0 C-N-CA 120.36 -0.924 . . . . 0.0 112.295 -179.898 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.486 ' N ' ' HB3' ' B' ' 6' ' ' ARG . 21.4 p -155.1 153.58 31.07 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.899 0.38 . . . . 0.0 110.206 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.721 HG23 ' HG2' ' B' ' 6' ' ' ARG . 72.0 p -103.08 179.9 4.14 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.319 -179.373 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 5.9 mp0 -58.04 -39.76 79.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.245 179.295 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 10.8 mm100 -63.5 -40.88 98.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.3 179.215 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.439 ' HB2' ' HB2' ' A' ' 15' ' ' CYS . 51.4 m-20 -61.23 -42.79 99.23 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.457 178.934 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.734 HD21 HD11 ' B' ' 9' ' ' LEU . 3.6 mm? -66.11 -45.6 80.56 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.365 178.541 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 25.7 tp -56.84 -42.38 79.54 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.848 -179.619 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 19.7 m -65.65 -21.07 66.53 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.345 0.593 . . . . 0.0 111.327 179.676 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 33.8 tp -86.33 -1.28 57.38 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.946 179.852 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.404 ' HA ' ' HD3' ' A' ' 25' ' ' PRO . 74.3 m -128.95 139.4 35.57 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-O 120.947 0.403 . . . . 0.0 111.451 -179.582 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 24' ' ' CYS . 15.0 Cg_exo -67.88 127.06 15.5 Favored 'Trans proline' 0 N--CA 1.459 -0.513 0 C-N-CA 122.857 2.372 . . . . 0.0 111.78 179.873 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 22.4 t80 . . . . . 0 C--O 1.248 1.018 0 CA-C-N 115.433 -0.803 . . . . 0.0 108.92 -179.968 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 1' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo . . . . . 0 N--CA 1.484 0.953 0 N-CA-C 110.709 -0.535 . . . . 0.0 110.709 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 2' ' ' THR . . . . . 0.556 ' HB ' ' HD2' ' B' ' 3' ' ' PRO . 0.4 OUTLIER -161.07 173.75 4.47 Favored Pre-proline 0 C--N 1.317 -0.841 0 CA-C-N 114.828 -1.078 . . . . 0.0 108.521 -178.799 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . 0.556 ' HD2' ' HB ' ' B' ' 2' ' ' THR . 61.5 Cg_endo -71.84 50.43 1.41 Allowed 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 122.546 2.164 . . . . 0.0 111.263 178.808 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . 0.666 ' HG3' HG21 ' A' ' 16' ' ' THR . 3.1 pt-20 -71.87 135.88 46.74 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 114.208 -1.36 . . . . 0.0 111.448 -178.87 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 5' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.1 130.7 42.18 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.853 -179.569 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 6' ' ' ARG . . . . . 0.437 ' HA ' HG22 ' A' ' 16' ' ' THR . 44.8 mtp85 -73.49 129.92 39.01 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.439 -179.823 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . 0.555 ' HG3' HD23 ' B' ' 9' ' ' LEU . 11.8 tp10 -93.54 135.17 35.07 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-O 121.46 0.648 . . . . 0.0 110.309 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . 0.439 ' HD3' ' N ' ' B' ' 8' ' ' LYS . 0.7 OUTLIER -82.87 95.33 7.91 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 179.876 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . 0.787 HD13 ' HA ' ' B' ' 14' ' ' PHE . 18.8 mt -77.45 54.47 1.16 Allowed 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 -177.561 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 10' ' ' CYS . . . . . 0.413 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 74.4 m -72.51 121.06 19.02 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.039 178.307 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 57.97 -120.21 20.57 Favored Glycine 0 CA--C 1.52 0.392 0 C-N-CA 121.34 -0.457 . . . . 0.0 113.892 179.323 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 23.6 t-160 -52.77 -30.71 34.42 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -178.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 13' ' ' HIS . . . . . 0.628 ' HA ' ' HG2' ' B' ' 16' ' ' ARG . 46.9 m170 -58.46 -41.84 86.08 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 120.438 -0.505 . . . . 0.0 110.682 -179.456 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 14' ' ' PHE . . . . . 0.787 ' HA ' HD13 ' B' ' 9' ' ' LEU . 34.3 t80 -60.88 -44.39 97.14 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.217 0.532 . . . . 0.0 109.753 178.766 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 46.9 t -61.15 -50.59 79.87 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.254 -0.885 . . . . 0.0 111.751 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . 0.628 ' HG2' ' HA ' ' B' ' 13' ' ' HIS . 18.5 ptt180 -62.05 -45.31 94.1 Favored 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -178.723 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . 0.537 ' N ' ' HG3' ' B' ' 16' ' ' ARG . . . -67.53 -43.43 80.8 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 111.76 0.281 . . . . 0.0 111.76 -179.216 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 18' ' ' LEU . . . . . 0.571 ' O ' ' HB2' ' B' ' 22' ' ' CYS . 3.7 tt -60.61 -55.38 34.04 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 110.118 -0.327 . . . . 0.0 110.118 -179.799 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 19' ' ' VAL . . . . . 0.469 ' HA ' ' NE1' ' B' ' 27' ' ' TRP . 83.5 t -57.28 -41.43 78.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.166 -0.47 . . . . 0.0 112.217 -179.605 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . 0.593 ' NE ' ' HA ' ' B' ' 20' ' ' ARG . 4.0 tpm_? -78.95 -60.87 2.21 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 113.32 0.859 . . . . 0.0 113.32 -178.517 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 63.0 t -65.44 -45.68 92.22 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.85 0 N-CA-C 114.004 1.113 . . . . 0.0 114.004 -176.489 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 22' ' ' CYS . . . . . 0.624 ' HB3' ' HB3' ' B' ' 27' ' ' TRP . 73.0 m -67.9 -25.63 65.59 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -178.271 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . 0.431 ' N ' ' HD1' ' B' ' 27' ' ' TRP . . . 165.46 -109.72 0.37 Allowed Glycine 0 N--CA 1.445 -0.751 0 C-N-CA 119.66 -1.257 . . . . 0.0 113.015 -179.673 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 174.47 -66.6 0.1 Allowed Glycine 0 N--CA 1.446 -0.655 0 N-CA-C 111.472 -0.651 . . . . 0.0 111.472 -179.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -72.68 -27.51 15.05 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.478 2.119 . . . . 0.0 112.36 179.626 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . 0.705 ' HB2' ' NH1' ' B' ' 26' ' ' ARG . 0.1 OUTLIER -167.49 151.48 6.54 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 116.123 -0.49 . . . . 0.0 109.935 -179.59 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 27' ' ' TRP . . . . . 0.657 ' CZ3' ' HB2' ' B' ' 30' ' ' GLU . 0.0 OUTLIER -156.91 -88.43 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.742 179.727 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 21.1 m -166.07 62.2 0.1 Allowed 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 112.978 0.733 . . . . 0.0 112.978 -179.824 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . 0.678 HG23 ' H ' ' B' ' 30' ' ' GLU . 7.5 t -173.09 -68.06 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.332 0 O-C-N 122.348 -0.22 . . . . 0.0 110.658 177.771 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 30' ' ' GLU . . . . . 0.678 ' H ' HG23 ' B' ' 29' ' ' THR . 20.2 mm-40 -84.72 -26.75 27.46 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.555 -0.906 . . . . 0.0 108.555 178.492 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.23 0 CA-C-N 114.124 -1.398 . . . . 0.0 108.459 179.835 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.15 0 N-CA-C 110.217 -0.29 . . . . 0.0 110.217 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -69.51 142.29 53.73 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.716 -0.22 . . . . 0.0 110.586 179.544 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.409 ' HB1' ' HD2' ' A' ' 8' ' ' ARG . . . -168.8 119.14 0.73 Allowed 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.402 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.6 m -75.46 59.53 1.1 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.596 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 15.3 t-20 -175.5 119.42 0.32 Allowed Pre-proline 0 C--N 1.326 -0.439 0 N-CA-C 108.531 -0.915 . . . . 0.0 108.531 -179.108 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -54.47 -47.86 24.55 Favored 'Trans proline' 0 N--CA 1.472 0.216 0 C-N-CA 123.365 2.71 . . . . 0.0 114.091 -178.146 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.86 -43.25 98.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.4 0.619 . . . . 0.0 110.169 179.79 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.409 ' HD2' ' HB1' ' A' ' 3' ' ' ALA . 26.1 ttm180 -66.28 -49.07 68.34 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.258 -0.883 . . . . 0.0 109.885 179.212 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 16.2 t80 -54.93 -50.76 68.05 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 114.452 -1.249 . . . . 0.0 111.33 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.656 ' SG ' ' HG ' ' B' ' 9' ' ' LEU . 35.5 t -73.01 -12.67 61.01 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.798 0.332 . . . . 0.0 111.713 -179.15 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.413 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 16.0 t -83.99 -53.55 5.48 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 121.723 0.773 . . . . 0.0 109.075 178.36 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.9 mp -69.81 -45.21 68.41 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.376 -1.283 . . . . 0.0 112.67 -179.73 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 8.3 m -98.36 -34.78 10.54 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 112.174 0.435 . . . . 0.0 112.174 -178.218 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.604 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 87.76 150.52 19.73 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.642 -0.79 . . . . 0.0 112.105 -179.026 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.62 ' HB2' ' CB ' ' A' ' 19' ' ' ASP . 32.1 p -148.28 148.73 30.77 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.845 0.355 . . . . 0.0 110.152 -179.216 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.666 HG21 ' HG3' ' B' ' 4' ' ' GLU . 65.1 p -94.13 -176.63 4.05 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.95 0.405 . . . . 0.0 111.448 -178.545 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.453 ' H ' ' CD ' ' A' ' 17' ' ' GLN . 2.0 pm0 -60.78 -40.2 91.71 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 115.956 -0.566 . . . . 0.0 109.785 178.321 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 37.2 tt0 -60.29 -45.04 94.72 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.25 -0.886 . . . . 0.0 109.531 178.498 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.62 ' CB ' ' HB2' ' A' ' 15' ' ' CYS . 12.3 m-20 -56.26 -45.84 79.9 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 114.997 -1.001 . . . . 0.0 109.762 178.897 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.638 HD21 HD11 ' B' ' 9' ' ' LEU . 3.2 mm? -63.96 -44.7 91.99 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.543 178.491 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 32.0 tp -56.7 -45.85 81.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.413 -179.284 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.0 p -66.19 -10.75 44.47 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -179.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.411 HD13 ' HA ' ' A' ' 23' ' ' LEU . 4.0 mm? -109.39 12.42 24.66 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.601 -0.272 . . . . 0.0 111.26 179.57 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.409 ' HA ' ' HD3' ' A' ' 25' ' ' PRO . 96.1 m -141.39 133.65 13.93 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.192 0.52 . . . . 0.0 111.491 179.709 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 24' ' ' CYS . 96.3 Cg_endo -97.63 -158.84 0.04 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.987 0 C-N-CA 123.887 3.058 . . . . 0.0 112.277 179.843 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 23.4 t80 . . . . . 0 C--O 1.249 1.039 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.207 178.623 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 1' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_exo . . . . . 0 N--CA 1.478 0.566 0 N-CA-C 111.221 -0.338 . . . . 0.0 111.221 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 32.4 p -130.15 137.16 30.26 Favored Pre-proline 0 C--N 1.327 -0.394 0 CA-C-O 120.914 0.388 . . . . 0.0 111.621 -179.862 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -80.33 107.21 1.99 Allowed 'Trans proline' 0 N--CA 1.458 -0.61 0 C-N-CA 122.643 2.229 . . . . 0.0 111.515 179.451 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . 0.602 ' CG ' HG21 ' A' ' 16' ' ' THR . 11.4 pt-20 -167.62 -157.27 0.22 Allowed 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 -179.079 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 5' ' ' MET . . . . . 0.468 ' O ' ' HB ' ' A' ' 16' ' ' THR . 26.3 ptt? -71.4 129.8 39.71 Favored 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 177.922 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 58.7 mtp85 -131.95 141.89 49.46 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.712 -178.329 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -131.29 148.91 52.73 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.533 -0.544 . . . . 0.0 109.533 179.208 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . 0.476 ' NZ ' ' HB2' ' B' ' 8' ' ' LYS . 4.8 mtmp? -73.17 96.29 2.21 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.293 179.943 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . 0.684 ' HB2' ' SG ' ' A' ' 10' ' ' CYS . 96.6 mt -88.01 58.9 5.05 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.4 0.619 . . . . 0.0 111.307 -179.723 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 10' ' ' CYS . . . . . 0.453 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 99.5 m -64.45 136.86 57.5 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.611 -0.722 . . . . 0.0 112.001 179.827 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 57.42 -125.05 37.96 Favored Glycine 0 CA--C 1.518 0.266 0 CA-C-N 115.644 -0.707 . . . . 0.0 114.809 177.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 15.4 t-160 -50.69 -31.45 16.46 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 123.325 0.65 . . . . 0.0 112.736 -178.228 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 13' ' ' HIS . . . . . 0.419 ' HB3' ' CD2' ' B' ' 9' ' ' LEU . 22.6 m170 -59.51 -43.68 93.31 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 121.216 -0.194 . . . . 0.0 111.134 -179.42 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 14' ' ' PHE . . . . . . . . . . . . . 34.6 t80 -64.05 -42.3 97.09 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.168 0.509 . . . . 0.0 109.86 178.927 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . 0.651 ' O ' HG23 ' B' ' 19' ' ' VAL . 39.3 t -58.84 -56.67 15.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.379 -179.935 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . 0.533 ' HD3' ' N ' ' B' ' 17' ' ' ALA . 0.0 OUTLIER -61.07 -35.06 75.95 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-O 120.754 0.311 . . . . 0.0 110.971 -179.676 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . 0.533 ' N ' ' HD3' ' B' ' 16' ' ' ARG . . . -64.15 -46.76 82.61 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.48 179.109 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 21.2 mt -60.51 -45.92 92.03 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.433 179.452 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 19' ' ' VAL . . . . . 0.884 HG22 ' HE1' ' B' ' 27' ' ' TRP . 14.7 t -60.62 -39.55 81.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-O 120.939 0.4 . . . . 0.0 110.8 -179.737 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 31.4 tpt85 -74.27 -57.67 3.8 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.286 0.565 . . . . 0.0 112.081 -179.657 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 21' ' ' VAL . . . . . 0.672 HG22 ' HG3' ' A' ' 17' ' ' GLN . 65.2 t -65.9 -57.36 10.95 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.892 0 CA-C-N 114.706 -1.134 . . . . 0.0 113.502 -177.019 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 56.8 m -101.52 37.95 1.7 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.883 0.373 . . . . 0.0 111.527 -178.219 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -78.46 124.18 6.57 Favored Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.315 179.522 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 154.21 -150.16 21.71 Favored Glycine 0 N--CA 1.445 -0.726 0 C-N-CA 120.827 -0.701 . . . . 0.0 111.971 179.836 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_exo -64.15 -27.92 64.96 Favored 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 123.022 2.481 . . . . 0.0 112.377 179.793 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . 0.417 ' O ' HG22 ' B' ' 29' ' ' THR . 32.1 mmt180 -80.23 -11.87 59.69 Favored 'General case' 0 CA--C 1.51 -0.572 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.667 -179.632 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 27' ' ' TRP . . . . . 0.884 ' HE1' HG22 ' B' ' 19' ' ' VAL . 0.0 OUTLIER -81.05 58.52 3.49 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 122.424 1.106 . . . . 0.0 110.89 -179.407 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 22.5 m -157.19 53.81 0.5 Allowed 'General case' 0 C--N 1.306 -1.288 0 CA-C-N 113.298 -1.774 . . . . 0.0 107.533 178.777 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . 0.534 HG23 ' H ' ' B' ' 30' ' ' GLU . 1.7 t -139.43 -55.48 0.58 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.602 -1.181 . . . . 0.0 110.717 -177.945 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 30' ' ' GLU . . . . . 0.651 ' HB2' ' CZ3' ' B' ' 27' ' ' TRP . 22.2 mm-40 -77.11 -28.33 54.35 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.664 179.699 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.876 0 CA-C-N 114.651 -1.159 . . . . 0.0 108.029 179.665 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.051 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -71.96 137.83 47.61 Favored 'General case' 0 C--N 1.327 -0.4 0 O-C-N 123.338 0.399 . . . . 0.0 110.558 179.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -81.1 56.35 2.79 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.131 0.491 . . . . 0.0 111.138 -179.797 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 2.1 m -78.01 54.65 1.34 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.7 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -169.42 112.3 0.5 Allowed Pre-proline 0 C--N 1.324 -0.528 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 -179.539 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -57.66 -47.02 23.17 Favored 'Trans proline' 0 C--O 1.235 0.338 0 C-N-CA 123.291 2.661 . . . . 0.0 113.446 -178.708 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.31 -46.35 90.19 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.202 0.525 . . . . 0.0 110.64 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.442 ' HD3' ' HA ' ' A' ' 8' ' ' ARG . 3.6 mmt180 -68.8 -39.35 80.16 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.121 179.484 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 31.3 t80 -57.93 -53.43 58.34 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.081 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.684 ' SG ' ' HB2' ' B' ' 9' ' ' LEU . 49.0 t -69.46 -18.35 63.71 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.018 0.437 . . . . 0.0 111.487 -179.64 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.453 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 16.2 t -81.09 -53.02 6.76 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.474 0.654 . . . . 0.0 110.47 179.401 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 94.2 mt -75.37 -57.88 3.62 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.044 -0.98 . . . . 0.0 112.51 -179.131 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 14.2 m -81.98 -29.4 32.15 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.823 0.344 . . . . 0.0 111.72 -178.783 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.58 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 86.13 147.66 10.71 Favored Glycine 0 N--CA 1.447 -0.59 0 C-N-CA 120.533 -0.841 . . . . 0.0 111.648 -178.914 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 18.1 p -139.84 -160.03 1.02 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.885 0.342 . . . . 0.0 110.529 -179.885 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.615 ' CG2' ' HB2' ' A' ' 19' ' ' ASP . 2.8 t -160.19 -178.65 7.12 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 -179.086 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.672 ' HG3' HG22 ' B' ' 21' ' ' VAL . 38.1 tt0 -62.7 -54.5 38.33 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -179.341 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -63.11 -34.17 77.02 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 179.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.615 ' HB2' ' CG2' ' A' ' 16' ' ' THR . 13.7 t70 -61.95 -45.77 92.2 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.949 179.076 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 53.2 mt -69.15 -42.72 75.57 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.523 179.498 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 32.4 tp -55.84 -52.48 63.88 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.349 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 16.1 p -65.37 -11.5 42.86 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.971 179.364 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 48.8 tp -93.6 -26.8 16.94 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.188 -0.46 . . . . 0.0 109.965 179.108 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.439 ' HA ' ' HD3' ' A' ' 25' ' ' PRO . 80.5 m -85.15 136.79 37.75 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.874 -179.868 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 24' ' ' CYS . 16.5 Cg_exo -67.08 119.87 6.92 Favored 'Trans proline' 0 N--CA 1.457 -0.632 0 C-N-CA 122.592 2.195 . . . . 0.0 110.62 179.21 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 25.4 m-85 . . . . . 0 C--O 1.248 0.985 0 CA-C-O 118.654 -0.689 . . . . 0.0 110.53 -179.135 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 1' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo . . . . . 0 N--CA 1.478 0.568 0 N-CA-C 110.722 -0.53 . . . . 0.0 110.722 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 2' ' ' THR . . . . . 0.605 HG23 ' HD2' ' B' ' 3' ' ' PRO . 22.4 m -163.51 144.15 7.04 Favored Pre-proline 0 C--N 1.326 -0.426 0 N-CA-C 109.457 -0.572 . . . . 0.0 109.457 -178.904 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . 0.605 ' HD2' HG23 ' B' ' 2' ' ' THR . 80.1 Cg_exo -45.8 145.1 4.98 Favored 'Trans proline' 0 C--N 1.359 1.091 0 C-N-CA 122.809 2.34 . . . . 0.0 111.411 179.528 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -47.31 115.2 1.04 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 122.323 1.059 . . . . 0.0 113.151 -177.129 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 5' ' ' MET . . . . . . . . . . . . . 39.3 ttp 177.25 47.48 0.0 OUTLIER 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 112.658 -2.064 . . . . 0.0 107.149 179.264 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.48 155.71 19.76 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 114.853 -1.067 . . . . 0.0 112.276 -177.372 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -147.89 151.86 36.6 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.308 -0.86 . . . . 0.0 109.152 178.226 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . 0.43 ' HE2' ' HB2' ' B' ' 8' ' ' LYS . 25.3 mtmm -67.91 97.44 0.66 Allowed 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.957 -178.981 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . 0.639 ' HB2' ' SG ' ' A' ' 10' ' ' CYS . 84.1 mt -88.9 53.24 2.63 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.275 0.559 . . . . 0.0 110.752 179.581 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 10' ' ' CYS . . . . . 0.405 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 96.6 m -60.18 138.72 57.86 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.788 -179.931 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 66.95 -133.88 31.73 Favored Glycine 0 N--CA 1.451 -0.327 0 CA-C-N 115.668 -0.696 . . . . 0.0 114.824 178.334 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 12' ' ' HIS . . . . . . . . . . . . . 17.5 t-160 -52.47 -29.25 23.85 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 -178.077 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 13' ' ' HIS . . . . . 0.591 ' HB3' HD22 ' B' ' 9' ' ' LEU . 22.7 m170 -58.6 -46.11 87.71 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.471 0.177 . . . . 0.0 111.286 -179.147 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 14' ' ' PHE . . . . . 0.581 ' CZ ' ' HB2' ' A' ' 6' ' ' PRO . 54.0 t80 -63.22 -45.19 92.82 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 178.509 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 40.6 t -54.2 -54.56 20.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.473 -179.608 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . 0.58 ' HG3' ' O ' ' B' ' 13' ' ' HIS . 0.0 OUTLIER -61.75 -42.74 99.36 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.852 -0.339 . . . . 0.0 111.598 -179.481 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . 0.509 ' N ' ' HE ' ' B' ' 16' ' ' ARG . . . -63.68 -52.39 60.88 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 -179.953 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 18' ' ' LEU . . . . . 0.503 HD22 ' CZ ' ' B' ' 14' ' ' PHE . 16.2 tp -64.57 -53.84 41.59 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.264 -179.044 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 19' ' ' VAL . . . . . 0.634 ' HA ' ' NE1' ' B' ' 27' ' ' TRP . 83.1 t -58.31 -40.31 77.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -178.295 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . 0.999 ' HE ' ' HA ' ' B' ' 20' ' ' ARG . 1.0 OUTLIER -82.29 -46.53 13.53 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 114.183 1.179 . . . . 0.0 114.183 -178.658 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 21' ' ' VAL . . . . . 0.489 HG21 ' HB3' ' A' ' 17' ' ' GLN . 72.8 t -73.83 -45.49 49.53 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 N-CA-C 113.447 0.906 . . . . 0.0 113.447 -177.778 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 22' ' ' CYS . . . . . 0.807 ' HB3' ' HB3' ' B' ' 27' ' ' TRP . 63.6 m -73.22 -33.23 65.23 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 -178.4 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 170.34 -101.95 0.17 Allowed Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 119.365 -1.398 . . . . 0.0 113.432 -179.202 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 170.68 -71.55 0.12 Allowed Glycine 0 N--CA 1.449 -0.471 0 N-CA-C 111.802 -0.519 . . . . 0.0 111.802 -179.743 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -69.41 -31.09 22.8 Favored 'Trans proline' 0 C--N 1.348 0.527 0 C-N-CA 122.531 2.154 . . . . 0.0 112.288 179.627 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . 0.583 ' HB2' ' OXT' ' B' ' 31' ' ' ALA . 0.0 OUTLIER -166.01 154.01 10.64 Favored 'General case' 0 CA--C 1.512 -0.496 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 179.559 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 27' ' ' TRP . . . . . 0.807 ' HB3' ' HB3' ' B' ' 22' ' ' CYS . 0.0 OUTLIER -140.26 -78.38 0.3 Allowed 'General case' 0 C--N 1.314 -0.976 0 O-C-N 123.357 0.411 . . . . 0.0 110.332 -179.215 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . 0.492 ' HB2' ' HD3' ' A' ' 25' ' ' PRO . 5.6 t -178.68 49.03 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -179.805 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . 0.803 HG23 ' H ' ' B' ' 30' ' ' GLU . 2.9 t -172.92 -79.18 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 121.184 -0.206 . . . . 0.0 110.761 178.949 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 30' ' ' GLU . . . . . 0.803 ' H ' HG23 ' B' ' 29' ' ' THR . 0.6 OUTLIER -67.29 -26.9 66.77 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 178.045 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 31' ' ' ALA . . . . . 0.583 ' OXT' ' HB2' ' B' ' 26' ' ' ARG . . . . . . . . 0 C--O 1.258 1.512 0 CA-C-N 114.099 -1.409 . . . . 0.0 107.747 179.069 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.016 0 N-CA-C 110.084 -0.339 . . . . 0.0 110.084 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.533 ' H ' HD22 ' A' ' 23' ' ' LEU . . . -81.19 66.3 6.67 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.826 0.346 . . . . 0.0 110.569 179.815 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -168.74 134.6 1.74 Allowed 'General case' 0 N--CA 1.442 -0.83 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 -179.602 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 4.8 p -54.2 -35.37 62.3 Favored 'General case' 0 C--N 1.318 -0.773 0 O-C-N 123.836 0.71 . . . . 0.0 111.495 -179.715 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -156.38 99.25 2.11 Favored Pre-proline 0 C--N 1.318 -0.786 0 CA-C-N 115.393 -0.821 . . . . 0.0 109.365 178.554 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.581 ' HB2' ' CZ ' ' B' ' 14' ' ' PHE . 24.0 Cg_exo -60.35 -39.45 66.93 Favored 'Trans proline' 0 C--N 1.331 -0.388 0 C-N-CA 123.826 3.017 . . . . 0.0 112.853 -178.708 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.94 -47.12 83.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.212 0.529 . . . . 0.0 110.527 179.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.409 ' HA ' ' HD2' ' A' ' 8' ' ' ARG . 14.0 tpt85 -66.73 -48.07 70.33 Favored 'General case' 0 CA--C 1.511 -0.532 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.698 179.222 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 10.5 t80 -52.23 -57.07 10.8 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 114.33 -1.305 . . . . 0.0 112.0 -179.518 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.65 ' O ' ' HA2' ' A' ' 14' ' ' GLY . 18.1 t -66.25 -19.83 65.94 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -178.535 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.405 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 14.4 t -84.89 -53.08 5.55 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.641 0.734 . . . . 0.0 110.427 179.453 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 15.0 tp -72.28 -62.52 1.41 Allowed 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 114.89 -1.05 . . . . 0.0 111.923 -179.138 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 14.7 m -79.86 -28.25 40.02 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.339 -178.829 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.65 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 85.7 152.52 19.28 Favored Glycine 0 N--CA 1.445 -0.714 0 C-N-CA 120.669 -0.777 . . . . 0.0 111.84 -179.267 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 9.1 p -151.57 -163.05 1.66 Allowed 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 179.451 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.612 HG22 ' HB2' ' A' ' 19' ' ' ASP . 13.4 t -153.33 168.52 25.78 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 108.37 -0.974 . . . . 0.0 108.37 179.493 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.49 ' NE2' ' H ' ' A' ' 17' ' ' GLN . 0.0 OUTLIER -55.25 -48.27 74.21 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.616 0.246 . . . . 0.0 111.39 -178.858 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.58 ' HB2' HG21 ' B' ' 2' ' ' THR . 8.7 mp0 -62.78 -38.07 89.15 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.475 179.712 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.612 ' HB2' HG22 ' A' ' 16' ' ' THR . 30.3 t70 -61.5 -44.03 97.8 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.782 179.371 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 67.9 mt -68.1 -39.91 82.72 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.258 178.687 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 49.9 tp -57.93 -43.55 86.35 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.704 179.469 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 36.3 p -69.61 0.77 4.9 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 120.964 0.411 . . . . 0.0 111.865 179.762 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.533 HD22 ' H ' ' A' ' 2' ' ' ALA . 89.1 mt -117.01 9.92 13.82 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.007 179.241 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 75.4 m -134.18 143.19 46.06 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.331 -179.221 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.492 ' HD3' ' HB2' ' B' ' 28' ' ' SER . 66.4 Cg_endo -90.35 -157.95 0.07 OUTLIER 'Trans proline' 0 N--CA 1.45 -1.075 0 C-N-CA 123.293 2.662 . . . . 0.0 111.312 178.724 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 12.6 t80 . . . . . 0 C--O 1.251 1.138 0 CA-C-O 118.851 -0.595 . . . . 0.0 109.999 179.277 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 1' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo . . . . . 0 CA--C 1.512 -0.588 0 N-CA-C 110.159 -0.747 . . . . 0.0 110.159 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 6.0 m -62.5 123.64 79.7 Favored Pre-proline 0 C--N 1.318 -0.769 0 O-C-N 123.719 0.637 . . . . 0.0 109.944 179.529 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -68.77 144.94 61.27 Favored 'Trans proline' 0 C--O 1.234 0.322 0 C-N-CA 122.71 2.273 . . . . 0.0 112.666 -179.155 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . 0.56 ' OE1' ' HB ' ' A' ' 16' ' ' THR . 1.6 mp0 -76.26 -149.03 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.502 0.668 . . . . 0.0 109.995 179.673 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 5' ' ' MET . . . . . . . . . . . . . 24.9 ptt? -82.62 121.36 26.73 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 178.186 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 6' ' ' ARG . . . . . 0.633 ' HG2' HG23 ' A' ' 16' ' ' THR . 49.6 mtt180 -72.61 123.96 24.29 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.762 0.315 . . . . 0.0 111.172 -179.158 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . 0.4 ' HG2' ' N ' ' B' ' 8' ' ' LYS . 22.3 tt0 -100.05 151.28 21.55 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 179.124 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . 0.444 ' HA ' ' O ' ' A' ' 10' ' ' CYS . 55.2 mttm -86.8 95.52 9.87 Favored 'General case' 0 C--N 1.312 -1.065 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 178.447 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . 0.739 ' HB2' ' HB3' ' A' ' 10' ' ' CYS . 2.8 mm? -76.65 57.08 1.21 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.81 -0.632 . . . . 0.0 112.249 -178.472 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 10' ' ' CYS . . . . . 0.442 ' HA ' ' HB2' ' A' ' 11' ' ' CYS . 93.7 m -74.26 124.91 27.3 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.158 179.313 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . 52.25 -115.04 3.77 Favored Glycine 0 CA--C 1.519 0.304 0 CA-C-N 115.897 -0.592 . . . . 0.0 114.326 178.617 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 12' ' ' HIS . . . . . 0.424 ' O ' ' HG3' ' B' ' 16' ' ' ARG . 15.6 t-160 -51.29 -31.69 22.27 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 123.131 0.573 . . . . 0.0 112.396 -178.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 13' ' ' HIS . . . . . 0.672 ' HB3' ' HA ' ' B' ' 9' ' ' LEU . 27.0 m170 -62.39 -42.82 99.72 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 120.695 -0.402 . . . . 0.0 110.589 -179.67 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 14' ' ' PHE . . . . . . . . . . . . . 19.3 t80 -60.49 -38.85 85.61 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 178.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . 0.417 ' O ' HG23 ' B' ' 19' ' ' VAL . 65.1 t -60.97 -57.5 11.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.386 -0.825 . . . . 0.0 111.4 179.497 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . 0.492 ' HD3' ' N ' ' B' ' 17' ' ' ALA . 0.0 OUTLIER -63.85 -28.54 69.92 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 120.964 -0.295 . . . . 0.0 111.322 179.93 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . 0.698 ' HB1' HD13 ' A' ' 20' ' ' LEU . . . -63.75 -53.08 56.65 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.29 179.188 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 18' ' ' LEU . . . . . . . . . . . . . 100.0 mt -60.77 -46.79 89.09 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.732 179.285 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 19' ' ' VAL . . . . . 0.645 HG12 ' HE ' ' B' ' 20' ' ' ARG . 71.8 t -58.43 -38.51 70.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.621 -0.718 . . . . 0.0 112.825 -179.35 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . 0.645 ' HE ' HG12 ' B' ' 19' ' ' VAL . 0.0 OUTLIER -93.27 -43.75 8.65 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 -178.171 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 94.7 t -70.7 -40.82 77.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -178.75 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 22' ' ' CYS . . . . . . . . . . . . . 52.5 m -116.6 47.26 1.47 Allowed 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 120.907 -0.317 . . . . 0.0 111.538 -179.126 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . 0.87 ' HA2' ' HB2' ' B' ' 28' ' ' SER . . . -168.38 139.47 5.68 Favored Glycine 0 N--CA 1.443 -0.875 0 C-N-CA 119.268 -1.444 . . . . 0.0 114.006 -179.9 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -84.14 -77.62 1.14 Allowed Glycine 0 N--CA 1.447 -0.57 0 N-CA-C 110.713 -0.955 . . . . 0.0 110.713 178.454 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 25' ' ' PRO . . . . . 0.481 ' HD2' ' OG ' ' B' ' 28' ' ' SER . 39.2 Cg_endo -68.6 -45.74 2.24 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.35 2.033 . . . . 0.0 110.928 178.57 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . 0.515 ' NH2' ' HB2' ' B' ' 31' ' ' ALA . 25.1 mtm105 -150.58 -128.55 0.04 OUTLIER 'General case' 0 CA--C 1.506 -0.719 0 CA-C-O 121.57 0.7 . . . . 0.0 110.364 178.582 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 27' ' ' TRP . . . . . 0.658 ' HA ' ' HE3' ' B' ' 27' ' ' TRP . 0.0 OUTLIER -82.83 62.07 6.22 Favored 'General case' 0 N--CA 1.422 -1.872 0 CA-C-N 114.254 -1.339 . . . . 0.0 109.645 -179.758 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . 0.87 ' HB2' ' HA2' ' B' ' 23' ' ' GLY . 69.4 m -53.37 81.57 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.014 0 CA-C-O 122.244 1.021 . . . . 0.0 113.282 -179.712 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 28.3 m 177.31 -42.28 0.01 OUTLIER 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 102.97 -2.974 . . . . 0.0 102.97 179.806 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 30' ' ' GLU . . . . . 0.491 ' OE1' ' HB3' ' B' ' 27' ' ' TRP . 3.6 tm-20 -98.71 -31.61 11.82 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 111.009 -2.814 . . . . 0.0 106.329 176.154 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 31' ' ' ALA . . . . . 0.579 ' O ' ' HA ' ' B' ' 28' ' ' SER . . . . . . . . 0 C--O 1.245 0.837 0 CA-C-N 113.142 -1.845 . . . . 0.0 109.459 179.551 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.147 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -69.22 144.24 53.76 Favored 'General case' 0 C--N 1.329 -0.291 0 O-C-N 123.085 0.24 . . . . 0.0 110.527 179.35 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -165.15 119.56 1.28 Allowed 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 116.312 -0.404 . . . . 0.0 109.999 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 3.9 p -77.73 52.86 1.05 Allowed 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.445 -179.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.463 ' HB3' ' HB2' ' A' ' 8' ' ' ARG . 29.6 t-20 -171.49 113.2 0.41 Allowed Pre-proline 0 C--N 1.327 -0.411 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 -179.716 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.565 ' HB3' HD13 ' A' ' 23' ' ' LEU . 27.8 Cg_exo -59.36 -48.06 14.85 Favored 'Trans proline' 0 C--N 1.335 -0.146 0 C-N-CA 123.209 2.606 . . . . 0.0 113.487 -178.637 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -58.73 -44.86 90.57 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.402 0.62 . . . . 0.0 110.408 179.781 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.463 ' HB2' ' HB3' ' A' ' 5' ' ' ASN . 12.0 mmt85 -67.47 -45.48 75.81 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.698 178.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 26.9 t80 -58.44 -48.73 79.76 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.088 179.784 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.739 ' HB3' ' HB2' ' B' ' 9' ' ' LEU . 61.9 m -65.9 -23.42 66.63 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.968 -179.811 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.442 ' HB2' ' HA ' ' B' ' 10' ' ' CYS . 37.6 t -88.2 -59.58 2.2 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.433 0.635 . . . . 0.0 110.475 179.531 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 13.0 tp -55.3 -54.2 46.5 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.848 -1.069 . . . . 0.0 111.083 -179.629 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 14.3 m -96.48 -59.52 1.81 Allowed 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.977 -179.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.696 ' HA2' ' O ' ' A' ' 10' ' ' CYS . . . 121.48 156.14 9.67 Favored Glycine 0 N--CA 1.452 -0.29 0 N-CA-C 110.82 -0.912 . . . . 0.0 110.82 -179.692 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.683 ' SG ' HD23 ' B' ' 9' ' ' LEU . 31.3 p -150.56 155.75 40.05 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 117.546 0.673 . . . . 0.0 111.574 -178.985 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.633 HG23 ' HG2' ' B' ' 6' ' ' ARG . 72.8 p -91.01 -173.28 3.61 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.017 -179.495 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 -69.14 -40.13 78.43 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 177.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 62.6 mt-30 -65.79 -39.55 91.07 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.535 178.674 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.589 ' CB ' ' HB2' ' A' ' 15' ' ' CYS . 38.5 m-20 -59.51 -47.19 86.48 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 178.212 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.698 HD13 ' HB1' ' B' ' 17' ' ' ALA . 30.6 mt -63.8 -45.99 87.19 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.804 179.026 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -55.04 -45.14 75.19 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.237 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 23.9 m -60.93 -25.04 66.49 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.557 179.658 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.565 HD13 ' HB3' ' A' ' 6' ' ' PRO . 85.2 mt -79.48 -24.64 42.22 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.593 179.301 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.488 ' HA ' ' HD3' ' A' ' 25' ' ' PRO . 56.5 m -85.04 133.74 42.49 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.126 -179.623 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.488 ' HD3' ' HA ' ' A' ' 24' ' ' CYS . 3.0 Cg_exo -73.79 125.17 9.76 Favored 'Trans proline' 0 N--CA 1.457 -0.652 0 C-N-CA 122.852 2.368 . . . . 0.0 111.68 179.572 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 17.8 t80 . . . . . 0 C--O 1.25 1.08 0 CA-C-O 117.521 -1.228 . . . . 0.0 108.899 179.891 . . . . . . . . 0 0 . 1 stop_ save_