data_1fb9_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 1fb9 _Structure_validation_residue.Date_analyzed 2016-10-06 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.0 mm? . . . . . 0 C--O 1.226 -0.162 0 N-CA-C 111.586 0.217 . . . . 1.0 111.586 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 32.8 t -53.53 -59.23 4.86 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 122.953 0.501 . . . . 1.0 110.207 176.517 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 3.0 m . . . . . 0 N--CA 1.451 -0.414 0 C-N-CA 123.369 0.668 . . . . 1.0 110.677 178.636 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 5.6 p . . . . . 0 CA--C 1.53 0.203 0 CA-C-O 119.597 -0.239 . . . . 1.0 110.567 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 72.6 mt -58.43 -48.6 80.18 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 118.454 0.57 . . . . 1.0 110.18 174.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -53.37 -54.25 30.77 Favored Glycine 0 CA--C 1.525 0.71 0 N-CA-C 110.746 -0.942 . . . . 1.0 110.746 176.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 52.7 mttt -51.09 -66.81 0.32 Allowed 'General case' 0 C--O 1.222 -0.364 0 CA-C-O 118.896 -0.574 . . . . 1.0 110.006 174.514 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 84.0 mt -48.83 -48.98 41.28 Favored 'General case' 0 N--CA 1.456 -0.148 0 CA-C-N 118.472 0.578 . . . . 1.0 110.669 -174.334 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 23.1 t -51.81 -62.14 1.81 Allowed 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 122.797 0.439 . . . . 1.0 111.014 176.587 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 71.3 mt-30 -63.0 -52.88 61.23 Favored 'General case' 0 C--O 1.226 -0.175 0 O-C-N 121.75 -0.594 . . . . 1.0 111.076 -175.512 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -56.43 -53.11 61.29 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 127.518 2.327 . . . . 1.0 110.447 -175.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 84.8 mt -65.51 -39.14 91.49 Favored 'General case' 0 CA--C 1.532 0.253 0 O-C-N 121.56 -0.713 . . . . 1.0 110.439 177.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 5.3 t60 -61.7 -39.33 91.08 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 120.71 -1.244 . . . . 1.0 111.103 175.204 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 61.2 mttm -63.01 -46.76 86.11 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 123.038 0.535 . . . . 1.0 110.107 176.516 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 28.7 tp . . . . . 0 CA--C 1.533 0.289 0 C-N-CA 123.556 0.742 . . . . 1.0 110.804 173.029 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.0 mm? . . . . . 0 CA--C 1.531 0.219 0 N-CA-C 112.366 0.506 . . . . 1.0 112.366 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.1 m -51.72 -55.73 17.92 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.511 0.724 . . . . 1.0 111.319 177.425 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 4.0 m . . . . . 0 N--CA 1.45 -0.43 0 C-N-CA 123.476 0.71 . . . . 1.0 110.376 179.46 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 9.2 p . . . . . 0 N--CA 1.455 -0.2 0 CA-C-O 119.45 -0.309 . . . . 1.0 110.584 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 73.3 mt -58.09 -47.8 82.13 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 118.621 0.646 . . . . 1.0 110.444 175.083 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -52.96 -57.44 14.61 Favored Glycine 0 CA--C 1.524 0.604 0 N-CA-C 110.418 -1.073 . . . . 1.0 110.418 177.446 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 7.7 mtpm? -49.31 -68.67 0.16 Allowed 'General case' 0 C--O 1.221 -0.416 0 N-CA-C 109.055 -0.72 . . . . 1.0 109.055 174.005 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 77.2 mt -44.22 -51.24 8.39 Favored 'General case' 0 C--O 1.225 -0.199 0 C-N-CA 123.605 0.762 . . . . 1.0 111.265 -174.036 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 30.8 t -53.03 -59.65 4.28 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.605 0.762 . . . . 1.0 111.292 177.055 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 86.2 mt-30 -59.04 -42.45 90.29 Favored 'General case' 0 CA--C 1.533 0.301 0 O-C-N 121.814 -0.554 . . . . 1.0 111.032 -177.615 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.29 -50.88 50.61 Favored 'General case' 0 N--CA 1.453 -0.325 0 C-N-CA 126.458 1.903 . . . . 1.0 109.702 -173.047 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.7 pp -66.23 -35.72 81.17 Favored 'General case' 0 C--O 1.234 0.277 0 O-C-N 121.681 -0.637 . . . . 1.0 110.925 177.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 11.0 t-80 -58.35 -47.13 84.77 Favored 'General case' 0 CA--C 1.535 0.385 0 O-C-N 122.143 -0.348 . . . . 1.0 110.243 170.632 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 9.1 mttt -58.89 -55.17 38.64 Favored 'General case' 0 C--O 1.225 -0.22 0 N-CA-C 109.8 -0.445 . . . . 1.0 109.8 176.221 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 61.3 tp . . . . . 0 N--CA 1.455 -0.177 0 C-N-CA 124.591 1.156 . . . . 1.0 110.786 -176.798 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.9 mm? . . . . . 0 C--O 1.226 -0.164 0 CA-C-O 119.47 -0.3 . . . . 1.0 111.098 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.2 m -51.22 -57.58 8.44 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 124.087 0.955 . . . . 1.0 111.247 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 3.8 m . . . . . 0 N--CA 1.453 -0.293 0 C-N-CA 123.426 0.69 . . . . 1.0 110.237 179.944 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 5.1 p . . . . . 0 N--CA 1.454 -0.251 0 CA-C-O 119.138 -0.458 . . . . 1.0 110.541 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 65.9 mt -57.83 -50.85 71.89 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 118.871 0.76 . . . . 1.0 110.408 174.553 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -52.2 -56.19 18.16 Favored Glycine 0 CA--C 1.525 0.695 0 N-CA-C 110.816 -0.914 . . . . 1.0 110.816 177.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.445 ' NZ ' ' OE1' ' A' ' 15' ' ' GLU . 7.9 mtpm? -54.06 -63.79 1.04 Allowed 'General case' 0 C--O 1.217 -0.632 0 CA-C-O 117.829 -1.081 . . . . 1.0 110.217 176.744 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 77.5 mt -45.44 -49.9 13.0 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 119.815 1.188 . . . . 1.0 111.19 -177.599 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 29.4 t -54.53 -58.84 5.91 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 122.988 0.515 . . . . 1.0 110.972 177.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -59.39 -51.9 67.92 Favored 'General case' 0 CA--C 1.535 0.378 0 O-C-N 121.405 -0.809 . . . . 1.0 110.806 -178.403 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.445 ' OE1' ' NZ ' ' A' ' 11' ' ' LYS . 3.4 tp10 -53.32 -53.63 48.22 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 127.25 2.22 . . . . 1.0 110.434 -177.123 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.7 pp -64.84 -40.61 95.44 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 118.377 0.535 . . . . 1.0 110.692 177.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -65.29 -34.93 79.5 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-O 118.571 -0.728 . . . . 1.0 111.738 -177.086 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.64 -39.66 24.08 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 118.977 0.808 . . . . 1.0 111.023 174.443 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 58.4 tp . . . . . 0 C--N 1.339 0.15 0 C-N-CA 123.442 0.697 . . . . 1.0 110.709 176.716 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.9 mm? . . . . . 0 N--CA 1.456 -0.126 0 CA-C-O 119.707 -0.187 . . . . 1.0 111.307 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 32.7 t -55.82 -60.32 3.63 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-O 121.369 0.604 . . . . 1.0 110.56 -171.694 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 18.8 m . . . . . 0 N--CA 1.451 -0.404 0 O-C-N 121.912 -0.493 . . . . 1.0 110.1 -177.674 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 9.8 p . . . . . 0 CA--C 1.53 0.188 0 CA-C-O 119.668 -0.205 . . . . 1.0 110.835 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 72.5 mt -56.6 -49.85 73.72 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 118.143 0.429 . . . . 1.0 110.112 175.675 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -54.9 -51.77 51.11 Favored Glycine 0 CA--C 1.529 0.919 0 N-CA-C 111.014 -0.834 . . . . 1.0 111.014 176.538 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.22 -58.05 8.84 Favored 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 123.91 0.884 . . . . 1.0 109.216 -179.494 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 80.8 mt -55.38 -50.2 70.32 Favored 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 123.076 0.551 . . . . 1.0 110.147 -178.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 22.9 t -52.71 -56.6 14.41 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 122.858 0.463 . . . . 1.0 110.239 179.48 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 27.6 mm-40 -56.25 -55.55 31.9 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 122.954 0.502 . . . . 1.0 110.498 179.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -56.28 -53.56 55.79 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.297 1.039 . . . . 1.0 110.491 -174.286 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 80.5 mt -62.07 -46.76 87.69 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 122.825 0.45 . . . . 1.0 110.552 178.115 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 4.4 t-80 -57.09 -33.58 67.45 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-O 118.992 -0.527 . . . . 1.0 111.012 178.231 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 78.5 tttt -78.02 -45.55 23.38 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 123.501 0.721 . . . . 1.0 110.153 177.7 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 60.8 tp . . . . . 0 CA--C 1.529 0.151 0 C-N-CA 126.08 1.752 . . . . 1.0 111.432 -174.665 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.8 mm? . . . . . 0 N--CA 1.453 -0.317 0 CA-C-O 118.521 -0.752 . . . . 1.0 111.3 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.96 -55.03 40.39 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 119.42 1.009 . . . . 1.0 109.569 -177.449 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.0 m . . . . . 0 N--CA 1.449 -0.484 0 C-N-CA 123.879 0.872 . . . . 1.0 109.906 179.124 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 4.3 p . . . . . 0 N--CA 1.456 -0.165 0 CA-C-O 119.623 -0.227 . . . . 1.0 110.75 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 82.2 mt -60.15 -47.18 86.99 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 118.589 0.631 . . . . 1.0 109.862 175.078 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -52.98 -50.4 51.25 Favored Glycine 0 CA--C 1.526 0.736 0 N-CA-C 111.022 -0.831 . . . . 1.0 111.022 176.417 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 66.7 mttt -55.48 -69.05 0.15 Allowed 'General case' 0 C--O 1.223 -0.312 0 CA-C-O 118.874 -0.584 . . . . 1.0 109.515 172.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 75.2 mt -45.25 -48.53 12.76 Favored 'General case' 0 C--O 1.226 -0.17 0 C-N-CA 124.153 0.981 . . . . 1.0 111.42 -172.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 23.0 t -53.12 -58.42 7.06 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.07 0.548 . . . . 1.0 111.11 177.353 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -62.83 -46.04 89.81 Favored 'General case' 0 CA--C 1.528 0.134 0 O-C-N 121.655 -0.653 . . . . 1.0 110.681 -177.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -62.81 -52.31 63.67 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 126.875 2.07 . . . . 1.0 109.64 -173.389 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.9 pp -64.43 -39.72 94.38 Favored 'General case' 0 N--CA 1.456 -0.148 0 O-C-N 121.726 -0.609 . . . . 1.0 110.242 175.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 63.2 t60 -61.15 -40.68 94.76 Favored 'General case' 0 CA--C 1.534 0.332 0 O-C-N 121.905 -0.497 . . . . 1.0 111.298 178.363 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 59.6 mttm -61.54 -52.89 62.58 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.24 -0.652 . . . . 1.0 109.24 171.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 56.6 tp . . . . . 0 CA--C 1.533 0.301 0 C-N-CA 123.144 0.577 . . . . 1.0 111.379 -178.523 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.0 mm? . . . . . 0 C--O 1.227 -0.085 0 N-CA-C 111.962 0.356 . . . . 1.0 111.962 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 23.0 t -56.99 -59.29 5.28 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 109.842 -0.429 . . . . 1.0 109.842 -179.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 4.2 m . . . . . 0 N--CA 1.449 -0.512 0 C-N-CA 124.034 0.933 . . . . 1.0 110.819 177.608 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 4.6 p . . . . . 0 N--CA 1.453 -0.284 0 CA-C-O 119.586 -0.245 . . . . 1.0 110.428 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 65.0 mt -56.52 -50.42 71.87 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 118.582 0.628 . . . . 1.0 110.145 174.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -57.61 -45.61 93.03 Favored Glycine 0 CA--C 1.528 0.882 0 C-N-CA 124.238 0.923 . . . . 1.0 112.179 179.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.7 ptmm? -64.12 -54.59 31.56 Favored 'General case' 0 C--O 1.223 -0.322 0 N-CA-C 108.87 -0.789 . . . . 1.0 108.87 177.207 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 68.2 mt -52.14 -48.97 64.6 Favored 'General case' 0 C--O 1.227 -0.105 0 C-N-CA 123.131 0.573 . . . . 1.0 110.613 -175.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 23.2 t -51.86 -56.44 13.99 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 121.227 0.537 . . . . 1.0 111.078 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -65.69 -48.06 73.32 Favored 'General case' 0 CA--C 1.531 0.227 0 O-C-N 121.716 -0.615 . . . . 1.0 110.57 -177.339 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -55.16 -55.58 29.54 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 127.089 2.156 . . . . 1.0 110.319 -177.054 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.7 pp -62.53 -42.2 99.37 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 118.562 0.619 . . . . 1.0 110.326 178.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -57.54 -38.7 75.15 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-O 118.85 -0.595 . . . . 1.0 110.676 177.442 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 14.2 mttt -66.97 -54.8 18.35 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 118.373 0.533 . . . . 1.0 110.051 173.342 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 58.3 tp . . . . . 0 C--O 1.232 0.15 0 C-N-CA 126.069 1.748 . . . . 1.0 111.787 -171.759 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.9 mm? . . . . . 0 CA--C 1.529 0.158 0 N-CA-C 112.319 0.489 . . . . 1.0 112.319 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 30.1 t -54.51 -60.82 2.84 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 120.933 0.397 . . . . 1.0 110.497 177.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 3.8 m . . . . . 0 N--CA 1.45 -0.428 0 C-N-CA 123.713 0.805 . . . . 1.0 110.788 179.054 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 4.1 p . . . . . 0 N--CA 1.455 -0.21 0 CA-C-O 119.538 -0.268 . . . . 1.0 110.436 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 75.0 mt -59.09 -49.34 78.26 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 118.389 0.541 . . . . 1.0 110.155 175.19 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -52.85 -55.13 25.0 Favored Glycine 0 CA--C 1.526 0.723 0 N-CA-C 110.615 -0.994 . . . . 1.0 110.615 176.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 24.3 mttt -50.05 -67.74 0.23 Allowed 'General case' 0 C--O 1.222 -0.39 0 CA-C-O 118.948 -0.548 . . . . 1.0 110.104 174.534 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 81.0 mt -48.45 -48.82 37.29 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 118.304 0.502 . . . . 1.0 110.539 -174.142 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 29.1 t -51.11 -63.24 1.19 Allowed 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 122.791 0.437 . . . . 1.0 111.023 176.304 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 66.9 mt-30 -64.12 -50.64 67.44 Favored 'General case' 0 CA--C 1.532 0.279 0 O-C-N 121.589 -0.694 . . . . 1.0 111.15 -174.486 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 15.2 tt0 -56.61 -52.62 64.16 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 127.191 2.196 . . . . 1.0 109.786 -176.052 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 83.5 mt -65.2 -43.42 91.67 Favored 'General case' 0 CA--C 1.532 0.267 0 O-C-N 121.586 -0.696 . . . . 1.0 110.746 176.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -56.64 -40.19 75.01 Favored 'General case' 0 C--N 1.341 0.198 0 O-C-N 121.853 -0.53 . . . . 1.0 110.733 177.511 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -65.1 -54.14 34.49 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 109.312 -0.625 . . . . 1.0 109.312 174.469 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 62.1 tp . . . . . 0 CA--C 1.529 0.156 0 C-N-CA 124.09 0.956 . . . . 1.0 111.493 -178.085 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.0 mm? . . . . . 0 CA--C 1.53 0.209 0 CA-C-O 119.711 -0.185 . . . . 1.0 110.726 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -58.24 -54.05 51.37 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 118.339 0.518 . . . . 1.0 109.882 -176.557 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 20.9 m . . . . . 0 CA--C 1.532 0.262 0 C-N-CA 123.247 0.619 . . . . 1.0 110.703 177.487 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 4.0 p . . . . . 0 CA--C 1.529 0.157 0 CA-C-O 119.438 -0.315 . . . . 1.0 110.652 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 77.7 mt -60.08 -46.69 88.74 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-N 118.651 0.66 . . . . 1.0 110.089 175.766 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -52.87 -57.35 14.71 Favored Glycine 0 CA--C 1.527 0.821 0 N-CA-C 110.657 -0.977 . . . . 1.0 110.657 175.513 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 66.2 mttt -49.69 -63.15 1.2 Allowed 'General case' 0 C--O 1.223 -0.326 0 CA-C-O 119.17 -0.443 . . . . 1.0 110.328 175.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 74.4 mt -49.77 -49.15 49.45 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.044 0.538 . . . . 1.0 110.54 -176.019 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 22.9 t -54.97 -58.0 9.41 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 122.986 0.514 . . . . 1.0 111.295 178.651 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -62.7 -45.03 94.67 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 121.377 0.608 . . . . 1.0 110.652 -175.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -63.4 -49.37 74.08 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 125.962 1.705 . . . . 1.0 110.052 -176.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.6 pp -68.19 -34.7 76.77 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 118.776 0.716 . . . . 1.0 111.072 177.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -58.79 -46.01 88.54 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 121.553 -0.717 . . . . 1.0 109.91 172.394 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 18.5 mttt -58.83 -59.23 5.76 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 118.241 0.473 . . . . 1.0 110.027 174.012 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 57.6 tp . . . . . 0 N--CA 1.453 -0.29 0 C-N-CA 124.326 1.05 . . . . 1.0 110.805 -174.658 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.532 0.284 0 N-CA-C 111.714 0.265 . . . . 1.0 111.714 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.0 m -51.54 -55.74 17.34 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.115 0.966 . . . . 1.0 111.312 175.785 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 5.8 m . . . . . 0 N--CA 1.452 -0.365 0 C-N-CA 123.297 0.639 . . . . 1.0 110.022 178.993 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 9.8 p . . . . . 0 CA--C 1.531 0.22 0 CA-C-O 119.242 -0.408 . . . . 1.0 110.804 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 67.8 mt -58.1 -49.56 76.51 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 118.989 0.813 . . . . 1.0 110.598 176.324 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -56.07 -51.21 57.12 Favored Glycine 0 CA--C 1.527 0.786 0 N-CA-C 110.804 -0.918 . . . . 1.0 110.804 177.248 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 46.1 tttm -54.43 -56.69 16.12 Favored 'General case' 0 C--O 1.222 -0.35 0 C-N-CA 123.02 0.528 . . . . 1.0 109.584 178.37 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 76.5 mt -54.16 -48.08 71.26 Favored 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 123.277 0.631 . . . . 1.0 110.687 -179.523 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 25.0 t -53.23 -53.6 48.37 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.027 0.531 . . . . 1.0 110.374 178.023 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 56.3 mm-40 -54.56 -56.72 16.01 Favored 'General case' 0 CA--C 1.531 0.237 0 O-C-N 122.083 -0.386 . . . . 1.0 110.529 175.109 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -52.31 -56.26 15.97 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 125.087 1.355 . . . . 1.0 110.509 -174.546 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.3 pp -64.8 -41.56 95.72 Favored 'General case' 0 N--CA 1.455 -0.208 0 O-C-N 122.321 -0.237 . . . . 1.0 110.464 -178.034 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -62.56 -36.48 82.79 Favored 'General case' 0 CA--C 1.532 0.271 0 O-C-N 121.963 -0.461 . . . . 1.0 110.848 179.476 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.08 -62.13 1.73 Allowed 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 108.836 -0.801 . . . . 1.0 108.836 170.77 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 59.0 tp . . . . . 0 CA--C 1.532 0.265 0 C-N-CA 125.171 1.389 . . . . 1.0 112.396 -176.357 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.534 0.357 0 N-CA-C 112.506 0.558 . . . . 1.0 112.506 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 33.5 t -54.81 -53.53 54.08 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.069 0.548 . . . . 1.0 111.044 175.069 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.6 m . . . . . 0 CA--C 1.529 0.156 0 C-N-CA 122.983 0.513 . . . . 1.0 109.947 176.452 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 6.3 p . . . . . 0 CA--C 1.531 0.241 0 CA-C-O 119.241 -0.409 . . . . 1.0 110.92 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 57.2 mt -58.47 -48.5 80.54 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 118.983 0.81 . . . . 1.0 110.644 174.338 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -54.77 -54.73 31.4 Favored Glycine 0 CA--C 1.528 0.884 0 N-CA-C 110.597 -1.001 . . . . 1.0 110.597 177.183 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 19.9 tttp -47.77 -62.66 1.34 Allowed 'General case' 0 C--O 1.223 -0.34 0 C-N-CA 123.577 0.751 . . . . 1.0 109.697 174.09 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 63.6 mt -52.29 -48.17 65.5 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 123.073 0.549 . . . . 1.0 110.759 -176.099 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 23.0 t -53.47 -59.74 4.19 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 117.959 0.345 . . . . 1.0 110.661 178.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 94.1 mt-30 -61.72 -51.94 66.33 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-O 121.001 0.429 . . . . 1.0 110.669 -176.359 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -55.55 -55.86 26.96 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 127.112 2.165 . . . . 1.0 110.69 -177.117 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 86.7 mt -63.55 -43.6 96.59 Favored 'General case' 0 N--CA 1.455 -0.177 0 O-C-N 121.934 -0.479 . . . . 1.0 110.132 179.451 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 37.7 t60 -57.97 -41.85 83.8 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 122.065 -0.397 . . . . 1.0 111.226 177.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 59.6 tttm -65.82 -44.96 84.04 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 123.779 0.832 . . . . 1.0 109.918 176.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 63.2 tp . . . . . 0 N--CA 1.455 -0.183 0 C-N-CA 123.822 0.849 . . . . 1.0 110.625 179.691 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' CSU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.5 t -81.07 41.03 0.57 Allowed 'General case' 0 CA--C 1.536 0.41 0 O-C-N 121.668 -0.645 . . . . 1.0 109.971 173.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 35.0 p-10 -111.35 59.63 0.62 Allowed 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 124.925 1.29 . . . . 1.0 109.175 -171.044 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.438 HD13 ' OD2' ' A' ' 7' ' ' CSU . 4.0 mm? -49.92 -43.82 49.98 Favored 'General case' 0 C--O 1.226 -0.162 0 C-N-CA 124.498 1.119 . . . . 1.0 111.586 -177.176 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 32.8 t -53.53 -59.23 4.86 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 122.953 0.501 . . . . 1.0 110.207 176.517 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 3.0 m -54.46 -46.54 73.34 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 123.369 0.668 . . . . 1.0 110.677 178.636 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' CSU . . . . . 0.438 ' OD2' HD13 ' A' ' 4' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 5.6 p -66.7 -41.51 88.18 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 O-C-N 122.048 -0.407 . . . . 1.0 110.567 -176.106 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 72.6 mt -58.43 -48.6 80.18 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 118.454 0.57 . . . . 1.0 110.18 174.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -53.37 -54.25 30.77 Favored Glycine 0 CA--C 1.525 0.71 0 N-CA-C 110.746 -0.942 . . . . 1.0 110.746 176.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 52.7 mttt -51.09 -66.81 0.32 Allowed 'General case' 0 C--O 1.222 -0.364 0 CA-C-O 118.896 -0.574 . . . . 1.0 110.006 174.514 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 84.0 mt -48.83 -48.98 41.28 Favored 'General case' 0 N--CA 1.456 -0.148 0 CA-C-N 118.472 0.578 . . . . 1.0 110.669 -174.334 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 23.1 t -51.81 -62.14 1.81 Allowed 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 122.797 0.439 . . . . 1.0 111.014 176.587 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 71.3 mt-30 -63.0 -52.88 61.23 Favored 'General case' 0 C--O 1.226 -0.175 0 O-C-N 121.75 -0.594 . . . . 1.0 111.076 -175.512 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -56.43 -53.11 61.29 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 127.518 2.327 . . . . 1.0 110.447 -175.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 84.8 mt -65.51 -39.14 91.49 Favored 'General case' 0 CA--C 1.532 0.253 0 O-C-N 121.56 -0.713 . . . . 1.0 110.439 177.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 5.3 t60 -61.7 -39.33 91.08 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 120.71 -1.244 . . . . 1.0 111.103 175.204 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 61.2 mttm -63.01 -46.76 86.11 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 123.038 0.535 . . . . 1.0 110.107 176.516 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 28.7 tp -45.84 -47.5 15.9 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 123.556 0.742 . . . . 1.0 110.804 173.029 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 -57.21 -45.94 83.36 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 118.184 0.447 . . . . 1.0 111.579 176.411 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 74.5 p -75.84 -25.39 56.2 Favored 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 113.212 0.819 . . . . 1.0 113.212 -174.743 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -55.18 142.55 57.67 Favored Pre-proline 0 CA--C 1.538 0.483 0 CA-C-N 118.645 0.657 . . . . 1.0 110.968 -178.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -65.53 -45.06 7.48 Favored 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 122.935 2.424 . . . . 1.0 111.454 -175.074 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -165.51 106.4 0.76 Allowed 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 109.73 -0.47 . . . . 1.0 109.73 176.217 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 17.0 p -79.32 -26.31 42.21 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.768 0.827 . . . . 1.0 110.973 171.175 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -80.78 62.65 4.89 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.868 0.867 . . . . 1.0 109.388 -169.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 16.0 p -104.46 0.54 29.01 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.483 1.513 . . . . 1.0 112.119 -174.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -50.68 -45.41 48.04 Favored Glycine 0 CA--C 1.53 0.97 0 C-N-CA 124.002 0.811 . . . . 1.0 112.82 -173.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 19.1 p -167.95 -87.66 0.01 OUTLIER 'General case' 0 N--CA 1.456 -0.157 0 N-CA-C 108.463 -0.94 . . . . 1.0 108.463 172.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 177.82 131.23 1.5 Allowed Glycine 0 CA--C 1.524 0.639 0 N-CA-C 108.978 -1.649 . . . . 1.0 108.978 179.441 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 13.1 t -65.97 137.82 96.07 Favored Pre-proline 0 CA--C 1.537 0.467 0 N-CA-C 108.945 -0.761 . . . . 1.0 108.945 176.011 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -65.5 86.71 0.21 Allowed 'Trans proline' 0 N--CA 1.454 -0.816 0 C-N-CA 122.165 1.91 . . . . 1.0 109.735 -178.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.338 0.087 0 O-C-N 121.866 -0.521 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' CSU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.8 m -147.39 28.15 0.99 Allowed 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 121.927 0.87 . . . . 1.0 109.318 167.169 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 6.3 m120 -89.84 68.48 7.44 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 108.413 -0.958 . . . . 1.0 108.413 -160.712 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -41.27 -51.74 3.53 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.869 1.268 . . . . 1.0 112.366 -175.543 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.1 m -51.72 -55.73 17.92 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.511 0.724 . . . . 1.0 111.319 177.425 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 4.0 m -58.69 -44.65 90.35 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 123.476 0.71 . . . . 1.0 110.376 179.46 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' CSU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 9.2 p -64.68 -43.45 96.61 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.2 0 O-C-N 122.016 -0.428 . . . . 1.0 110.584 -176.363 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 73.3 mt -58.09 -47.8 82.13 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 118.621 0.646 . . . . 1.0 110.444 175.083 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -52.96 -57.44 14.61 Favored Glycine 0 CA--C 1.524 0.604 0 N-CA-C 110.418 -1.073 . . . . 1.0 110.418 177.446 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 7.7 mtpm? -49.31 -68.67 0.16 Allowed 'General case' 0 C--O 1.221 -0.416 0 N-CA-C 109.055 -0.72 . . . . 1.0 109.055 174.005 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 77.2 mt -44.22 -51.24 8.39 Favored 'General case' 0 C--O 1.225 -0.199 0 C-N-CA 123.605 0.762 . . . . 1.0 111.265 -174.036 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 30.8 t -53.03 -59.65 4.28 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.605 0.762 . . . . 1.0 111.292 177.055 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 86.2 mt-30 -59.04 -42.45 90.29 Favored 'General case' 0 CA--C 1.533 0.301 0 O-C-N 121.814 -0.554 . . . . 1.0 111.032 -177.615 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.29 -50.88 50.61 Favored 'General case' 0 N--CA 1.453 -0.325 0 C-N-CA 126.458 1.903 . . . . 1.0 109.702 -173.047 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.7 pp -66.23 -35.72 81.17 Favored 'General case' 0 C--O 1.234 0.277 0 O-C-N 121.681 -0.637 . . . . 1.0 110.925 177.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 11.0 t-80 -58.35 -47.13 84.77 Favored 'General case' 0 CA--C 1.535 0.385 0 O-C-N 122.143 -0.348 . . . . 1.0 110.243 170.632 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 9.1 mttt -58.89 -55.17 38.64 Favored 'General case' 0 C--O 1.225 -0.22 0 N-CA-C 109.8 -0.445 . . . . 1.0 109.8 176.221 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 61.3 tp -48.56 -54.68 13.55 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 124.591 1.156 . . . . 1.0 110.786 -176.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -67.74 -7.1 24.54 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 113.32 0.859 . . . . 1.0 113.32 -177.493 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 36.6 p -116.07 10.21 14.98 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.038 0.935 . . . . 1.0 111.92 172.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 2.9 m-30 -86.4 150.41 51.51 Favored Pre-proline 0 CA--C 1.533 0.292 0 CA-C-N 119.132 0.878 . . . . 1.0 109.787 174.754 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_endo -65.78 147.08 85.14 Favored 'Trans proline' 0 N--CA 1.453 -0.899 0 C-N-CA 122.501 2.134 . . . . 1.0 109.645 171.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 21.1 tpt180 -78.52 62.94 3.23 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.385 0.674 . . . . 1.0 110.516 -174.372 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 19.4 p -69.21 -50.94 42.77 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 124.241 1.016 . . . . 1.0 110.51 -179.727 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -71.31 76.18 0.73 Allowed 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 125.095 1.358 . . . . 1.0 110.37 -167.165 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 13.5 p -119.63 60.97 0.84 Allowed 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 126.087 1.755 . . . . 1.0 108.96 -175.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -47.74 -42.95 21.92 Favored Glycine 0 CA--C 1.532 1.114 0 C-N-CA 124.316 0.96 . . . . 1.0 113.23 -174.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 14.9 m 54.93 47.32 22.47 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.805 0.842 . . . . 1.0 112.471 174.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -66.91 168.97 35.78 Favored Glycine 0 CA--C 1.531 1.038 0 N-CA-C 110.644 -0.982 . . . . 1.0 110.644 171.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 1.2 p -98.47 90.35 1.0 Allowed Pre-proline 0 CA--C 1.539 0.536 0 C-N-CA 125.584 1.553 . . . . 1.0 110.449 -176.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -63.87 143.97 87.15 Favored 'Trans proline' 0 N--CA 1.457 -0.67 0 C-N-CA 121.378 1.385 . . . . 1.0 110.313 175.06 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.338 0.074 0 O-C-N 121.848 -0.532 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' CSU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.8 t -150.32 40.78 0.79 Allowed 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 108.346 -0.983 . . . . 1.0 108.346 177.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 20.4 m120 -147.17 83.61 1.57 Allowed 'General case' 0 N--CA 1.456 -0.138 0 N-CA-C 108.366 -0.976 . . . . 1.0 108.366 -169.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -46.5 -52.73 12.66 Favored 'General case' 0 C--O 1.226 -0.164 0 C-N-CA 123.975 0.91 . . . . 1.0 111.098 -177.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.2 m -51.22 -57.58 8.44 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 124.087 0.955 . . . . 1.0 111.247 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 3.8 m -57.24 -48.25 79.31 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 123.426 0.69 . . . . 1.0 110.237 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' CSU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 5.1 p -65.6 -41.85 91.59 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.251 0 CA-C-O 119.138 -0.458 . . . . 1.0 110.541 -175.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 65.9 mt -57.83 -50.85 71.89 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 118.871 0.76 . . . . 1.0 110.408 174.553 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -52.2 -56.19 18.16 Favored Glycine 0 CA--C 1.525 0.695 0 N-CA-C 110.816 -0.914 . . . . 1.0 110.816 177.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.445 ' NZ ' ' OE1' ' A' ' 15' ' ' GLU . 7.9 mtpm? -54.06 -63.79 1.04 Allowed 'General case' 0 C--O 1.217 -0.632 0 CA-C-O 117.829 -1.081 . . . . 1.0 110.217 176.744 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 77.5 mt -45.44 -49.9 13.0 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 119.815 1.188 . . . . 1.0 111.19 -177.599 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 29.4 t -54.53 -58.84 5.91 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 122.988 0.515 . . . . 1.0 110.972 177.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -59.39 -51.9 67.92 Favored 'General case' 0 CA--C 1.535 0.378 0 O-C-N 121.405 -0.809 . . . . 1.0 110.806 -178.403 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.445 ' OE1' ' NZ ' ' A' ' 11' ' ' LYS . 3.4 tp10 -53.32 -53.63 48.22 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 127.25 2.22 . . . . 1.0 110.434 -177.123 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.7 pp -64.84 -40.61 95.44 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 118.377 0.535 . . . . 1.0 110.692 177.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -65.29 -34.93 79.5 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-O 118.571 -0.728 . . . . 1.0 111.738 -177.086 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.64 -39.66 24.08 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 118.977 0.808 . . . . 1.0 111.023 174.443 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 58.4 tp -50.77 -52.35 41.64 Favored 'General case' 0 C--N 1.339 0.15 0 C-N-CA 123.442 0.697 . . . . 1.0 110.709 176.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -56.34 -23.97 40.89 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 113.003 0.742 . . . . 1.0 113.003 -179.175 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 10.5 p -98.23 -2.75 38.96 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 123.596 0.758 . . . . 1.0 113.034 177.379 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 10.3 m-30 -65.96 150.3 96.7 Favored Pre-proline 0 CA--C 1.537 0.465 0 CA-C-N 119.641 1.109 . . . . 1.0 110.459 178.251 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_endo -63.38 126.47 17.79 Favored 'Trans proline' 0 N--CA 1.454 -0.818 0 C-N-CA 122.882 2.388 . . . . 1.0 110.443 179.436 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 9.8 tpt180 -76.46 80.99 3.17 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 122.983 0.513 . . . . 1.0 110.589 -173.462 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 7.9 p -49.61 -38.13 30.58 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.478 1.111 . . . . 1.0 112.216 172.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -70.08 66.54 0.27 Allowed 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.501 1.12 . . . . 1.0 112.116 -179.612 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 6.2 m -74.9 59.91 0.93 Allowed 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.518 1.127 . . . . 1.0 109.003 169.182 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 158.98 65.44 0.01 OUTLIER Glycine 0 CA--C 1.525 0.692 0 N-CA-C 109.76 -1.336 . . . . 1.0 109.76 -171.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 61.3 m -154.3 -57.87 0.11 Allowed 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 123.842 0.857 . . . . 1.0 108.697 173.552 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 66.63 -80.65 0.12 Allowed Glycine 0 CA--C 1.527 0.831 0 N-CA-C 111.599 -0.6 . . . . 1.0 111.599 176.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 40.6 p -114.08 76.54 3.48 Favored Pre-proline 0 CA--C 1.534 0.365 0 C-N-CA 126.063 1.745 . . . . 1.0 108.673 -178.617 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -65.95 144.32 76.05 Favored 'Trans proline' 0 N--CA 1.454 -0.799 0 C-N-CA 121.898 1.732 . . . . 1.0 110.084 178.018 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.338 0.082 0 O-C-N 121.843 -0.535 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' CSU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 29.8 p -76.6 63.75 2.13 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.607 1.163 . . . . 1.0 110.607 -175.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 41.3 t-20 -167.13 99.89 0.53 Allowed 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.581 0.752 . . . . 1.0 110.193 -176.134 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -57.42 -55.58 32.91 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 123.649 0.78 . . . . 1.0 111.307 179.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 32.7 t -55.82 -60.32 3.63 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-O 121.369 0.604 . . . . 1.0 110.56 -171.694 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 18.8 m -60.84 -40.47 92.95 Favored 'General case' 0 N--CA 1.451 -0.404 0 O-C-N 121.912 -0.493 . . . . 1.0 110.1 -177.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' CSU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 9.8 p -63.74 -43.16 97.9 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 CA-C-N 118.556 0.616 . . . . 1.0 110.835 -175.117 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 72.5 mt -56.6 -49.85 73.72 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 118.143 0.429 . . . . 1.0 110.112 175.675 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -54.9 -51.77 51.11 Favored Glycine 0 CA--C 1.529 0.919 0 N-CA-C 111.014 -0.834 . . . . 1.0 111.014 176.538 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.22 -58.05 8.84 Favored 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 123.91 0.884 . . . . 1.0 109.216 -179.494 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 80.8 mt -55.38 -50.2 70.32 Favored 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 123.076 0.551 . . . . 1.0 110.147 -178.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 22.9 t -52.71 -56.6 14.41 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 122.858 0.463 . . . . 1.0 110.239 179.48 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 27.6 mm-40 -56.25 -55.55 31.9 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 122.954 0.502 . . . . 1.0 110.498 179.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -56.28 -53.56 55.79 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.297 1.039 . . . . 1.0 110.491 -174.286 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 80.5 mt -62.07 -46.76 87.69 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 122.825 0.45 . . . . 1.0 110.552 178.115 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 4.4 t-80 -57.09 -33.58 67.45 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-O 118.992 -0.527 . . . . 1.0 111.012 178.231 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 78.5 tttt -78.02 -45.55 23.38 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 123.501 0.721 . . . . 1.0 110.153 177.7 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 60.8 tp -48.27 -52.46 21.15 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 126.08 1.752 . . . . 1.0 111.432 -174.665 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 15.5 pt20 -50.67 -29.64 11.65 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 113.006 0.743 . . . . 1.0 113.006 177.556 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 4.2 p -111.11 16.04 21.29 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.474 1.509 . . . . 1.0 111.585 -178.152 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 3.4 t80 -72.61 152.85 91.66 Favored Pre-proline 0 CA--C 1.535 0.381 0 O-C-N 121.392 -0.818 . . . . 1.0 109.386 -177.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -55.37 155.98 18.72 Favored 'Trans proline' 0 N--CA 1.455 -0.763 0 C-N-CA 121.424 1.416 . . . . 1.0 110.152 166.253 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 21.7 ttp85 -78.77 57.56 2.12 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.425 0.69 . . . . 1.0 111.724 -168.013 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 7.9 m -57.12 -56.54 20.4 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 123.835 0.854 . . . . 1.0 109.166 174.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -76.39 73.07 3.15 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 109.48 -0.563 . . . . 1.0 109.48 174.628 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 85.0 m -71.0 71.77 0.56 Allowed 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 108.638 -0.875 . . . . 1.0 108.638 167.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -71.33 -37.14 63.13 Favored Glycine 0 CA--C 1.529 0.907 0 N-CA-C 110.905 -0.878 . . . . 1.0 110.905 176.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 21.8 m 55.55 49.66 16.15 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.127 0.971 . . . . 1.0 111.538 177.477 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -81.96 -152.6 10.3 Favored Glycine 0 CA--C 1.53 0.996 0 N-CA-C 111.36 -0.696 . . . . 1.0 111.36 177.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 14.7 t -55.43 138.59 68.03 Favored Pre-proline 0 CA--C 1.54 0.562 0 C-N-CA 123.11 0.564 . . . . 1.0 110.196 178.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -65.67 80.7 0.25 Allowed 'Trans proline' 0 N--CA 1.454 -0.805 0 C-N-CA 122.225 1.95 . . . . 1.0 109.648 -179.042 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.338 0.086 0 O-C-N 121.845 -0.535 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' CSU . . . . . 0.865 ' OD3' ' SG ' ' A' ' 7' ' ' CSU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 85.3 p -159.71 52.37 0.35 Allowed 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 110.173 -0.306 . . . . 1.0 110.173 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 29.3 t30 -164.09 130.52 3.11 Favored 'General case' 0 C--O 1.231 0.108 0 C-N-CA 122.447 0.299 . . . . 1.0 110.46 172.477 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -59.32 -45.2 91.98 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 123.948 0.899 . . . . 1.0 111.3 177.487 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.96 -55.03 40.39 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 119.42 1.009 . . . . 1.0 109.569 -177.449 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.0 m -55.67 -48.58 74.8 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 123.879 0.872 . . . . 1.0 109.906 179.124 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' CSU . . . . . 0.865 ' SG ' ' OD3' ' A' ' 1' ' ' CSU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 4.3 p -66.83 -42.83 89.69 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.165 0 O-C-N 121.967 -0.458 . . . . 1.0 110.75 -174.291 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 82.2 mt -60.15 -47.18 86.99 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 118.589 0.631 . . . . 1.0 109.862 175.078 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -52.98 -50.4 51.25 Favored Glycine 0 CA--C 1.526 0.736 0 N-CA-C 111.022 -0.831 . . . . 1.0 111.022 176.417 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 66.7 mttt -55.48 -69.05 0.15 Allowed 'General case' 0 C--O 1.223 -0.312 0 CA-C-O 118.874 -0.584 . . . . 1.0 109.515 172.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 75.2 mt -45.25 -48.53 12.76 Favored 'General case' 0 C--O 1.226 -0.17 0 C-N-CA 124.153 0.981 . . . . 1.0 111.42 -172.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 23.0 t -53.12 -58.42 7.06 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.07 0.548 . . . . 1.0 111.11 177.353 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -62.83 -46.04 89.81 Favored 'General case' 0 CA--C 1.528 0.134 0 O-C-N 121.655 -0.653 . . . . 1.0 110.681 -177.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -62.81 -52.31 63.67 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 126.875 2.07 . . . . 1.0 109.64 -173.389 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.9 pp -64.43 -39.72 94.38 Favored 'General case' 0 N--CA 1.456 -0.148 0 O-C-N 121.726 -0.609 . . . . 1.0 110.242 175.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 63.2 t60 -61.15 -40.68 94.76 Favored 'General case' 0 CA--C 1.534 0.332 0 O-C-N 121.905 -0.497 . . . . 1.0 111.298 178.363 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 59.6 mttm -61.54 -52.89 62.58 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.24 -0.652 . . . . 1.0 109.24 171.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 56.6 tp -49.28 -53.86 19.75 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.144 0.577 . . . . 1.0 111.379 -178.523 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -63.85 -11.77 30.35 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 113.174 0.805 . . . . 1.0 113.174 -179.076 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 25.0 p -120.2 22.44 11.38 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.104 0.962 . . . . 1.0 111.199 173.672 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.19 150.96 96.38 Favored Pre-proline 0 CA--C 1.536 0.415 0 O-C-N 121.415 -0.803 . . . . 1.0 111.074 -175.46 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -61.51 144.49 97.95 Favored 'Trans proline' 0 N--CA 1.452 -0.927 0 N-CA-C 108.201 -1.5 . . . . 1.0 108.201 165.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 39.1 ttm180 -68.12 75.9 0.23 Allowed 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.002 0.921 . . . . 1.0 111.005 -171.386 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 18.9 m -74.27 -29.3 61.6 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.676 1.191 . . . . 1.0 110.082 -174.523 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 12.1 t-20 61.06 27.4 17.25 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.28 1.032 . . . . 1.0 112.779 172.169 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -62.38 115.49 4.25 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 124.017 0.927 . . . . 1.0 108.632 170.55 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 164.59 -53.21 0.28 Allowed Glycine 0 CA--C 1.522 0.489 0 N-CA-C 108.17 -1.972 . . . . 1.0 108.17 -174.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 5.3 m 59.72 32.58 21.51 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 112.884 0.698 . . . . 1.0 112.884 162.369 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 159.67 -77.42 0.18 Allowed Glycine 0 C--N 1.335 0.499 0 N-CA-C 107.087 -2.405 . . . . 1.0 107.087 179.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 1.2 p -69.37 159.04 85.15 Favored Pre-proline 0 N--CA 1.449 -0.522 0 N-CA-C 108.499 -0.926 . . . . 1.0 108.499 161.118 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -66.52 149.37 84.38 Favored 'Trans proline' 0 N--CA 1.453 -0.863 0 C-N-CA 122.062 1.841 . . . . 1.0 109.743 171.59 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.338 0.103 0 O-C-N 121.825 -0.547 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' CSU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.7 t -77.25 61.61 2.15 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-O 122.168 0.985 . . . . 1.0 108.806 177.299 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 67.3 m-20 -86.32 56.84 4.17 Favored 'General case' 0 CA--C 1.528 0.131 0 C-N-CA 123.689 0.796 . . . . 1.0 109.422 -165.396 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.417 HD11 ' OD2' ' A' ' 7' ' ' CSU . 4.0 mm? -54.75 -45.87 74.24 Favored 'General case' 0 C--O 1.227 -0.085 0 C-N-CA 123.677 0.791 . . . . 1.0 111.962 -170.025 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 23.0 t -56.99 -59.29 5.28 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 109.842 -0.429 . . . . 1.0 109.842 -179.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 4.2 m -51.21 -49.38 61.16 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 124.034 0.933 . . . . 1.0 110.819 177.608 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' CSU . . . . . 0.417 ' OD2' HD11 ' A' ' 4' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 4.6 p -65.24 -43.04 95.36 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.284 0 O-C-N 122.115 -0.365 . . . . 1.0 110.428 -175.316 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 65.0 mt -56.52 -50.42 71.87 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 118.582 0.628 . . . . 1.0 110.145 174.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -57.61 -45.61 93.03 Favored Glycine 0 CA--C 1.528 0.882 0 C-N-CA 124.238 0.923 . . . . 1.0 112.179 179.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.7 ptmm? -64.12 -54.59 31.56 Favored 'General case' 0 C--O 1.223 -0.322 0 N-CA-C 108.87 -0.789 . . . . 1.0 108.87 177.207 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 68.2 mt -52.14 -48.97 64.6 Favored 'General case' 0 C--O 1.227 -0.105 0 C-N-CA 123.131 0.573 . . . . 1.0 110.613 -175.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 23.2 t -51.86 -56.44 13.99 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 121.227 0.537 . . . . 1.0 111.078 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -65.69 -48.06 73.32 Favored 'General case' 0 CA--C 1.531 0.227 0 O-C-N 121.716 -0.615 . . . . 1.0 110.57 -177.339 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -55.16 -55.58 29.54 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 127.089 2.156 . . . . 1.0 110.319 -177.054 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.7 pp -62.53 -42.2 99.37 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 118.562 0.619 . . . . 1.0 110.326 178.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -57.54 -38.7 75.15 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-O 118.85 -0.595 . . . . 1.0 110.676 177.442 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 14.2 mttt -66.97 -54.8 18.35 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 118.373 0.533 . . . . 1.0 110.051 173.342 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 58.3 tp -51.08 -40.02 57.4 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 126.069 1.748 . . . . 1.0 111.787 -171.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 16.9 pt20 -65.99 -54.69 22.97 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 120.893 -0.323 . . . . 1.0 111.03 174.022 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 6.2 p -64.42 -24.94 67.8 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 113.363 0.875 . . . . 1.0 113.363 -176.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 2.1 m-30 -54.36 160.65 2.42 Favored Pre-proline 0 CA--C 1.542 0.662 0 C-N-CA 123.832 0.853 . . . . 1.0 112.153 -178.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 79.6 Cg_endo -68.46 -174.69 0.72 Allowed 'Trans proline' 0 N--CA 1.454 -0.835 0 C-N-CA 123.469 2.779 . . . . 1.0 110.396 173.086 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -157.52 149.45 22.3 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 107.057 -1.46 . . . . 1.0 107.057 178.55 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 9.1 p -83.65 -61.7 1.77 Allowed 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 124.864 1.265 . . . . 1.0 108.838 -178.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 50.4 m-20 113.31 74.74 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 130.261 3.424 . . . . 1.0 108.976 179.462 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 2.9 m -66.84 71.68 0.09 Allowed 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.146 1.378 . . . . 1.0 109.651 173.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 74.53 -65.82 2.05 Favored Glycine 0 CA--C 1.529 0.952 0 N-CA-C 110.215 -1.154 . . . . 1.0 110.215 -171.268 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 24.1 p -84.8 -70.68 0.56 Allowed 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 123.936 0.894 . . . . 1.0 110.607 -178.218 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 78.59 34.55 35.07 Favored Glycine 0 CA--C 1.527 0.831 0 N-CA-C 111.373 -0.691 . . . . 1.0 111.373 -171.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -61.54 148.32 86.58 Favored Pre-proline 0 N--CA 1.448 -0.569 0 O-C-N 121.868 -0.783 . . . . 1.0 110.048 174.308 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -67.83 153.31 75.98 Favored 'Trans proline' 0 N--CA 1.452 -0.952 0 C-N-CA 122.294 1.996 . . . . 1.0 109.761 174.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.338 0.077 0 O-C-N 121.838 -0.539 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' CSU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.5 m -72.29 -40.51 67.49 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.994 0.918 . . . . 1.0 109.439 167.043 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 5.1 m-80 74.65 101.77 0.07 Allowed 'General case' 0 C--N 1.341 0.21 0 C-N-CA 126.305 1.842 . . . . 1.0 109.998 172.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -47.54 -45.75 27.1 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 124.033 0.933 . . . . 1.0 112.319 -174.027 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 30.1 t -54.51 -60.82 2.84 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 120.933 0.397 . . . . 1.0 110.497 177.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 3.8 m -53.05 -48.41 67.67 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 123.713 0.805 . . . . 1.0 110.788 179.054 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' CSU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 4.1 p -66.89 -41.59 87.84 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.21 0 O-C-N 122.026 -0.421 . . . . 1.0 110.436 -174.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 75.0 mt -59.09 -49.34 78.26 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 118.389 0.541 . . . . 1.0 110.155 175.19 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -52.85 -55.13 25.0 Favored Glycine 0 CA--C 1.526 0.723 0 N-CA-C 110.615 -0.994 . . . . 1.0 110.615 176.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 24.3 mttt -50.05 -67.74 0.23 Allowed 'General case' 0 C--O 1.222 -0.39 0 CA-C-O 118.948 -0.548 . . . . 1.0 110.104 174.534 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 81.0 mt -48.45 -48.82 37.29 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 118.304 0.502 . . . . 1.0 110.539 -174.142 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 29.1 t -51.11 -63.24 1.19 Allowed 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 122.791 0.437 . . . . 1.0 111.023 176.304 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 66.9 mt-30 -64.12 -50.64 67.44 Favored 'General case' 0 CA--C 1.532 0.279 0 O-C-N 121.589 -0.694 . . . . 1.0 111.15 -174.486 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 15.2 tt0 -56.61 -52.62 64.16 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 127.191 2.196 . . . . 1.0 109.786 -176.052 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 83.5 mt -65.2 -43.42 91.67 Favored 'General case' 0 CA--C 1.532 0.267 0 O-C-N 121.586 -0.696 . . . . 1.0 110.746 176.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -56.64 -40.19 75.01 Favored 'General case' 0 C--N 1.341 0.198 0 O-C-N 121.853 -0.53 . . . . 1.0 110.733 177.511 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -65.1 -54.14 34.49 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 109.312 -0.625 . . . . 1.0 109.312 174.469 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 62.1 tp -46.37 -53.36 11.08 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 124.09 0.956 . . . . 1.0 111.493 -178.085 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 15.5 pt20 -61.5 -24.33 66.52 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 113.026 0.75 . . . . 1.0 113.026 -176.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 13.2 p -96.42 1.88 52.1 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.382 0.673 . . . . 1.0 112.294 175.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 24.1 t80 -74.31 143.08 79.29 Favored Pre-proline 0 CA--C 1.536 0.425 0 O-C-N 121.359 -0.838 . . . . 1.0 110.684 -170.08 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -65.76 91.03 0.24 Allowed 'Trans proline' 0 N--CA 1.454 -0.803 0 C-N-CA 122.6 2.2 . . . . 1.0 110.64 176.227 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 61.8 ttp180 -66.41 75.95 0.1 Allowed 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 125.284 1.434 . . . . 1.0 110.776 176.282 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 2.0 p -62.74 -36.92 84.61 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 125.214 1.406 . . . . 1.0 112.808 -179.588 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -82.44 63.35 6.56 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 123.346 0.659 . . . . 1.0 111.379 -163.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 9.6 m -69.28 69.88 0.23 Allowed 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 127.09 2.156 . . . . 1.0 111.504 -177.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -171.21 49.67 0.19 Allowed Glycine 0 CA--C 1.522 0.488 0 N-CA-C 108.077 -2.009 . . . . 1.0 108.077 176.202 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.6 t 54.88 47.46 22.22 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.231 1.012 . . . . 1.0 110.19 -173.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 70.41 57.14 6.93 Favored Glycine 0 CA--C 1.525 0.712 0 N-CA-C 109.514 -1.434 . . . . 1.0 109.514 -174.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -45.59 125.79 6.29 Favored Pre-proline 0 CA--C 1.536 0.435 0 C-N-CA 124.653 1.181 . . . . 1.0 111.096 -179.632 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -68.82 158.67 56.91 Favored 'Trans proline' 0 N--CA 1.454 -0.794 0 C-N-CA 122.051 1.834 . . . . 1.0 110.049 176.688 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.338 0.086 0 O-C-N 121.849 -0.532 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' CSU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.1 m 63.85 174.32 0.17 Allowed 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.835 1.254 . . . . 1.0 112.037 -173.452 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 34.7 t30 67.2 130.37 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 126.182 1.793 . . . . 1.0 114.003 177.726 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -58.86 -53.17 61.36 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 123.548 0.739 . . . . 1.0 110.726 -177.022 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -58.24 -54.05 51.37 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 118.339 0.518 . . . . 1.0 109.882 -176.557 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 20.9 m -52.88 -53.28 51.35 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.247 0.619 . . . . 1.0 110.703 177.487 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' CSU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 4.0 p -66.26 -42.1 90.29 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.157 0 CA-C-O 119.438 -0.315 . . . . 1.0 110.652 -174.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 77.7 mt -60.08 -46.69 88.74 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-N 118.651 0.66 . . . . 1.0 110.089 175.766 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -52.87 -57.35 14.71 Favored Glycine 0 CA--C 1.527 0.821 0 N-CA-C 110.657 -0.977 . . . . 1.0 110.657 175.513 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 66.2 mttt -49.69 -63.15 1.2 Allowed 'General case' 0 C--O 1.223 -0.326 0 CA-C-O 119.17 -0.443 . . . . 1.0 110.328 175.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 74.4 mt -49.77 -49.15 49.45 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.044 0.538 . . . . 1.0 110.54 -176.019 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 22.9 t -54.97 -58.0 9.41 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 122.986 0.514 . . . . 1.0 111.295 178.651 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -62.7 -45.03 94.67 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 121.377 0.608 . . . . 1.0 110.652 -175.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -63.4 -49.37 74.08 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 125.962 1.705 . . . . 1.0 110.052 -176.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.6 pp -68.19 -34.7 76.77 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 118.776 0.716 . . . . 1.0 111.072 177.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -58.79 -46.01 88.54 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 121.553 -0.717 . . . . 1.0 109.91 172.394 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 18.5 mttt -58.83 -59.23 5.76 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 118.241 0.473 . . . . 1.0 110.027 174.012 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 57.6 tp -49.09 -45.35 43.12 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.326 1.05 . . . . 1.0 110.805 -174.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 34.5 mt-30 -53.31 -57.19 11.41 Favored 'General case' 0 CA--C 1.532 0.281 0 O-C-N 121.894 -0.504 . . . . 1.0 111.341 175.129 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 11.9 t -79.97 -11.92 59.75 Favored 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 113.711 1.004 . . . . 1.0 113.711 -172.673 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 3.7 m-30 -55.32 151.67 18.38 Favored Pre-proline 0 CA--C 1.541 0.617 0 CA-C-N 119.253 0.933 . . . . 1.0 111.014 176.521 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -70.3 78.05 1.22 Allowed 'Trans proline' 0 N--CA 1.458 -0.598 0 C-N-CA 124.026 3.151 . . . . 1.0 111.613 -173.3 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 22.0 ttm105 -71.85 66.67 0.57 Allowed 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 125.985 1.714 . . . . 1.0 110.14 177.406 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 29.1 p -91.78 -78.64 0.4 Allowed 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 124.205 1.002 . . . . 1.0 108.566 178.309 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 44.9 t30 -70.1 82.26 0.51 Allowed 'General case' 0 C--N 1.339 0.123 0 CA-C-O 123.05 1.405 . . . . 1.0 110.929 -174.725 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 1.2 p -90.64 6.47 43.73 Favored 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 126.291 1.836 . . . . 1.0 110.514 171.284 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -82.03 55.6 4.92 Favored Glycine 0 CA--C 1.531 1.046 0 N-CA-C 111.088 -0.805 . . . . 1.0 111.088 -171.253 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.4 t 59.07 25.94 14.51 Favored 'General case' 0 C--O 1.247 0.959 0 C-N-CA 123.913 0.885 . . . . 1.0 111.304 -179.438 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -84.29 85.27 1.56 Allowed Glycine 0 C--N 1.352 1.434 0 CA-C-O 118.944 -0.92 . . . . 1.0 110.871 -172.629 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 7.3 m 98.22 134.23 0.02 OUTLIER Pre-proline 0 N--CA 1.468 0.473 0 C-N-CA 127.85 2.46 . . . . 1.0 109.002 179.395 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo -63.43 143.22 87.88 Favored 'Trans proline' 0 N--CA 1.46 -0.462 0 C-N-CA 121.803 1.668 . . . . 1.0 110.152 174.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.338 0.071 0 O-C-N 121.835 -0.54 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' CSU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.8 p -78.65 42.17 0.43 Allowed 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.404 1.482 . . . . 1.0 111.566 -173.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 26.7 m120 -104.06 77.22 1.41 Allowed 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.317 1.047 . . . . 1.0 108.363 -171.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -48.03 -46.27 32.95 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.714 0.806 . . . . 1.0 111.714 -175.177 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.0 m -51.54 -55.74 17.34 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.115 0.966 . . . . 1.0 111.312 175.785 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 5.8 m -58.54 -45.77 88.2 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 123.297 0.639 . . . . 1.0 110.022 178.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' CSU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 9.8 p -64.8 -42.52 95.13 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 O-C-N 121.957 -0.464 . . . . 1.0 110.804 -177.007 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 67.8 mt -58.1 -49.56 76.51 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 118.989 0.813 . . . . 1.0 110.598 176.324 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -56.07 -51.21 57.12 Favored Glycine 0 CA--C 1.527 0.786 0 N-CA-C 110.804 -0.918 . . . . 1.0 110.804 177.248 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 46.1 tttm -54.43 -56.69 16.12 Favored 'General case' 0 C--O 1.222 -0.35 0 C-N-CA 123.02 0.528 . . . . 1.0 109.584 178.37 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 76.5 mt -54.16 -48.08 71.26 Favored 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 123.277 0.631 . . . . 1.0 110.687 -179.523 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 25.0 t -53.23 -53.6 48.37 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.027 0.531 . . . . 1.0 110.374 178.023 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 56.3 mm-40 -54.56 -56.72 16.01 Favored 'General case' 0 CA--C 1.531 0.237 0 O-C-N 122.083 -0.386 . . . . 1.0 110.529 175.109 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -52.31 -56.26 15.97 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 125.087 1.355 . . . . 1.0 110.509 -174.546 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.3 pp -64.8 -41.56 95.72 Favored 'General case' 0 N--CA 1.455 -0.208 0 O-C-N 122.321 -0.237 . . . . 1.0 110.464 -178.034 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -62.56 -36.48 82.79 Favored 'General case' 0 CA--C 1.532 0.271 0 O-C-N 121.963 -0.461 . . . . 1.0 110.848 179.476 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.08 -62.13 1.73 Allowed 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 108.836 -0.801 . . . . 1.0 108.836 170.77 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 59.0 tp -44.3 -50.81 8.83 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 125.171 1.389 . . . . 1.0 112.396 -176.357 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 14.3 pt20 -64.42 -22.39 66.94 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 112.926 0.713 . . . . 1.0 112.926 -177.506 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 82.4 p -97.1 -22.94 16.48 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 123.843 0.857 . . . . 1.0 111.964 176.448 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 8.5 m-30 -59.18 155.78 32.4 Favored Pre-proline 0 CA--C 1.535 0.389 0 C-N-CA 123.004 0.522 . . . . 1.0 110.358 175.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -67.14 -179.05 1.6 Allowed 'Trans proline' 0 N--CA 1.452 -0.927 0 C-N-CA 122.535 2.156 . . . . 1.0 110.905 177.007 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -55.2 78.2 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 126.283 1.833 . . . . 1.0 112.357 178.328 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 96.1 m -69.65 -55.8 9.02 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 124.936 1.295 . . . . 1.0 109.678 -173.061 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.9 t30 -155.26 63.14 0.62 Allowed 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 122.181 0.991 . . . . 1.0 108.783 172.068 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 2.6 m -69.37 82.33 0.38 Allowed 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 124.079 0.951 . . . . 1.0 110.502 -176.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 81.13 -45.53 3.22 Favored Glycine 0 CA--C 1.529 0.934 0 O-C-N 121.605 -0.684 . . . . 1.0 112.255 173.236 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 22.6 p 54.14 59.76 4.02 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.68 1.192 . . . . 1.0 111.506 176.786 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -157.91 -98.59 0.14 Allowed Glycine 0 CA--C 1.526 0.727 0 N-CA-C 110.063 -1.215 . . . . 1.0 110.063 176.004 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.9 t -163.25 152.5 12.54 Favored Pre-proline 0 N--CA 1.454 -0.242 0 N-CA-C 107.089 -1.449 . . . . 1.0 107.089 -178.162 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 77.7 Cg_endo -63.82 163.7 24.07 Favored 'Trans proline' 0 N--CA 1.453 -0.892 0 C-N-CA 121.153 1.236 . . . . 1.0 109.065 160.369 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.338 0.07 0 O-C-N 121.834 -0.541 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' CSU . . . . . 0.439 ' C ' ' H ' ' A' ' 3' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.1 t -74.81 34.0 0.1 Allowed 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.89 0.876 . . . . 1.0 111.922 179.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.439 ' H ' ' C ' ' A' ' 1' ' ' CSU . 20.8 m120 -85.71 71.25 10.72 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 107.624 -1.25 . . . . 1.0 107.624 -172.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -47.43 -42.1 21.64 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.118 0.967 . . . . 1.0 112.506 -171.367 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 33.5 t -54.81 -53.53 54.08 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.069 0.548 . . . . 1.0 111.044 175.069 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.6 m -57.3 -47.29 81.88 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 122.983 0.513 . . . . 1.0 109.947 176.452 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' CSU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 6.3 p -64.6 -39.61 86.19 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 CA-C-O 119.241 -0.409 . . . . 1.0 110.92 -177.011 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 57.2 mt -58.47 -48.5 80.54 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 118.983 0.81 . . . . 1.0 110.644 174.338 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -54.77 -54.73 31.4 Favored Glycine 0 CA--C 1.528 0.884 0 N-CA-C 110.597 -1.001 . . . . 1.0 110.597 177.183 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 19.9 tttp -47.77 -62.66 1.34 Allowed 'General case' 0 C--O 1.223 -0.34 0 C-N-CA 123.577 0.751 . . . . 1.0 109.697 174.09 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 63.6 mt -52.29 -48.17 65.5 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 123.073 0.549 . . . . 1.0 110.759 -176.099 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 23.0 t -53.47 -59.74 4.19 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 117.959 0.345 . . . . 1.0 110.661 178.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 94.1 mt-30 -61.72 -51.94 66.33 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-O 121.001 0.429 . . . . 1.0 110.669 -176.359 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -55.55 -55.86 26.96 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 127.112 2.165 . . . . 1.0 110.69 -177.117 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 86.7 mt -63.55 -43.6 96.59 Favored 'General case' 0 N--CA 1.455 -0.177 0 O-C-N 121.934 -0.479 . . . . 1.0 110.132 179.451 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 37.7 t60 -57.97 -41.85 83.8 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 122.065 -0.397 . . . . 1.0 111.226 177.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 59.6 tttm -65.82 -44.96 84.04 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 123.779 0.832 . . . . 1.0 109.918 176.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 63.2 tp -56.24 -53.74 53.65 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 123.822 0.849 . . . . 1.0 110.625 179.691 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 -57.11 -33.48 67.37 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 118.407 0.549 . . . . 1.0 112.047 -178.159 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 15.7 p -80.02 -14.35 58.63 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 113.165 0.802 . . . . 1.0 113.165 177.642 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -70.8 152.84 95.07 Favored Pre-proline 0 CA--C 1.536 0.415 0 CA-C-N 119.409 1.004 . . . . 1.0 111.127 -175.117 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -67.6 88.88 0.34 Allowed 'Trans proline' 0 N--CA 1.453 -0.896 0 C-N-CA 122.83 2.353 . . . . 1.0 109.778 175.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -36.4 -44.75 0.44 Allowed 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 126.768 2.027 . . . . 1.0 112.614 179.03 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 2.4 p -55.08 -28.25 51.08 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 126.602 1.961 . . . . 1.0 113.628 -177.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 33.4 t30 -43.26 101.8 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 125.68 1.592 . . . . 1.0 113.33 -173.568 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . 0.258 0.4 OUTLIER 69.77 -57.99 0.54 Allowed 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 126.846 2.058 . . . . 1.0 112.899 172.442 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -77.86 59.52 3.84 Favored Glycine 0 CA--C 1.524 0.636 0 N-CA-C 110.895 -0.882 . . . . 1.0 110.895 -177.178 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 11.5 p -60.19 -67.58 0.38 Allowed 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 108.397 -0.964 . . . . 1.0 108.397 175.437 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 165.95 76.9 0.03 OUTLIER Glycine 0 CA--C 1.528 0.846 0 C-N-CA 127.466 2.46 . . . . 1.0 107.493 -178.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 9.3 t -155.4 146.3 16.4 Favored Pre-proline 0 CA--C 1.532 0.287 0 N-CA-C 107.868 -1.16 . . . . 1.0 107.868 -171.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -65.7 81.62 0.24 Allowed 'Trans proline' 0 N--CA 1.454 -0.801 0 C-N-CA 122.276 1.984 . . . . 1.0 109.558 178.349 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.338 0.071 0 O-C-N 121.844 -0.535 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.0 mm? . . . . . 0 C--O 1.226 -0.162 0 N-CA-C 111.586 0.217 . . . . 1.0 111.586 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 32.8 t -53.53 -59.23 4.86 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 122.953 0.501 . . . . 1.0 110.207 176.517 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 3.0 m . . . . . 0 N--CA 1.451 -0.414 0 C-N-CA 123.369 0.668 . . . . 1.0 110.677 178.636 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 5.6 p . . . . . 0 CA--C 1.53 0.203 0 CA-C-O 119.597 -0.239 . . . . 1.0 110.567 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 72.6 mt -58.43 -48.6 80.18 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 118.454 0.57 . . . . 1.0 110.18 174.884 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -53.37 -54.25 30.77 Favored Glycine 0 CA--C 1.525 0.71 0 N-CA-C 110.746 -0.942 . . . . 1.0 110.746 176.74 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 52.7 mttt -51.09 -66.81 0.32 Allowed 'General case' 0 C--O 1.222 -0.364 0 CA-C-O 118.896 -0.574 . . . . 1.0 110.006 174.514 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 84.0 mt -48.83 -48.98 41.28 Favored 'General case' 0 N--CA 1.456 -0.148 0 CA-C-N 118.472 0.578 . . . . 1.0 110.669 -174.334 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 23.1 t -51.81 -62.14 1.81 Allowed 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 122.797 0.439 . . . . 1.0 111.014 176.587 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 71.3 mt-30 -63.0 -52.88 61.23 Favored 'General case' 0 C--O 1.226 -0.175 0 O-C-N 121.75 -0.594 . . . . 1.0 111.076 -175.512 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -56.43 -53.11 61.29 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 127.518 2.327 . . . . 1.0 110.447 -175.436 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 84.8 mt -65.51 -39.14 91.49 Favored 'General case' 0 CA--C 1.532 0.253 0 O-C-N 121.56 -0.713 . . . . 1.0 110.439 177.808 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 5.3 t60 -61.7 -39.33 91.08 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 120.71 -1.244 . . . . 1.0 111.103 175.204 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 61.2 mttm -63.01 -46.76 86.11 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 123.038 0.535 . . . . 1.0 110.107 176.516 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 28.7 tp . . . . . 0 CA--C 1.533 0.289 0 C-N-CA 123.556 0.742 . . . . 1.0 110.804 173.029 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.0 mm? . . . . . 0 CA--C 1.531 0.219 0 N-CA-C 112.366 0.506 . . . . 1.0 112.366 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.1 m -51.72 -55.73 17.92 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.511 0.724 . . . . 1.0 111.319 177.425 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 4.0 m . . . . . 0 N--CA 1.45 -0.43 0 C-N-CA 123.476 0.71 . . . . 1.0 110.376 179.46 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 9.2 p . . . . . 0 N--CA 1.455 -0.2 0 CA-C-O 119.45 -0.309 . . . . 1.0 110.584 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 73.3 mt -58.09 -47.8 82.13 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 118.621 0.646 . . . . 1.0 110.444 175.083 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -52.96 -57.44 14.61 Favored Glycine 0 CA--C 1.524 0.604 0 N-CA-C 110.418 -1.073 . . . . 1.0 110.418 177.446 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 7.7 mtpm? -49.31 -68.67 0.16 Allowed 'General case' 0 C--O 1.221 -0.416 0 N-CA-C 109.055 -0.72 . . . . 1.0 109.055 174.005 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 77.2 mt -44.22 -51.24 8.39 Favored 'General case' 0 C--O 1.225 -0.199 0 C-N-CA 123.605 0.762 . . . . 1.0 111.265 -174.036 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 30.8 t -53.03 -59.65 4.28 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.605 0.762 . . . . 1.0 111.292 177.055 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 86.2 mt-30 -59.04 -42.45 90.29 Favored 'General case' 0 CA--C 1.533 0.301 0 O-C-N 121.814 -0.554 . . . . 1.0 111.032 -177.615 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.29 -50.88 50.61 Favored 'General case' 0 N--CA 1.453 -0.325 0 C-N-CA 126.458 1.903 . . . . 1.0 109.702 -173.047 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.7 pp -66.23 -35.72 81.17 Favored 'General case' 0 C--O 1.234 0.277 0 O-C-N 121.681 -0.637 . . . . 1.0 110.925 177.483 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 11.0 t-80 -58.35 -47.13 84.77 Favored 'General case' 0 CA--C 1.535 0.385 0 O-C-N 122.143 -0.348 . . . . 1.0 110.243 170.632 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 9.1 mttt -58.89 -55.17 38.64 Favored 'General case' 0 C--O 1.225 -0.22 0 N-CA-C 109.8 -0.445 . . . . 1.0 109.8 176.221 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 61.3 tp . . . . . 0 N--CA 1.455 -0.177 0 C-N-CA 124.591 1.156 . . . . 1.0 110.786 -176.798 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.9 mm? . . . . . 0 C--O 1.226 -0.164 0 CA-C-O 119.47 -0.3 . . . . 1.0 111.098 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.2 m -51.22 -57.58 8.44 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 124.087 0.955 . . . . 1.0 111.247 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 3.8 m . . . . . 0 N--CA 1.453 -0.293 0 C-N-CA 123.426 0.69 . . . . 1.0 110.237 179.944 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 5.1 p . . . . . 0 N--CA 1.454 -0.251 0 CA-C-O 119.138 -0.458 . . . . 1.0 110.541 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 65.9 mt -57.83 -50.85 71.89 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 118.871 0.76 . . . . 1.0 110.408 174.553 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -52.2 -56.19 18.16 Favored Glycine 0 CA--C 1.525 0.695 0 N-CA-C 110.816 -0.914 . . . . 1.0 110.816 177.857 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.445 ' NZ ' ' OE1' ' A' ' 15' ' ' GLU . 7.9 mtpm? -54.06 -63.79 1.04 Allowed 'General case' 0 C--O 1.217 -0.632 0 CA-C-O 117.829 -1.081 . . . . 1.0 110.217 176.744 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 77.5 mt -45.44 -49.9 13.0 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 119.815 1.188 . . . . 1.0 111.19 -177.599 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 29.4 t -54.53 -58.84 5.91 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 122.988 0.515 . . . . 1.0 110.972 177.974 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -59.39 -51.9 67.92 Favored 'General case' 0 CA--C 1.535 0.378 0 O-C-N 121.405 -0.809 . . . . 1.0 110.806 -178.403 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.445 ' OE1' ' NZ ' ' A' ' 11' ' ' LYS . 3.4 tp10 -53.32 -53.63 48.22 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 127.25 2.22 . . . . 1.0 110.434 -177.123 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.7 pp -64.84 -40.61 95.44 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 118.377 0.535 . . . . 1.0 110.692 177.866 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -65.29 -34.93 79.5 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-O 118.571 -0.728 . . . . 1.0 111.738 -177.086 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.64 -39.66 24.08 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 118.977 0.808 . . . . 1.0 111.023 174.443 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 58.4 tp . . . . . 0 C--N 1.339 0.15 0 C-N-CA 123.442 0.697 . . . . 1.0 110.709 176.716 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.9 mm? . . . . . 0 N--CA 1.456 -0.126 0 CA-C-O 119.707 -0.187 . . . . 1.0 111.307 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 32.7 t -55.82 -60.32 3.63 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-O 121.369 0.604 . . . . 1.0 110.56 -171.694 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 18.8 m . . . . . 0 N--CA 1.451 -0.404 0 O-C-N 121.912 -0.493 . . . . 1.0 110.1 -177.674 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 9.8 p . . . . . 0 CA--C 1.53 0.188 0 CA-C-O 119.668 -0.205 . . . . 1.0 110.835 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 72.5 mt -56.6 -49.85 73.72 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 118.143 0.429 . . . . 1.0 110.112 175.675 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -54.9 -51.77 51.11 Favored Glycine 0 CA--C 1.529 0.919 0 N-CA-C 111.014 -0.834 . . . . 1.0 111.014 176.538 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.22 -58.05 8.84 Favored 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 123.91 0.884 . . . . 1.0 109.216 -179.494 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 80.8 mt -55.38 -50.2 70.32 Favored 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 123.076 0.551 . . . . 1.0 110.147 -178.847 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 22.9 t -52.71 -56.6 14.41 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 122.858 0.463 . . . . 1.0 110.239 179.48 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 27.6 mm-40 -56.25 -55.55 31.9 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 122.954 0.502 . . . . 1.0 110.498 179.596 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -56.28 -53.56 55.79 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.297 1.039 . . . . 1.0 110.491 -174.286 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 80.5 mt -62.07 -46.76 87.69 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 122.825 0.45 . . . . 1.0 110.552 178.115 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 4.4 t-80 -57.09 -33.58 67.45 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-O 118.992 -0.527 . . . . 1.0 111.012 178.231 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 78.5 tttt -78.02 -45.55 23.38 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 123.501 0.721 . . . . 1.0 110.153 177.7 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 60.8 tp . . . . . 0 CA--C 1.529 0.151 0 C-N-CA 126.08 1.752 . . . . 1.0 111.432 -174.665 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.8 mm? . . . . . 0 N--CA 1.453 -0.317 0 CA-C-O 118.521 -0.752 . . . . 1.0 111.3 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.96 -55.03 40.39 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 119.42 1.009 . . . . 1.0 109.569 -177.449 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.0 m . . . . . 0 N--CA 1.449 -0.484 0 C-N-CA 123.879 0.872 . . . . 1.0 109.906 179.124 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 4.3 p . . . . . 0 N--CA 1.456 -0.165 0 CA-C-O 119.623 -0.227 . . . . 1.0 110.75 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 82.2 mt -60.15 -47.18 86.99 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 118.589 0.631 . . . . 1.0 109.862 175.078 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -52.98 -50.4 51.25 Favored Glycine 0 CA--C 1.526 0.736 0 N-CA-C 111.022 -0.831 . . . . 1.0 111.022 176.417 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 66.7 mttt -55.48 -69.05 0.15 Allowed 'General case' 0 C--O 1.223 -0.312 0 CA-C-O 118.874 -0.584 . . . . 1.0 109.515 172.819 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 75.2 mt -45.25 -48.53 12.76 Favored 'General case' 0 C--O 1.226 -0.17 0 C-N-CA 124.153 0.981 . . . . 1.0 111.42 -172.521 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 23.0 t -53.12 -58.42 7.06 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.07 0.548 . . . . 1.0 111.11 177.353 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -62.83 -46.04 89.81 Favored 'General case' 0 CA--C 1.528 0.134 0 O-C-N 121.655 -0.653 . . . . 1.0 110.681 -177.587 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -62.81 -52.31 63.67 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 126.875 2.07 . . . . 1.0 109.64 -173.389 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.9 pp -64.43 -39.72 94.38 Favored 'General case' 0 N--CA 1.456 -0.148 0 O-C-N 121.726 -0.609 . . . . 1.0 110.242 175.97 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 63.2 t60 -61.15 -40.68 94.76 Favored 'General case' 0 CA--C 1.534 0.332 0 O-C-N 121.905 -0.497 . . . . 1.0 111.298 178.363 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 59.6 mttm -61.54 -52.89 62.58 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.24 -0.652 . . . . 1.0 109.24 171.892 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 56.6 tp . . . . . 0 CA--C 1.533 0.301 0 C-N-CA 123.144 0.577 . . . . 1.0 111.379 -178.523 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.0 mm? . . . . . 0 C--O 1.227 -0.085 0 N-CA-C 111.962 0.356 . . . . 1.0 111.962 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 23.0 t -56.99 -59.29 5.28 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 109.842 -0.429 . . . . 1.0 109.842 -179.843 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 4.2 m . . . . . 0 N--CA 1.449 -0.512 0 C-N-CA 124.034 0.933 . . . . 1.0 110.819 177.608 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 4.6 p . . . . . 0 N--CA 1.453 -0.284 0 CA-C-O 119.586 -0.245 . . . . 1.0 110.428 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 65.0 mt -56.52 -50.42 71.87 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 118.582 0.628 . . . . 1.0 110.145 174.734 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -57.61 -45.61 93.03 Favored Glycine 0 CA--C 1.528 0.882 0 C-N-CA 124.238 0.923 . . . . 1.0 112.179 179.702 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.7 ptmm? -64.12 -54.59 31.56 Favored 'General case' 0 C--O 1.223 -0.322 0 N-CA-C 108.87 -0.789 . . . . 1.0 108.87 177.207 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 68.2 mt -52.14 -48.97 64.6 Favored 'General case' 0 C--O 1.227 -0.105 0 C-N-CA 123.131 0.573 . . . . 1.0 110.613 -175.982 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 23.2 t -51.86 -56.44 13.99 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 121.227 0.537 . . . . 1.0 111.078 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -65.69 -48.06 73.32 Favored 'General case' 0 CA--C 1.531 0.227 0 O-C-N 121.716 -0.615 . . . . 1.0 110.57 -177.339 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -55.16 -55.58 29.54 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 127.089 2.156 . . . . 1.0 110.319 -177.054 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.7 pp -62.53 -42.2 99.37 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 118.562 0.619 . . . . 1.0 110.326 178.72 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -57.54 -38.7 75.15 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-O 118.85 -0.595 . . . . 1.0 110.676 177.442 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 14.2 mttt -66.97 -54.8 18.35 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 118.373 0.533 . . . . 1.0 110.051 173.342 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 58.3 tp . . . . . 0 C--O 1.232 0.15 0 C-N-CA 126.069 1.748 . . . . 1.0 111.787 -171.759 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.9 mm? . . . . . 0 CA--C 1.529 0.158 0 N-CA-C 112.319 0.489 . . . . 1.0 112.319 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 30.1 t -54.51 -60.82 2.84 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 120.933 0.397 . . . . 1.0 110.497 177.598 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 3.8 m . . . . . 0 N--CA 1.45 -0.428 0 C-N-CA 123.713 0.805 . . . . 1.0 110.788 179.054 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 4.1 p . . . . . 0 N--CA 1.455 -0.21 0 CA-C-O 119.538 -0.268 . . . . 1.0 110.436 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 75.0 mt -59.09 -49.34 78.26 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 118.389 0.541 . . . . 1.0 110.155 175.19 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -52.85 -55.13 25.0 Favored Glycine 0 CA--C 1.526 0.723 0 N-CA-C 110.615 -0.994 . . . . 1.0 110.615 176.867 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 24.3 mttt -50.05 -67.74 0.23 Allowed 'General case' 0 C--O 1.222 -0.39 0 CA-C-O 118.948 -0.548 . . . . 1.0 110.104 174.534 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 81.0 mt -48.45 -48.82 37.29 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 118.304 0.502 . . . . 1.0 110.539 -174.142 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 29.1 t -51.11 -63.24 1.19 Allowed 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 122.791 0.437 . . . . 1.0 111.023 176.304 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 66.9 mt-30 -64.12 -50.64 67.44 Favored 'General case' 0 CA--C 1.532 0.279 0 O-C-N 121.589 -0.694 . . . . 1.0 111.15 -174.486 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 15.2 tt0 -56.61 -52.62 64.16 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 127.191 2.196 . . . . 1.0 109.786 -176.052 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 83.5 mt -65.2 -43.42 91.67 Favored 'General case' 0 CA--C 1.532 0.267 0 O-C-N 121.586 -0.696 . . . . 1.0 110.746 176.678 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -56.64 -40.19 75.01 Favored 'General case' 0 C--N 1.341 0.198 0 O-C-N 121.853 -0.53 . . . . 1.0 110.733 177.511 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -65.1 -54.14 34.49 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 109.312 -0.625 . . . . 1.0 109.312 174.469 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 62.1 tp . . . . . 0 CA--C 1.529 0.156 0 C-N-CA 124.09 0.956 . . . . 1.0 111.493 -178.085 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.0 mm? . . . . . 0 CA--C 1.53 0.209 0 CA-C-O 119.711 -0.185 . . . . 1.0 110.726 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -58.24 -54.05 51.37 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 118.339 0.518 . . . . 1.0 109.882 -176.557 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 20.9 m . . . . . 0 CA--C 1.532 0.262 0 C-N-CA 123.247 0.619 . . . . 1.0 110.703 177.487 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 4.0 p . . . . . 0 CA--C 1.529 0.157 0 CA-C-O 119.438 -0.315 . . . . 1.0 110.652 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 77.7 mt -60.08 -46.69 88.74 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-N 118.651 0.66 . . . . 1.0 110.089 175.766 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -52.87 -57.35 14.71 Favored Glycine 0 CA--C 1.527 0.821 0 N-CA-C 110.657 -0.977 . . . . 1.0 110.657 175.513 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 66.2 mttt -49.69 -63.15 1.2 Allowed 'General case' 0 C--O 1.223 -0.326 0 CA-C-O 119.17 -0.443 . . . . 1.0 110.328 175.918 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 74.4 mt -49.77 -49.15 49.45 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.044 0.538 . . . . 1.0 110.54 -176.019 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 22.9 t -54.97 -58.0 9.41 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 122.986 0.514 . . . . 1.0 111.295 178.651 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -62.7 -45.03 94.67 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 121.377 0.608 . . . . 1.0 110.652 -175.983 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -63.4 -49.37 74.08 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 125.962 1.705 . . . . 1.0 110.052 -176.593 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.6 pp -68.19 -34.7 76.77 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 118.776 0.716 . . . . 1.0 111.072 177.638 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -58.79 -46.01 88.54 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 121.553 -0.717 . . . . 1.0 109.91 172.394 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 18.5 mttt -58.83 -59.23 5.76 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 118.241 0.473 . . . . 1.0 110.027 174.012 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 57.6 tp . . . . . 0 N--CA 1.453 -0.29 0 C-N-CA 124.326 1.05 . . . . 1.0 110.805 -174.658 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.532 0.284 0 N-CA-C 111.714 0.265 . . . . 1.0 111.714 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.0 m -51.54 -55.74 17.34 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.115 0.966 . . . . 1.0 111.312 175.785 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 5.8 m . . . . . 0 N--CA 1.452 -0.365 0 C-N-CA 123.297 0.639 . . . . 1.0 110.022 178.993 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 9.8 p . . . . . 0 CA--C 1.531 0.22 0 CA-C-O 119.242 -0.408 . . . . 1.0 110.804 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 67.8 mt -58.1 -49.56 76.51 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 118.989 0.813 . . . . 1.0 110.598 176.324 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -56.07 -51.21 57.12 Favored Glycine 0 CA--C 1.527 0.786 0 N-CA-C 110.804 -0.918 . . . . 1.0 110.804 177.248 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 46.1 tttm -54.43 -56.69 16.12 Favored 'General case' 0 C--O 1.222 -0.35 0 C-N-CA 123.02 0.528 . . . . 1.0 109.584 178.37 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 76.5 mt -54.16 -48.08 71.26 Favored 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 123.277 0.631 . . . . 1.0 110.687 -179.523 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 25.0 t -53.23 -53.6 48.37 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.027 0.531 . . . . 1.0 110.374 178.023 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 56.3 mm-40 -54.56 -56.72 16.01 Favored 'General case' 0 CA--C 1.531 0.237 0 O-C-N 122.083 -0.386 . . . . 1.0 110.529 175.109 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -52.31 -56.26 15.97 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 125.087 1.355 . . . . 1.0 110.509 -174.546 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.3 pp -64.8 -41.56 95.72 Favored 'General case' 0 N--CA 1.455 -0.208 0 O-C-N 122.321 -0.237 . . . . 1.0 110.464 -178.034 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -62.56 -36.48 82.79 Favored 'General case' 0 CA--C 1.532 0.271 0 O-C-N 121.963 -0.461 . . . . 1.0 110.848 179.476 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.08 -62.13 1.73 Allowed 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 108.836 -0.801 . . . . 1.0 108.836 170.77 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 59.0 tp . . . . . 0 CA--C 1.532 0.265 0 C-N-CA 125.171 1.389 . . . . 1.0 112.396 -176.357 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.534 0.357 0 N-CA-C 112.506 0.558 . . . . 1.0 112.506 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 33.5 t -54.81 -53.53 54.08 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.069 0.548 . . . . 1.0 111.044 175.069 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.6 m . . . . . 0 CA--C 1.529 0.156 0 C-N-CA 122.983 0.513 . . . . 1.0 109.947 176.452 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 6.3 p . . . . . 0 CA--C 1.531 0.241 0 CA-C-O 119.241 -0.409 . . . . 1.0 110.92 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 57.2 mt -58.47 -48.5 80.54 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 118.983 0.81 . . . . 1.0 110.644 174.338 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -54.77 -54.73 31.4 Favored Glycine 0 CA--C 1.528 0.884 0 N-CA-C 110.597 -1.001 . . . . 1.0 110.597 177.183 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 19.9 tttp -47.77 -62.66 1.34 Allowed 'General case' 0 C--O 1.223 -0.34 0 C-N-CA 123.577 0.751 . . . . 1.0 109.697 174.09 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 63.6 mt -52.29 -48.17 65.5 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 123.073 0.549 . . . . 1.0 110.759 -176.099 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 23.0 t -53.47 -59.74 4.19 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 117.959 0.345 . . . . 1.0 110.661 178.677 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 94.1 mt-30 -61.72 -51.94 66.33 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-O 121.001 0.429 . . . . 1.0 110.669 -176.359 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -55.55 -55.86 26.96 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 127.112 2.165 . . . . 1.0 110.69 -177.117 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 86.7 mt -63.55 -43.6 96.59 Favored 'General case' 0 N--CA 1.455 -0.177 0 O-C-N 121.934 -0.479 . . . . 1.0 110.132 179.451 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 37.7 t60 -57.97 -41.85 83.8 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 122.065 -0.397 . . . . 1.0 111.226 177.456 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 59.6 tttm -65.82 -44.96 84.04 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 123.779 0.832 . . . . 1.0 109.918 176.888 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 63.2 tp . . . . . 0 N--CA 1.455 -0.183 0 C-N-CA 123.822 0.849 . . . . 1.0 110.625 179.691 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' CSU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.5 t -81.07 41.03 0.57 Allowed 'General case' 0 CA--C 1.536 0.41 0 O-C-N 121.668 -0.645 . . . . 1.0 109.971 173.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 35.0 p-10 -111.35 59.63 0.62 Allowed 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 124.925 1.29 . . . . 1.0 109.175 -171.044 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -49.92 -43.82 49.98 Favored 'General case' 0 C--O 1.226 -0.162 0 C-N-CA 124.498 1.119 . . . . 1.0 111.586 -177.176 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 32.8 t -53.53 -59.23 4.86 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 122.953 0.501 . . . . 1.0 110.207 176.517 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 3.0 m -54.46 -46.54 73.34 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 123.369 0.668 . . . . 1.0 110.677 178.636 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' CSU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 5.6 p -66.7 -41.51 88.18 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 O-C-N 122.048 -0.407 . . . . 1.0 110.567 -176.106 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 72.6 mt -58.43 -48.6 80.18 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 118.454 0.57 . . . . 1.0 110.18 174.884 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -53.37 -54.25 30.77 Favored Glycine 0 CA--C 1.525 0.71 0 N-CA-C 110.746 -0.942 . . . . 1.0 110.746 176.74 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 52.7 mttt -51.09 -66.81 0.32 Allowed 'General case' 0 C--O 1.222 -0.364 0 CA-C-O 118.896 -0.574 . . . . 1.0 110.006 174.514 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 84.0 mt -48.83 -48.98 41.28 Favored 'General case' 0 N--CA 1.456 -0.148 0 CA-C-N 118.472 0.578 . . . . 1.0 110.669 -174.334 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 23.1 t -51.81 -62.14 1.81 Allowed 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 122.797 0.439 . . . . 1.0 111.014 176.587 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 71.3 mt-30 -63.0 -52.88 61.23 Favored 'General case' 0 C--O 1.226 -0.175 0 O-C-N 121.75 -0.594 . . . . 1.0 111.076 -175.512 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -56.43 -53.11 61.29 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 127.518 2.327 . . . . 1.0 110.447 -175.436 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 84.8 mt -65.51 -39.14 91.49 Favored 'General case' 0 CA--C 1.532 0.253 0 O-C-N 121.56 -0.713 . . . . 1.0 110.439 177.808 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 5.3 t60 -61.7 -39.33 91.08 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 120.71 -1.244 . . . . 1.0 111.103 175.204 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 61.2 mttm -63.01 -46.76 86.11 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 123.038 0.535 . . . . 1.0 110.107 176.516 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 28.7 tp -45.84 -47.5 15.9 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 123.556 0.742 . . . . 1.0 110.804 173.029 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 -57.21 -45.94 83.36 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 118.184 0.447 . . . . 1.0 111.579 176.411 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 74.5 p -75.84 -25.39 56.2 Favored 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 113.212 0.819 . . . . 1.0 113.212 -174.743 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -55.18 142.55 57.67 Favored Pre-proline 0 CA--C 1.538 0.483 0 CA-C-N 118.645 0.657 . . . . 1.0 110.968 -178.62 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -65.53 -45.06 7.48 Favored 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 122.935 2.424 . . . . 1.0 111.454 -175.074 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -165.51 106.4 0.76 Allowed 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 109.73 -0.47 . . . . 1.0 109.73 176.217 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 17.0 p -79.32 -26.31 42.21 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.768 0.827 . . . . 1.0 110.973 171.175 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -80.78 62.65 4.89 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.868 0.867 . . . . 1.0 109.388 -169.719 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 16.0 p -104.46 0.54 29.01 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.483 1.513 . . . . 1.0 112.119 -174.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -50.68 -45.41 48.04 Favored Glycine 0 CA--C 1.53 0.97 0 C-N-CA 124.002 0.811 . . . . 1.0 112.82 -173.829 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 19.1 p -167.95 -87.66 0.01 OUTLIER 'General case' 0 N--CA 1.456 -0.157 0 N-CA-C 108.463 -0.94 . . . . 1.0 108.463 172.722 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 177.82 131.23 1.5 Allowed Glycine 0 CA--C 1.524 0.639 0 N-CA-C 108.978 -1.649 . . . . 1.0 108.978 179.441 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 13.1 t -65.97 137.82 96.07 Favored Pre-proline 0 CA--C 1.537 0.467 0 N-CA-C 108.945 -0.761 . . . . 1.0 108.945 176.011 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -65.5 86.71 0.21 Allowed 'Trans proline' 0 N--CA 1.454 -0.816 0 C-N-CA 122.165 1.91 . . . . 1.0 109.735 -178.855 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.338 0.087 0 O-C-N 121.866 -0.521 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' CSU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.8 m -147.39 28.15 0.99 Allowed 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 121.927 0.87 . . . . 1.0 109.318 167.169 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 6.3 m120 -89.84 68.48 7.44 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 108.413 -0.958 . . . . 1.0 108.413 -160.712 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -41.27 -51.74 3.53 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.869 1.268 . . . . 1.0 112.366 -175.543 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.1 m -51.72 -55.73 17.92 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.511 0.724 . . . . 1.0 111.319 177.425 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 4.0 m -58.69 -44.65 90.35 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 123.476 0.71 . . . . 1.0 110.376 179.46 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' CSU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 9.2 p -64.68 -43.45 96.61 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.2 0 O-C-N 122.016 -0.428 . . . . 1.0 110.584 -176.363 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 73.3 mt -58.09 -47.8 82.13 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 118.621 0.646 . . . . 1.0 110.444 175.083 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -52.96 -57.44 14.61 Favored Glycine 0 CA--C 1.524 0.604 0 N-CA-C 110.418 -1.073 . . . . 1.0 110.418 177.446 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 7.7 mtpm? -49.31 -68.67 0.16 Allowed 'General case' 0 C--O 1.221 -0.416 0 N-CA-C 109.055 -0.72 . . . . 1.0 109.055 174.005 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 77.2 mt -44.22 -51.24 8.39 Favored 'General case' 0 C--O 1.225 -0.199 0 C-N-CA 123.605 0.762 . . . . 1.0 111.265 -174.036 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 30.8 t -53.03 -59.65 4.28 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.605 0.762 . . . . 1.0 111.292 177.055 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 86.2 mt-30 -59.04 -42.45 90.29 Favored 'General case' 0 CA--C 1.533 0.301 0 O-C-N 121.814 -0.554 . . . . 1.0 111.032 -177.615 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.29 -50.88 50.61 Favored 'General case' 0 N--CA 1.453 -0.325 0 C-N-CA 126.458 1.903 . . . . 1.0 109.702 -173.047 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.7 pp -66.23 -35.72 81.17 Favored 'General case' 0 C--O 1.234 0.277 0 O-C-N 121.681 -0.637 . . . . 1.0 110.925 177.483 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 11.0 t-80 -58.35 -47.13 84.77 Favored 'General case' 0 CA--C 1.535 0.385 0 O-C-N 122.143 -0.348 . . . . 1.0 110.243 170.632 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 9.1 mttt -58.89 -55.17 38.64 Favored 'General case' 0 C--O 1.225 -0.22 0 N-CA-C 109.8 -0.445 . . . . 1.0 109.8 176.221 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 61.3 tp -48.56 -54.68 13.55 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 124.591 1.156 . . . . 1.0 110.786 -176.798 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -67.74 -7.1 24.54 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 113.32 0.859 . . . . 1.0 113.32 -177.493 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 36.6 p -116.07 10.21 14.98 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.038 0.935 . . . . 1.0 111.92 172.848 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 2.9 m-30 -86.4 150.41 51.51 Favored Pre-proline 0 CA--C 1.533 0.292 0 CA-C-N 119.132 0.878 . . . . 1.0 109.787 174.754 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_endo -65.78 147.08 85.14 Favored 'Trans proline' 0 N--CA 1.453 -0.899 0 C-N-CA 122.501 2.134 . . . . 1.0 109.645 171.833 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 21.1 tpt180 -78.52 62.94 3.23 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.385 0.674 . . . . 1.0 110.516 -174.372 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 19.4 p -69.21 -50.94 42.77 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 124.241 1.016 . . . . 1.0 110.51 -179.727 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -71.31 76.18 0.73 Allowed 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 125.095 1.358 . . . . 1.0 110.37 -167.165 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 13.5 p -119.63 60.97 0.84 Allowed 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 126.087 1.755 . . . . 1.0 108.96 -175.54 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -47.74 -42.95 21.92 Favored Glycine 0 CA--C 1.532 1.114 0 C-N-CA 124.316 0.96 . . . . 1.0 113.23 -174.901 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 14.9 m 54.93 47.32 22.47 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.805 0.842 . . . . 1.0 112.471 174.696 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -66.91 168.97 35.78 Favored Glycine 0 CA--C 1.531 1.038 0 N-CA-C 110.644 -0.982 . . . . 1.0 110.644 171.806 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 1.2 p -98.47 90.35 1.0 Allowed Pre-proline 0 CA--C 1.539 0.536 0 C-N-CA 125.584 1.553 . . . . 1.0 110.449 -176.765 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -63.87 143.97 87.15 Favored 'Trans proline' 0 N--CA 1.457 -0.67 0 C-N-CA 121.378 1.385 . . . . 1.0 110.313 175.06 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.338 0.074 0 O-C-N 121.848 -0.532 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' CSU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.8 t -150.32 40.78 0.79 Allowed 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 108.346 -0.983 . . . . 1.0 108.346 177.857 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 20.4 m120 -147.17 83.61 1.57 Allowed 'General case' 0 N--CA 1.456 -0.138 0 N-CA-C 108.366 -0.976 . . . . 1.0 108.366 -169.747 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -46.5 -52.73 12.66 Favored 'General case' 0 C--O 1.226 -0.164 0 C-N-CA 123.975 0.91 . . . . 1.0 111.098 -177.928 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.2 m -51.22 -57.58 8.44 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 124.087 0.955 . . . . 1.0 111.247 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 3.8 m -57.24 -48.25 79.31 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 123.426 0.69 . . . . 1.0 110.237 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' CSU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 5.1 p -65.6 -41.85 91.59 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.251 0 CA-C-O 119.138 -0.458 . . . . 1.0 110.541 -175.969 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 65.9 mt -57.83 -50.85 71.89 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 118.871 0.76 . . . . 1.0 110.408 174.553 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -52.2 -56.19 18.16 Favored Glycine 0 CA--C 1.525 0.695 0 N-CA-C 110.816 -0.914 . . . . 1.0 110.816 177.857 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.445 ' NZ ' ' OE1' ' A' ' 15' ' ' GLU . 7.9 mtpm? -54.06 -63.79 1.04 Allowed 'General case' 0 C--O 1.217 -0.632 0 CA-C-O 117.829 -1.081 . . . . 1.0 110.217 176.744 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 77.5 mt -45.44 -49.9 13.0 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 119.815 1.188 . . . . 1.0 111.19 -177.599 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 29.4 t -54.53 -58.84 5.91 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 122.988 0.515 . . . . 1.0 110.972 177.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -59.39 -51.9 67.92 Favored 'General case' 0 CA--C 1.535 0.378 0 O-C-N 121.405 -0.809 . . . . 1.0 110.806 -178.403 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.445 ' OE1' ' NZ ' ' A' ' 11' ' ' LYS . 3.4 tp10 -53.32 -53.63 48.22 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 127.25 2.22 . . . . 1.0 110.434 -177.123 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.7 pp -64.84 -40.61 95.44 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 118.377 0.535 . . . . 1.0 110.692 177.866 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -65.29 -34.93 79.5 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-O 118.571 -0.728 . . . . 1.0 111.738 -177.086 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.64 -39.66 24.08 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 118.977 0.808 . . . . 1.0 111.023 174.443 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 58.4 tp -50.77 -52.35 41.64 Favored 'General case' 0 C--N 1.339 0.15 0 C-N-CA 123.442 0.697 . . . . 1.0 110.709 176.716 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -56.34 -23.97 40.89 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 113.003 0.742 . . . . 1.0 113.003 -179.175 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 10.5 p -98.23 -2.75 38.96 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 123.596 0.758 . . . . 1.0 113.034 177.379 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 10.3 m-30 -65.96 150.3 96.7 Favored Pre-proline 0 CA--C 1.537 0.465 0 CA-C-N 119.641 1.109 . . . . 1.0 110.459 178.251 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_endo -63.38 126.47 17.79 Favored 'Trans proline' 0 N--CA 1.454 -0.818 0 C-N-CA 122.882 2.388 . . . . 1.0 110.443 179.436 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 9.8 tpt180 -76.46 80.99 3.17 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 122.983 0.513 . . . . 1.0 110.589 -173.462 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 7.9 p -49.61 -38.13 30.58 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.478 1.111 . . . . 1.0 112.216 172.877 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -70.08 66.54 0.27 Allowed 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.501 1.12 . . . . 1.0 112.116 -179.612 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 6.2 m -74.9 59.91 0.93 Allowed 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.518 1.127 . . . . 1.0 109.003 169.182 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 158.98 65.44 0.01 OUTLIER Glycine 0 CA--C 1.525 0.692 0 N-CA-C 109.76 -1.336 . . . . 1.0 109.76 -171.779 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 61.3 m -154.3 -57.87 0.11 Allowed 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 123.842 0.857 . . . . 1.0 108.697 173.552 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 66.63 -80.65 0.12 Allowed Glycine 0 CA--C 1.527 0.831 0 N-CA-C 111.599 -0.6 . . . . 1.0 111.599 176.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 40.6 p -114.08 76.54 3.48 Favored Pre-proline 0 CA--C 1.534 0.365 0 C-N-CA 126.063 1.745 . . . . 1.0 108.673 -178.617 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -65.95 144.32 76.05 Favored 'Trans proline' 0 N--CA 1.454 -0.799 0 C-N-CA 121.898 1.732 . . . . 1.0 110.084 178.018 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.338 0.082 0 O-C-N 121.843 -0.535 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' CSU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 29.8 p -76.6 63.75 2.13 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.607 1.163 . . . . 1.0 110.607 -175.732 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 41.3 t-20 -167.13 99.89 0.53 Allowed 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.581 0.752 . . . . 1.0 110.193 -176.134 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -57.42 -55.58 32.91 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 123.649 0.78 . . . . 1.0 111.307 179.69 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 32.7 t -55.82 -60.32 3.63 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-O 121.369 0.604 . . . . 1.0 110.56 -171.694 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 18.8 m -60.84 -40.47 92.95 Favored 'General case' 0 N--CA 1.451 -0.404 0 O-C-N 121.912 -0.493 . . . . 1.0 110.1 -177.674 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' CSU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 9.8 p -63.74 -43.16 97.9 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 CA-C-N 118.556 0.616 . . . . 1.0 110.835 -175.117 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 72.5 mt -56.6 -49.85 73.72 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 118.143 0.429 . . . . 1.0 110.112 175.675 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -54.9 -51.77 51.11 Favored Glycine 0 CA--C 1.529 0.919 0 N-CA-C 111.014 -0.834 . . . . 1.0 111.014 176.538 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.22 -58.05 8.84 Favored 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 123.91 0.884 . . . . 1.0 109.216 -179.494 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 80.8 mt -55.38 -50.2 70.32 Favored 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 123.076 0.551 . . . . 1.0 110.147 -178.847 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 22.9 t -52.71 -56.6 14.41 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 122.858 0.463 . . . . 1.0 110.239 179.48 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 27.6 mm-40 -56.25 -55.55 31.9 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 122.954 0.502 . . . . 1.0 110.498 179.596 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -56.28 -53.56 55.79 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.297 1.039 . . . . 1.0 110.491 -174.286 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 80.5 mt -62.07 -46.76 87.69 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 122.825 0.45 . . . . 1.0 110.552 178.115 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 4.4 t-80 -57.09 -33.58 67.45 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-O 118.992 -0.527 . . . . 1.0 111.012 178.231 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 78.5 tttt -78.02 -45.55 23.38 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 123.501 0.721 . . . . 1.0 110.153 177.7 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 60.8 tp -48.27 -52.46 21.15 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 126.08 1.752 . . . . 1.0 111.432 -174.665 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 15.5 pt20 -50.67 -29.64 11.65 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 113.006 0.743 . . . . 1.0 113.006 177.556 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 4.2 p -111.11 16.04 21.29 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.474 1.509 . . . . 1.0 111.585 -178.152 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 3.4 t80 -72.61 152.85 91.66 Favored Pre-proline 0 CA--C 1.535 0.381 0 O-C-N 121.392 -0.818 . . . . 1.0 109.386 -177.811 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -55.37 155.98 18.72 Favored 'Trans proline' 0 N--CA 1.455 -0.763 0 C-N-CA 121.424 1.416 . . . . 1.0 110.152 166.253 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 21.7 ttp85 -78.77 57.56 2.12 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.425 0.69 . . . . 1.0 111.724 -168.013 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 7.9 m -57.12 -56.54 20.4 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 123.835 0.854 . . . . 1.0 109.166 174.94 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -76.39 73.07 3.15 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 109.48 -0.563 . . . . 1.0 109.48 174.628 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 85.0 m -71.0 71.77 0.56 Allowed 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 108.638 -0.875 . . . . 1.0 108.638 167.706 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -71.33 -37.14 63.13 Favored Glycine 0 CA--C 1.529 0.907 0 N-CA-C 110.905 -0.878 . . . . 1.0 110.905 176.66 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 21.8 m 55.55 49.66 16.15 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.127 0.971 . . . . 1.0 111.538 177.477 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -81.96 -152.6 10.3 Favored Glycine 0 CA--C 1.53 0.996 0 N-CA-C 111.36 -0.696 . . . . 1.0 111.36 177.781 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 14.7 t -55.43 138.59 68.03 Favored Pre-proline 0 CA--C 1.54 0.562 0 C-N-CA 123.11 0.564 . . . . 1.0 110.196 178.36 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -65.67 80.7 0.25 Allowed 'Trans proline' 0 N--CA 1.454 -0.805 0 C-N-CA 122.225 1.95 . . . . 1.0 109.648 -179.042 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.338 0.086 0 O-C-N 121.845 -0.535 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' CSU . . . . . 0.865 ' OD3' ' SG ' ' A' ' 7' ' ' CSU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 85.3 p -159.71 52.37 0.35 Allowed 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 110.173 -0.306 . . . . 1.0 110.173 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 29.3 t30 -164.09 130.52 3.11 Favored 'General case' 0 C--O 1.231 0.108 0 C-N-CA 122.447 0.299 . . . . 1.0 110.46 172.477 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -59.32 -45.2 91.98 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 123.948 0.899 . . . . 1.0 111.3 177.487 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.96 -55.03 40.39 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 119.42 1.009 . . . . 1.0 109.569 -177.449 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.0 m -55.67 -48.58 74.8 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 123.879 0.872 . . . . 1.0 109.906 179.124 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' CSU . . . . . 0.865 ' SG ' ' OD3' ' A' ' 1' ' ' CSU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 4.3 p -66.83 -42.83 89.69 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.165 0 O-C-N 121.967 -0.458 . . . . 1.0 110.75 -174.291 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 82.2 mt -60.15 -47.18 86.99 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 118.589 0.631 . . . . 1.0 109.862 175.078 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -52.98 -50.4 51.25 Favored Glycine 0 CA--C 1.526 0.736 0 N-CA-C 111.022 -0.831 . . . . 1.0 111.022 176.417 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 66.7 mttt -55.48 -69.05 0.15 Allowed 'General case' 0 C--O 1.223 -0.312 0 CA-C-O 118.874 -0.584 . . . . 1.0 109.515 172.819 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 75.2 mt -45.25 -48.53 12.76 Favored 'General case' 0 C--O 1.226 -0.17 0 C-N-CA 124.153 0.981 . . . . 1.0 111.42 -172.521 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 23.0 t -53.12 -58.42 7.06 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.07 0.548 . . . . 1.0 111.11 177.353 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -62.83 -46.04 89.81 Favored 'General case' 0 CA--C 1.528 0.134 0 O-C-N 121.655 -0.653 . . . . 1.0 110.681 -177.587 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -62.81 -52.31 63.67 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 126.875 2.07 . . . . 1.0 109.64 -173.389 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.9 pp -64.43 -39.72 94.38 Favored 'General case' 0 N--CA 1.456 -0.148 0 O-C-N 121.726 -0.609 . . . . 1.0 110.242 175.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 63.2 t60 -61.15 -40.68 94.76 Favored 'General case' 0 CA--C 1.534 0.332 0 O-C-N 121.905 -0.497 . . . . 1.0 111.298 178.363 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 59.6 mttm -61.54 -52.89 62.58 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.24 -0.652 . . . . 1.0 109.24 171.892 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 56.6 tp -49.28 -53.86 19.75 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.144 0.577 . . . . 1.0 111.379 -178.523 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -63.85 -11.77 30.35 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 113.174 0.805 . . . . 1.0 113.174 -179.076 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 25.0 p -120.2 22.44 11.38 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.104 0.962 . . . . 1.0 111.199 173.672 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.19 150.96 96.38 Favored Pre-proline 0 CA--C 1.536 0.415 0 O-C-N 121.415 -0.803 . . . . 1.0 111.074 -175.46 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -61.51 144.49 97.95 Favored 'Trans proline' 0 N--CA 1.452 -0.927 0 N-CA-C 108.201 -1.5 . . . . 1.0 108.201 165.689 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 39.1 ttm180 -68.12 75.9 0.23 Allowed 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.002 0.921 . . . . 1.0 111.005 -171.386 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 18.9 m -74.27 -29.3 61.6 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.676 1.191 . . . . 1.0 110.082 -174.523 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 12.1 t-20 61.06 27.4 17.25 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.28 1.032 . . . . 1.0 112.779 172.169 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -62.38 115.49 4.25 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 124.017 0.927 . . . . 1.0 108.632 170.55 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 164.59 -53.21 0.28 Allowed Glycine 0 CA--C 1.522 0.489 0 N-CA-C 108.17 -1.972 . . . . 1.0 108.17 -174.745 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 5.3 m 59.72 32.58 21.51 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 112.884 0.698 . . . . 1.0 112.884 162.369 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 159.67 -77.42 0.18 Allowed Glycine 0 C--N 1.335 0.499 0 N-CA-C 107.087 -2.405 . . . . 1.0 107.087 179.91 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 1.2 p -69.37 159.04 85.15 Favored Pre-proline 0 N--CA 1.449 -0.522 0 N-CA-C 108.499 -0.926 . . . . 1.0 108.499 161.118 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -66.52 149.37 84.38 Favored 'Trans proline' 0 N--CA 1.453 -0.863 0 C-N-CA 122.062 1.841 . . . . 1.0 109.743 171.59 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.338 0.103 0 O-C-N 121.825 -0.547 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' CSU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.7 t -77.25 61.61 2.15 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-O 122.168 0.985 . . . . 1.0 108.806 177.299 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 67.3 m-20 -86.32 56.84 4.17 Favored 'General case' 0 CA--C 1.528 0.131 0 C-N-CA 123.689 0.796 . . . . 1.0 109.422 -165.396 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -54.75 -45.87 74.24 Favored 'General case' 0 C--O 1.227 -0.085 0 C-N-CA 123.677 0.791 . . . . 1.0 111.962 -170.025 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 23.0 t -56.99 -59.29 5.28 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 109.842 -0.429 . . . . 1.0 109.842 -179.843 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 4.2 m -51.21 -49.38 61.16 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 124.034 0.933 . . . . 1.0 110.819 177.608 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' CSU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 4.6 p -65.24 -43.04 95.36 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.284 0 O-C-N 122.115 -0.365 . . . . 1.0 110.428 -175.316 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 65.0 mt -56.52 -50.42 71.87 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 118.582 0.628 . . . . 1.0 110.145 174.734 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -57.61 -45.61 93.03 Favored Glycine 0 CA--C 1.528 0.882 0 C-N-CA 124.238 0.923 . . . . 1.0 112.179 179.702 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.7 ptmm? -64.12 -54.59 31.56 Favored 'General case' 0 C--O 1.223 -0.322 0 N-CA-C 108.87 -0.789 . . . . 1.0 108.87 177.207 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 68.2 mt -52.14 -48.97 64.6 Favored 'General case' 0 C--O 1.227 -0.105 0 C-N-CA 123.131 0.573 . . . . 1.0 110.613 -175.982 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 23.2 t -51.86 -56.44 13.99 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 121.227 0.537 . . . . 1.0 111.078 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -65.69 -48.06 73.32 Favored 'General case' 0 CA--C 1.531 0.227 0 O-C-N 121.716 -0.615 . . . . 1.0 110.57 -177.339 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -55.16 -55.58 29.54 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 127.089 2.156 . . . . 1.0 110.319 -177.054 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.7 pp -62.53 -42.2 99.37 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 118.562 0.619 . . . . 1.0 110.326 178.72 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -57.54 -38.7 75.15 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-O 118.85 -0.595 . . . . 1.0 110.676 177.442 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 14.2 mttt -66.97 -54.8 18.35 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 118.373 0.533 . . . . 1.0 110.051 173.342 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 58.3 tp -51.08 -40.02 57.4 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 126.069 1.748 . . . . 1.0 111.787 -171.759 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 16.9 pt20 -65.99 -54.69 22.97 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 120.893 -0.323 . . . . 1.0 111.03 174.022 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 6.2 p -64.42 -24.94 67.8 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 113.363 0.875 . . . . 1.0 113.363 -176.879 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 2.1 m-30 -54.36 160.65 2.42 Favored Pre-proline 0 CA--C 1.542 0.662 0 C-N-CA 123.832 0.853 . . . . 1.0 112.153 -178.788 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 79.6 Cg_endo -68.46 -174.69 0.72 Allowed 'Trans proline' 0 N--CA 1.454 -0.835 0 C-N-CA 123.469 2.779 . . . . 1.0 110.396 173.086 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -157.52 149.45 22.3 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 107.057 -1.46 . . . . 1.0 107.057 178.55 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 9.1 p -83.65 -61.7 1.77 Allowed 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 124.864 1.265 . . . . 1.0 108.838 -178.38 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 50.4 m-20 113.31 74.74 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 130.261 3.424 . . . . 1.0 108.976 179.462 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 2.9 m -66.84 71.68 0.09 Allowed 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.146 1.378 . . . . 1.0 109.651 173.935 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 74.53 -65.82 2.05 Favored Glycine 0 CA--C 1.529 0.952 0 N-CA-C 110.215 -1.154 . . . . 1.0 110.215 -171.268 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 24.1 p -84.8 -70.68 0.56 Allowed 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 123.936 0.894 . . . . 1.0 110.607 -178.218 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 78.59 34.55 35.07 Favored Glycine 0 CA--C 1.527 0.831 0 N-CA-C 111.373 -0.691 . . . . 1.0 111.373 -171.886 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -61.54 148.32 86.58 Favored Pre-proline 0 N--CA 1.448 -0.569 0 O-C-N 121.868 -0.783 . . . . 1.0 110.048 174.308 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -67.83 153.31 75.98 Favored 'Trans proline' 0 N--CA 1.452 -0.952 0 C-N-CA 122.294 1.996 . . . . 1.0 109.761 174.731 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.338 0.077 0 O-C-N 121.838 -0.539 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' CSU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.5 m -72.29 -40.51 67.49 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.994 0.918 . . . . 1.0 109.439 167.043 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 5.1 m-80 74.65 101.77 0.07 Allowed 'General case' 0 C--N 1.341 0.21 0 C-N-CA 126.305 1.842 . . . . 1.0 109.998 172.655 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -47.54 -45.75 27.1 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 124.033 0.933 . . . . 1.0 112.319 -174.027 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 30.1 t -54.51 -60.82 2.84 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 120.933 0.397 . . . . 1.0 110.497 177.598 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 3.8 m -53.05 -48.41 67.67 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 123.713 0.805 . . . . 1.0 110.788 179.054 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' CSU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 4.1 p -66.89 -41.59 87.84 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.21 0 O-C-N 122.026 -0.421 . . . . 1.0 110.436 -174.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 75.0 mt -59.09 -49.34 78.26 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 118.389 0.541 . . . . 1.0 110.155 175.19 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -52.85 -55.13 25.0 Favored Glycine 0 CA--C 1.526 0.723 0 N-CA-C 110.615 -0.994 . . . . 1.0 110.615 176.867 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 24.3 mttt -50.05 -67.74 0.23 Allowed 'General case' 0 C--O 1.222 -0.39 0 CA-C-O 118.948 -0.548 . . . . 1.0 110.104 174.534 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 81.0 mt -48.45 -48.82 37.29 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 118.304 0.502 . . . . 1.0 110.539 -174.142 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 29.1 t -51.11 -63.24 1.19 Allowed 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 122.791 0.437 . . . . 1.0 111.023 176.304 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 66.9 mt-30 -64.12 -50.64 67.44 Favored 'General case' 0 CA--C 1.532 0.279 0 O-C-N 121.589 -0.694 . . . . 1.0 111.15 -174.486 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 15.2 tt0 -56.61 -52.62 64.16 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 127.191 2.196 . . . . 1.0 109.786 -176.052 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 83.5 mt -65.2 -43.42 91.67 Favored 'General case' 0 CA--C 1.532 0.267 0 O-C-N 121.586 -0.696 . . . . 1.0 110.746 176.678 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -56.64 -40.19 75.01 Favored 'General case' 0 C--N 1.341 0.198 0 O-C-N 121.853 -0.53 . . . . 1.0 110.733 177.511 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -65.1 -54.14 34.49 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 109.312 -0.625 . . . . 1.0 109.312 174.469 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 62.1 tp -46.37 -53.36 11.08 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 124.09 0.956 . . . . 1.0 111.493 -178.085 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 15.5 pt20 -61.5 -24.33 66.52 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 113.026 0.75 . . . . 1.0 113.026 -176.82 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 13.2 p -96.42 1.88 52.1 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.382 0.673 . . . . 1.0 112.294 175.738 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 24.1 t80 -74.31 143.08 79.29 Favored Pre-proline 0 CA--C 1.536 0.425 0 O-C-N 121.359 -0.838 . . . . 1.0 110.684 -170.08 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -65.76 91.03 0.24 Allowed 'Trans proline' 0 N--CA 1.454 -0.803 0 C-N-CA 122.6 2.2 . . . . 1.0 110.64 176.227 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 61.8 ttp180 -66.41 75.95 0.1 Allowed 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 125.284 1.434 . . . . 1.0 110.776 176.282 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 2.0 p -62.74 -36.92 84.61 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 125.214 1.406 . . . . 1.0 112.808 -179.588 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -82.44 63.35 6.56 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 123.346 0.659 . . . . 1.0 111.379 -163.676 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 9.6 m -69.28 69.88 0.23 Allowed 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 127.09 2.156 . . . . 1.0 111.504 -177.803 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -171.21 49.67 0.19 Allowed Glycine 0 CA--C 1.522 0.488 0 N-CA-C 108.077 -2.009 . . . . 1.0 108.077 176.202 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.6 t 54.88 47.46 22.22 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.231 1.012 . . . . 1.0 110.19 -173.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 70.41 57.14 6.93 Favored Glycine 0 CA--C 1.525 0.712 0 N-CA-C 109.514 -1.434 . . . . 1.0 109.514 -174.648 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -45.59 125.79 6.29 Favored Pre-proline 0 CA--C 1.536 0.435 0 C-N-CA 124.653 1.181 . . . . 1.0 111.096 -179.632 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -68.82 158.67 56.91 Favored 'Trans proline' 0 N--CA 1.454 -0.794 0 C-N-CA 122.051 1.834 . . . . 1.0 110.049 176.688 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.338 0.086 0 O-C-N 121.849 -0.532 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' CSU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.1 m 63.85 174.32 0.17 Allowed 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.835 1.254 . . . . 1.0 112.037 -173.452 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 67.2 130.37 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 126.182 1.793 . . . . 1.0 114.003 177.726 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -58.86 -53.17 61.36 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 123.548 0.739 . . . . 1.0 110.726 -177.022 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -58.24 -54.05 51.37 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 118.339 0.518 . . . . 1.0 109.882 -176.557 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 20.9 m -52.88 -53.28 51.35 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.247 0.619 . . . . 1.0 110.703 177.487 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' CSU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 4.0 p -66.26 -42.1 90.29 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.157 0 CA-C-O 119.438 -0.315 . . . . 1.0 110.652 -174.848 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 77.7 mt -60.08 -46.69 88.74 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-N 118.651 0.66 . . . . 1.0 110.089 175.766 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -52.87 -57.35 14.71 Favored Glycine 0 CA--C 1.527 0.821 0 N-CA-C 110.657 -0.977 . . . . 1.0 110.657 175.513 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 66.2 mttt -49.69 -63.15 1.2 Allowed 'General case' 0 C--O 1.223 -0.326 0 CA-C-O 119.17 -0.443 . . . . 1.0 110.328 175.918 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 74.4 mt -49.77 -49.15 49.45 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.044 0.538 . . . . 1.0 110.54 -176.019 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 22.9 t -54.97 -58.0 9.41 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 122.986 0.514 . . . . 1.0 111.295 178.651 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -62.7 -45.03 94.67 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 121.377 0.608 . . . . 1.0 110.652 -175.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -63.4 -49.37 74.08 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 125.962 1.705 . . . . 1.0 110.052 -176.593 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.6 pp -68.19 -34.7 76.77 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 118.776 0.716 . . . . 1.0 111.072 177.638 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -58.79 -46.01 88.54 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 121.553 -0.717 . . . . 1.0 109.91 172.394 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 18.5 mttt -58.83 -59.23 5.76 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 118.241 0.473 . . . . 1.0 110.027 174.012 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 57.6 tp -49.09 -45.35 43.12 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.326 1.05 . . . . 1.0 110.805 -174.658 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 34.5 mt-30 -53.31 -57.19 11.41 Favored 'General case' 0 CA--C 1.532 0.281 0 O-C-N 121.894 -0.504 . . . . 1.0 111.341 175.129 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 11.9 t -79.97 -11.92 59.75 Favored 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 113.711 1.004 . . . . 1.0 113.711 -172.673 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 3.7 m-30 -55.32 151.67 18.38 Favored Pre-proline 0 CA--C 1.541 0.617 0 CA-C-N 119.253 0.933 . . . . 1.0 111.014 176.521 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -70.3 78.05 1.22 Allowed 'Trans proline' 0 N--CA 1.458 -0.598 0 C-N-CA 124.026 3.151 . . . . 1.0 111.613 -173.3 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 22.0 ttm105 -71.85 66.67 0.57 Allowed 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 125.985 1.714 . . . . 1.0 110.14 177.406 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 29.1 p -91.78 -78.64 0.4 Allowed 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 124.205 1.002 . . . . 1.0 108.566 178.309 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 44.9 t30 -70.1 82.26 0.51 Allowed 'General case' 0 C--N 1.339 0.123 0 CA-C-O 123.05 1.405 . . . . 1.0 110.929 -174.725 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 1.2 p -90.64 6.47 43.73 Favored 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 126.291 1.836 . . . . 1.0 110.514 171.284 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -82.03 55.6 4.92 Favored Glycine 0 CA--C 1.531 1.046 0 N-CA-C 111.088 -0.805 . . . . 1.0 111.088 -171.253 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.4 t 59.07 25.94 14.51 Favored 'General case' 0 C--O 1.247 0.959 0 C-N-CA 123.913 0.885 . . . . 1.0 111.304 -179.438 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -84.29 85.27 1.56 Allowed Glycine 0 C--N 1.352 1.434 0 CA-C-O 118.944 -0.92 . . . . 1.0 110.871 -172.629 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 7.3 m 98.22 134.23 0.02 OUTLIER Pre-proline 0 N--CA 1.468 0.473 0 C-N-CA 127.85 2.46 . . . . 1.0 109.002 179.395 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo -63.43 143.22 87.88 Favored 'Trans proline' 0 N--CA 1.46 -0.462 0 C-N-CA 121.803 1.668 . . . . 1.0 110.152 174.807 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.338 0.071 0 O-C-N 121.835 -0.54 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' CSU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.8 p -78.65 42.17 0.43 Allowed 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.404 1.482 . . . . 1.0 111.566 -173.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 26.7 m120 -104.06 77.22 1.41 Allowed 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.317 1.047 . . . . 1.0 108.363 -171.919 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -48.03 -46.27 32.95 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.714 0.806 . . . . 1.0 111.714 -175.177 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.0 m -51.54 -55.74 17.34 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.115 0.966 . . . . 1.0 111.312 175.785 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 5.8 m -58.54 -45.77 88.2 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 123.297 0.639 . . . . 1.0 110.022 178.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' CSU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 9.8 p -64.8 -42.52 95.13 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 O-C-N 121.957 -0.464 . . . . 1.0 110.804 -177.007 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 67.8 mt -58.1 -49.56 76.51 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 118.989 0.813 . . . . 1.0 110.598 176.324 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -56.07 -51.21 57.12 Favored Glycine 0 CA--C 1.527 0.786 0 N-CA-C 110.804 -0.918 . . . . 1.0 110.804 177.248 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 46.1 tttm -54.43 -56.69 16.12 Favored 'General case' 0 C--O 1.222 -0.35 0 C-N-CA 123.02 0.528 . . . . 1.0 109.584 178.37 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 76.5 mt -54.16 -48.08 71.26 Favored 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 123.277 0.631 . . . . 1.0 110.687 -179.523 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 25.0 t -53.23 -53.6 48.37 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.027 0.531 . . . . 1.0 110.374 178.023 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 56.3 mm-40 -54.56 -56.72 16.01 Favored 'General case' 0 CA--C 1.531 0.237 0 O-C-N 122.083 -0.386 . . . . 1.0 110.529 175.109 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -52.31 -56.26 15.97 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 125.087 1.355 . . . . 1.0 110.509 -174.546 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.3 pp -64.8 -41.56 95.72 Favored 'General case' 0 N--CA 1.455 -0.208 0 O-C-N 122.321 -0.237 . . . . 1.0 110.464 -178.034 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -62.56 -36.48 82.79 Favored 'General case' 0 CA--C 1.532 0.271 0 O-C-N 121.963 -0.461 . . . . 1.0 110.848 179.476 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.08 -62.13 1.73 Allowed 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 108.836 -0.801 . . . . 1.0 108.836 170.77 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 59.0 tp -44.3 -50.81 8.83 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 125.171 1.389 . . . . 1.0 112.396 -176.357 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 14.3 pt20 -64.42 -22.39 66.94 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 112.926 0.713 . . . . 1.0 112.926 -177.506 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 82.4 p -97.1 -22.94 16.48 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 123.843 0.857 . . . . 1.0 111.964 176.448 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 8.5 m-30 -59.18 155.78 32.4 Favored Pre-proline 0 CA--C 1.535 0.389 0 C-N-CA 123.004 0.522 . . . . 1.0 110.358 175.76 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -67.14 -179.05 1.6 Allowed 'Trans proline' 0 N--CA 1.452 -0.927 0 C-N-CA 122.535 2.156 . . . . 1.0 110.905 177.007 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -55.2 78.2 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 126.283 1.833 . . . . 1.0 112.357 178.328 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 96.1 m -69.65 -55.8 9.02 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 124.936 1.295 . . . . 1.0 109.678 -173.061 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.9 t30 -155.26 63.14 0.62 Allowed 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 122.181 0.991 . . . . 1.0 108.783 172.068 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 2.6 m -69.37 82.33 0.38 Allowed 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 124.079 0.951 . . . . 1.0 110.502 -176.908 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 81.13 -45.53 3.22 Favored Glycine 0 CA--C 1.529 0.934 0 O-C-N 121.605 -0.684 . . . . 1.0 112.255 173.236 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 22.6 p 54.14 59.76 4.02 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.68 1.192 . . . . 1.0 111.506 176.786 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -157.91 -98.59 0.14 Allowed Glycine 0 CA--C 1.526 0.727 0 N-CA-C 110.063 -1.215 . . . . 1.0 110.063 176.004 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.9 t -163.25 152.5 12.54 Favored Pre-proline 0 N--CA 1.454 -0.242 0 N-CA-C 107.089 -1.449 . . . . 1.0 107.089 -178.162 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 77.7 Cg_endo -63.82 163.7 24.07 Favored 'Trans proline' 0 N--CA 1.453 -0.892 0 C-N-CA 121.153 1.236 . . . . 1.0 109.065 160.369 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.338 0.07 0 O-C-N 121.834 -0.541 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' CSU . . . . . 0.404 ' C ' ' H ' ' A' ' 3' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.1 t -74.81 34.0 0.1 Allowed 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.89 0.876 . . . . 1.0 111.922 179.817 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.404 ' H ' ' C ' ' A' ' 1' ' ' CSU . 20.8 m120 -85.71 71.25 10.72 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 107.624 -1.25 . . . . 1.0 107.624 -172.973 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -47.43 -42.1 21.64 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.118 0.967 . . . . 1.0 112.506 -171.367 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 33.5 t -54.81 -53.53 54.08 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.069 0.548 . . . . 1.0 111.044 175.069 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.6 m -57.3 -47.29 81.88 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 122.983 0.513 . . . . 1.0 109.947 176.452 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' CSU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 6.3 p -64.6 -39.61 86.19 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 CA-C-O 119.241 -0.409 . . . . 1.0 110.92 -177.011 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 57.2 mt -58.47 -48.5 80.54 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 118.983 0.81 . . . . 1.0 110.644 174.338 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -54.77 -54.73 31.4 Favored Glycine 0 CA--C 1.528 0.884 0 N-CA-C 110.597 -1.001 . . . . 1.0 110.597 177.183 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 19.9 tttp -47.77 -62.66 1.34 Allowed 'General case' 0 C--O 1.223 -0.34 0 C-N-CA 123.577 0.751 . . . . 1.0 109.697 174.09 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 63.6 mt -52.29 -48.17 65.5 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 123.073 0.549 . . . . 1.0 110.759 -176.099 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 23.0 t -53.47 -59.74 4.19 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 117.959 0.345 . . . . 1.0 110.661 178.677 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 94.1 mt-30 -61.72 -51.94 66.33 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-O 121.001 0.429 . . . . 1.0 110.669 -176.359 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -55.55 -55.86 26.96 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 127.112 2.165 . . . . 1.0 110.69 -177.117 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 86.7 mt -63.55 -43.6 96.59 Favored 'General case' 0 N--CA 1.455 -0.177 0 O-C-N 121.934 -0.479 . . . . 1.0 110.132 179.451 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 37.7 t60 -57.97 -41.85 83.8 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 122.065 -0.397 . . . . 1.0 111.226 177.456 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 59.6 tttm -65.82 -44.96 84.04 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 123.779 0.832 . . . . 1.0 109.918 176.888 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 63.2 tp -56.24 -53.74 53.65 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 123.822 0.849 . . . . 1.0 110.625 179.691 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 -57.11 -33.48 67.37 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 118.407 0.549 . . . . 1.0 112.047 -178.159 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 15.7 p -80.02 -14.35 58.63 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 113.165 0.802 . . . . 1.0 113.165 177.642 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -70.8 152.84 95.07 Favored Pre-proline 0 CA--C 1.536 0.415 0 CA-C-N 119.409 1.004 . . . . 1.0 111.127 -175.117 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -67.6 88.88 0.34 Allowed 'Trans proline' 0 N--CA 1.453 -0.896 0 C-N-CA 122.83 2.353 . . . . 1.0 109.778 175.78 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -36.4 -44.75 0.44 Allowed 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 126.768 2.027 . . . . 1.0 112.614 179.03 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 2.4 p -55.08 -28.25 51.08 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 126.602 1.961 . . . . 1.0 113.628 -177.779 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 33.4 t30 -43.26 101.8 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 125.68 1.592 . . . . 1.0 113.33 -173.568 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . 0.258 0.4 OUTLIER 69.77 -57.99 0.54 Allowed 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 126.846 2.058 . . . . 1.0 112.899 172.442 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -77.86 59.52 3.84 Favored Glycine 0 CA--C 1.524 0.636 0 N-CA-C 110.895 -0.882 . . . . 1.0 110.895 -177.178 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 11.5 p -60.19 -67.58 0.38 Allowed 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 108.397 -0.964 . . . . 1.0 108.397 175.437 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 165.95 76.9 0.03 OUTLIER Glycine 0 CA--C 1.528 0.846 0 C-N-CA 127.466 2.46 . . . . 1.0 107.493 -178.904 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 9.3 t -155.4 146.3 16.4 Favored Pre-proline 0 CA--C 1.532 0.287 0 N-CA-C 107.868 -1.16 . . . . 1.0 107.868 -171.891 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -65.7 81.62 0.24 Allowed 'Trans proline' 0 N--CA 1.454 -0.801 0 C-N-CA 122.276 1.984 . . . . 1.0 109.558 178.349 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.338 0.071 0 O-C-N 121.844 -0.535 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.0 mm? . . . . . 0 C--O 1.226 -0.162 0 N-CA-C 111.586 0.217 . . . . 1.0 111.586 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 32.8 t -53.53 -59.23 4.86 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 122.953 0.501 . . . . 1.0 110.207 176.517 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 3.0 m . . . . . 0 N--CA 1.451 -0.414 0 C-N-CA 123.369 0.668 . . . . 1.0 110.677 178.636 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 5.6 p . . . . . 0 CA--C 1.53 0.203 0 CA-C-O 119.597 -0.239 . . . . 1.0 110.567 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 72.6 mt -58.43 -48.6 80.18 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 118.454 0.57 . . . . 1.0 110.18 174.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -53.37 -54.25 30.77 Favored Glycine 0 CA--C 1.525 0.71 0 N-CA-C 110.746 -0.942 . . . . 1.0 110.746 176.74 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 52.7 mttt -51.09 -66.81 0.32 Allowed 'General case' 0 C--O 1.222 -0.364 0 CA-C-O 118.896 -0.574 . . . . 1.0 110.006 174.514 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 84.0 mt -48.83 -48.98 41.28 Favored 'General case' 0 N--CA 1.456 -0.148 0 CA-C-N 118.472 0.578 . . . . 1.0 110.669 -174.334 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 23.1 t -51.81 -62.14 1.81 Allowed 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 122.797 0.439 . . . . 1.0 111.014 176.587 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 71.3 mt-30 -63.0 -52.88 61.23 Favored 'General case' 0 C--O 1.226 -0.175 0 O-C-N 121.75 -0.594 . . . . 1.0 111.076 -175.512 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -56.43 -53.11 61.29 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 127.518 2.327 . . . . 1.0 110.447 -175.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 84.8 mt -65.51 -39.14 91.49 Favored 'General case' 0 CA--C 1.532 0.253 0 O-C-N 121.56 -0.713 . . . . 1.0 110.439 177.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 5.3 t60 -61.7 -39.33 91.08 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 120.71 -1.244 . . . . 1.0 111.103 175.204 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 61.2 mttm -63.01 -46.76 86.11 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 123.038 0.535 . . . . 1.0 110.107 176.516 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 28.7 tp . . . . . 0 CA--C 1.533 0.289 0 C-N-CA 123.556 0.742 . . . . 1.0 110.804 173.029 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.0 mm? . . . . . 0 CA--C 1.531 0.219 0 N-CA-C 112.366 0.506 . . . . 1.0 112.366 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.1 m -51.72 -55.73 17.92 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.511 0.724 . . . . 1.0 111.319 177.425 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 4.0 m . . . . . 0 N--CA 1.45 -0.43 0 C-N-CA 123.476 0.71 . . . . 1.0 110.376 179.46 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 9.2 p . . . . . 0 N--CA 1.455 -0.2 0 CA-C-O 119.45 -0.309 . . . . 1.0 110.584 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 73.3 mt -58.09 -47.8 82.13 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 118.621 0.646 . . . . 1.0 110.444 175.083 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -52.96 -57.44 14.61 Favored Glycine 0 CA--C 1.524 0.604 0 N-CA-C 110.418 -1.073 . . . . 1.0 110.418 177.446 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 7.7 mtpm? -49.31 -68.67 0.16 Allowed 'General case' 0 C--O 1.221 -0.416 0 N-CA-C 109.055 -0.72 . . . . 1.0 109.055 174.005 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 77.2 mt -44.22 -51.24 8.39 Favored 'General case' 0 C--O 1.225 -0.199 0 C-N-CA 123.605 0.762 . . . . 1.0 111.265 -174.036 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 30.8 t -53.03 -59.65 4.28 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.605 0.762 . . . . 1.0 111.292 177.055 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 86.2 mt-30 -59.04 -42.45 90.29 Favored 'General case' 0 CA--C 1.533 0.301 0 O-C-N 121.814 -0.554 . . . . 1.0 111.032 -177.615 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.29 -50.88 50.61 Favored 'General case' 0 N--CA 1.453 -0.325 0 C-N-CA 126.458 1.903 . . . . 1.0 109.702 -173.047 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.7 pp -66.23 -35.72 81.17 Favored 'General case' 0 C--O 1.234 0.277 0 O-C-N 121.681 -0.637 . . . . 1.0 110.925 177.483 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 11.0 t-80 -58.35 -47.13 84.77 Favored 'General case' 0 CA--C 1.535 0.385 0 O-C-N 122.143 -0.348 . . . . 1.0 110.243 170.632 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 9.1 mttt -58.89 -55.17 38.64 Favored 'General case' 0 C--O 1.225 -0.22 0 N-CA-C 109.8 -0.445 . . . . 1.0 109.8 176.221 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 61.3 tp . . . . . 0 N--CA 1.455 -0.177 0 C-N-CA 124.591 1.156 . . . . 1.0 110.786 -176.798 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.9 mm? . . . . . 0 C--O 1.226 -0.164 0 CA-C-O 119.47 -0.3 . . . . 1.0 111.098 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.2 m -51.22 -57.58 8.44 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 124.087 0.955 . . . . 1.0 111.247 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 3.8 m . . . . . 0 N--CA 1.453 -0.293 0 C-N-CA 123.426 0.69 . . . . 1.0 110.237 179.944 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 5.1 p . . . . . 0 N--CA 1.454 -0.251 0 CA-C-O 119.138 -0.458 . . . . 1.0 110.541 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 65.9 mt -57.83 -50.85 71.89 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 118.871 0.76 . . . . 1.0 110.408 174.553 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -52.2 -56.19 18.16 Favored Glycine 0 CA--C 1.525 0.695 0 N-CA-C 110.816 -0.914 . . . . 1.0 110.816 177.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.445 ' NZ ' ' OE1' ' A' ' 15' ' ' GLU . 7.9 mtpm? -54.06 -63.79 1.04 Allowed 'General case' 0 C--O 1.217 -0.632 0 CA-C-O 117.829 -1.081 . . . . 1.0 110.217 176.744 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 77.5 mt -45.44 -49.9 13.0 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 119.815 1.188 . . . . 1.0 111.19 -177.599 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 29.4 t -54.53 -58.84 5.91 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 122.988 0.515 . . . . 1.0 110.972 177.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -59.39 -51.9 67.92 Favored 'General case' 0 CA--C 1.535 0.378 0 O-C-N 121.405 -0.809 . . . . 1.0 110.806 -178.403 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.445 ' OE1' ' NZ ' ' A' ' 11' ' ' LYS . 3.4 tp10 -53.32 -53.63 48.22 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 127.25 2.22 . . . . 1.0 110.434 -177.123 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.7 pp -64.84 -40.61 95.44 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 118.377 0.535 . . . . 1.0 110.692 177.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -65.29 -34.93 79.5 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-O 118.571 -0.728 . . . . 1.0 111.738 -177.086 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.64 -39.66 24.08 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 118.977 0.808 . . . . 1.0 111.023 174.443 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 58.4 tp . . . . . 0 C--N 1.339 0.15 0 C-N-CA 123.442 0.697 . . . . 1.0 110.709 176.716 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.9 mm? . . . . . 0 N--CA 1.456 -0.126 0 CA-C-O 119.707 -0.187 . . . . 1.0 111.307 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 32.7 t -55.82 -60.32 3.63 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-O 121.369 0.604 . . . . 1.0 110.56 -171.694 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 18.8 m . . . . . 0 N--CA 1.451 -0.404 0 O-C-N 121.912 -0.493 . . . . 1.0 110.1 -177.674 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 9.8 p . . . . . 0 CA--C 1.53 0.188 0 CA-C-O 119.668 -0.205 . . . . 1.0 110.835 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 72.5 mt -56.6 -49.85 73.72 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 118.143 0.429 . . . . 1.0 110.112 175.675 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -54.9 -51.77 51.11 Favored Glycine 0 CA--C 1.529 0.919 0 N-CA-C 111.014 -0.834 . . . . 1.0 111.014 176.538 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.22 -58.05 8.84 Favored 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 123.91 0.884 . . . . 1.0 109.216 -179.494 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 80.8 mt -55.38 -50.2 70.32 Favored 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 123.076 0.551 . . . . 1.0 110.147 -178.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 22.9 t -52.71 -56.6 14.41 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 122.858 0.463 . . . . 1.0 110.239 179.48 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 27.6 mm-40 -56.25 -55.55 31.9 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 122.954 0.502 . . . . 1.0 110.498 179.596 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -56.28 -53.56 55.79 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.297 1.039 . . . . 1.0 110.491 -174.286 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 80.5 mt -62.07 -46.76 87.69 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 122.825 0.45 . . . . 1.0 110.552 178.115 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 4.4 t-80 -57.09 -33.58 67.45 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-O 118.992 -0.527 . . . . 1.0 111.012 178.231 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 78.5 tttt -78.02 -45.55 23.38 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 123.501 0.721 . . . . 1.0 110.153 177.7 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 60.8 tp . . . . . 0 CA--C 1.529 0.151 0 C-N-CA 126.08 1.752 . . . . 1.0 111.432 -174.665 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.8 mm? . . . . . 0 N--CA 1.453 -0.317 0 CA-C-O 118.521 -0.752 . . . . 1.0 111.3 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.96 -55.03 40.39 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 119.42 1.009 . . . . 1.0 109.569 -177.449 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.0 m . . . . . 0 N--CA 1.449 -0.484 0 C-N-CA 123.879 0.872 . . . . 1.0 109.906 179.124 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 4.3 p . . . . . 0 N--CA 1.456 -0.165 0 CA-C-O 119.623 -0.227 . . . . 1.0 110.75 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 82.2 mt -60.15 -47.18 86.99 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 118.589 0.631 . . . . 1.0 109.862 175.078 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -52.98 -50.4 51.25 Favored Glycine 0 CA--C 1.526 0.736 0 N-CA-C 111.022 -0.831 . . . . 1.0 111.022 176.417 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 66.7 mttt -55.48 -69.05 0.15 Allowed 'General case' 0 C--O 1.223 -0.312 0 CA-C-O 118.874 -0.584 . . . . 1.0 109.515 172.819 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 75.2 mt -45.25 -48.53 12.76 Favored 'General case' 0 C--O 1.226 -0.17 0 C-N-CA 124.153 0.981 . . . . 1.0 111.42 -172.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 23.0 t -53.12 -58.42 7.06 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.07 0.548 . . . . 1.0 111.11 177.353 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -62.83 -46.04 89.81 Favored 'General case' 0 CA--C 1.528 0.134 0 O-C-N 121.655 -0.653 . . . . 1.0 110.681 -177.587 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -62.81 -52.31 63.67 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 126.875 2.07 . . . . 1.0 109.64 -173.389 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.9 pp -64.43 -39.72 94.38 Favored 'General case' 0 N--CA 1.456 -0.148 0 O-C-N 121.726 -0.609 . . . . 1.0 110.242 175.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 63.2 t60 -61.15 -40.68 94.76 Favored 'General case' 0 CA--C 1.534 0.332 0 O-C-N 121.905 -0.497 . . . . 1.0 111.298 178.363 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 59.6 mttm -61.54 -52.89 62.58 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.24 -0.652 . . . . 1.0 109.24 171.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 56.6 tp . . . . . 0 CA--C 1.533 0.301 0 C-N-CA 123.144 0.577 . . . . 1.0 111.379 -178.523 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.0 mm? . . . . . 0 C--O 1.227 -0.085 0 N-CA-C 111.962 0.356 . . . . 1.0 111.962 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 23.0 t -56.99 -59.29 5.28 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 109.842 -0.429 . . . . 1.0 109.842 -179.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 4.2 m . . . . . 0 N--CA 1.449 -0.512 0 C-N-CA 124.034 0.933 . . . . 1.0 110.819 177.608 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 4.6 p . . . . . 0 N--CA 1.453 -0.284 0 CA-C-O 119.586 -0.245 . . . . 1.0 110.428 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 65.0 mt -56.52 -50.42 71.87 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 118.582 0.628 . . . . 1.0 110.145 174.734 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -57.61 -45.61 93.03 Favored Glycine 0 CA--C 1.528 0.882 0 C-N-CA 124.238 0.923 . . . . 1.0 112.179 179.702 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.7 ptmm? -64.12 -54.59 31.56 Favored 'General case' 0 C--O 1.223 -0.322 0 N-CA-C 108.87 -0.789 . . . . 1.0 108.87 177.207 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 68.2 mt -52.14 -48.97 64.6 Favored 'General case' 0 C--O 1.227 -0.105 0 C-N-CA 123.131 0.573 . . . . 1.0 110.613 -175.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 23.2 t -51.86 -56.44 13.99 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 121.227 0.537 . . . . 1.0 111.078 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -65.69 -48.06 73.32 Favored 'General case' 0 CA--C 1.531 0.227 0 O-C-N 121.716 -0.615 . . . . 1.0 110.57 -177.339 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -55.16 -55.58 29.54 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 127.089 2.156 . . . . 1.0 110.319 -177.054 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.7 pp -62.53 -42.2 99.37 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 118.562 0.619 . . . . 1.0 110.326 178.72 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -57.54 -38.7 75.15 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-O 118.85 -0.595 . . . . 1.0 110.676 177.442 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 14.2 mttt -66.97 -54.8 18.35 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 118.373 0.533 . . . . 1.0 110.051 173.342 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 58.3 tp . . . . . 0 C--O 1.232 0.15 0 C-N-CA 126.069 1.748 . . . . 1.0 111.787 -171.759 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.9 mm? . . . . . 0 CA--C 1.529 0.158 0 N-CA-C 112.319 0.489 . . . . 1.0 112.319 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 30.1 t -54.51 -60.82 2.84 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 120.933 0.397 . . . . 1.0 110.497 177.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 3.8 m . . . . . 0 N--CA 1.45 -0.428 0 C-N-CA 123.713 0.805 . . . . 1.0 110.788 179.054 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 4.1 p . . . . . 0 N--CA 1.455 -0.21 0 CA-C-O 119.538 -0.268 . . . . 1.0 110.436 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 75.0 mt -59.09 -49.34 78.26 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 118.389 0.541 . . . . 1.0 110.155 175.19 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -52.85 -55.13 25.0 Favored Glycine 0 CA--C 1.526 0.723 0 N-CA-C 110.615 -0.994 . . . . 1.0 110.615 176.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 24.3 mttt -50.05 -67.74 0.23 Allowed 'General case' 0 C--O 1.222 -0.39 0 CA-C-O 118.948 -0.548 . . . . 1.0 110.104 174.534 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 81.0 mt -48.45 -48.82 37.29 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 118.304 0.502 . . . . 1.0 110.539 -174.142 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 29.1 t -51.11 -63.24 1.19 Allowed 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 122.791 0.437 . . . . 1.0 111.023 176.304 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 66.9 mt-30 -64.12 -50.64 67.44 Favored 'General case' 0 CA--C 1.532 0.279 0 O-C-N 121.589 -0.694 . . . . 1.0 111.15 -174.486 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 15.2 tt0 -56.61 -52.62 64.16 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 127.191 2.196 . . . . 1.0 109.786 -176.052 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 83.5 mt -65.2 -43.42 91.67 Favored 'General case' 0 CA--C 1.532 0.267 0 O-C-N 121.586 -0.696 . . . . 1.0 110.746 176.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -56.64 -40.19 75.01 Favored 'General case' 0 C--N 1.341 0.198 0 O-C-N 121.853 -0.53 . . . . 1.0 110.733 177.511 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -65.1 -54.14 34.49 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 109.312 -0.625 . . . . 1.0 109.312 174.469 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 62.1 tp . . . . . 0 CA--C 1.529 0.156 0 C-N-CA 124.09 0.956 . . . . 1.0 111.493 -178.085 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.0 mm? . . . . . 0 CA--C 1.53 0.209 0 CA-C-O 119.711 -0.185 . . . . 1.0 110.726 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -58.24 -54.05 51.37 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 118.339 0.518 . . . . 1.0 109.882 -176.557 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 20.9 m . . . . . 0 CA--C 1.532 0.262 0 C-N-CA 123.247 0.619 . . . . 1.0 110.703 177.487 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 4.0 p . . . . . 0 CA--C 1.529 0.157 0 CA-C-O 119.438 -0.315 . . . . 1.0 110.652 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 77.7 mt -60.08 -46.69 88.74 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-N 118.651 0.66 . . . . 1.0 110.089 175.766 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -52.87 -57.35 14.71 Favored Glycine 0 CA--C 1.527 0.821 0 N-CA-C 110.657 -0.977 . . . . 1.0 110.657 175.513 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 66.2 mttt -49.69 -63.15 1.2 Allowed 'General case' 0 C--O 1.223 -0.326 0 CA-C-O 119.17 -0.443 . . . . 1.0 110.328 175.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 74.4 mt -49.77 -49.15 49.45 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.044 0.538 . . . . 1.0 110.54 -176.019 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 22.9 t -54.97 -58.0 9.41 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 122.986 0.514 . . . . 1.0 111.295 178.651 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -62.7 -45.03 94.67 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 121.377 0.608 . . . . 1.0 110.652 -175.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -63.4 -49.37 74.08 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 125.962 1.705 . . . . 1.0 110.052 -176.593 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.6 pp -68.19 -34.7 76.77 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 118.776 0.716 . . . . 1.0 111.072 177.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -58.79 -46.01 88.54 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 121.553 -0.717 . . . . 1.0 109.91 172.394 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 18.5 mttt -58.83 -59.23 5.76 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 118.241 0.473 . . . . 1.0 110.027 174.012 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 57.6 tp . . . . . 0 N--CA 1.453 -0.29 0 C-N-CA 124.326 1.05 . . . . 1.0 110.805 -174.658 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.532 0.284 0 N-CA-C 111.714 0.265 . . . . 1.0 111.714 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.0 m -51.54 -55.74 17.34 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.115 0.966 . . . . 1.0 111.312 175.785 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 5.8 m . . . . . 0 N--CA 1.452 -0.365 0 C-N-CA 123.297 0.639 . . . . 1.0 110.022 178.993 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 9.8 p . . . . . 0 CA--C 1.531 0.22 0 CA-C-O 119.242 -0.408 . . . . 1.0 110.804 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 67.8 mt -58.1 -49.56 76.51 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 118.989 0.813 . . . . 1.0 110.598 176.324 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -56.07 -51.21 57.12 Favored Glycine 0 CA--C 1.527 0.786 0 N-CA-C 110.804 -0.918 . . . . 1.0 110.804 177.248 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 46.1 tttm -54.43 -56.69 16.12 Favored 'General case' 0 C--O 1.222 -0.35 0 C-N-CA 123.02 0.528 . . . . 1.0 109.584 178.37 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 76.5 mt -54.16 -48.08 71.26 Favored 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 123.277 0.631 . . . . 1.0 110.687 -179.523 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 25.0 t -53.23 -53.6 48.37 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.027 0.531 . . . . 1.0 110.374 178.023 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 56.3 mm-40 -54.56 -56.72 16.01 Favored 'General case' 0 CA--C 1.531 0.237 0 O-C-N 122.083 -0.386 . . . . 1.0 110.529 175.109 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -52.31 -56.26 15.97 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 125.087 1.355 . . . . 1.0 110.509 -174.546 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.3 pp -64.8 -41.56 95.72 Favored 'General case' 0 N--CA 1.455 -0.208 0 O-C-N 122.321 -0.237 . . . . 1.0 110.464 -178.034 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -62.56 -36.48 82.79 Favored 'General case' 0 CA--C 1.532 0.271 0 O-C-N 121.963 -0.461 . . . . 1.0 110.848 179.476 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.08 -62.13 1.73 Allowed 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 108.836 -0.801 . . . . 1.0 108.836 170.77 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 59.0 tp . . . . . 0 CA--C 1.532 0.265 0 C-N-CA 125.171 1.389 . . . . 1.0 112.396 -176.357 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.534 0.357 0 N-CA-C 112.506 0.558 . . . . 1.0 112.506 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 33.5 t -54.81 -53.53 54.08 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.069 0.548 . . . . 1.0 111.044 175.069 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.6 m . . . . . 0 CA--C 1.529 0.156 0 C-N-CA 122.983 0.513 . . . . 1.0 109.947 176.452 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 6.3 p . . . . . 0 CA--C 1.531 0.241 0 CA-C-O 119.241 -0.409 . . . . 1.0 110.92 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 57.2 mt -58.47 -48.5 80.54 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 118.983 0.81 . . . . 1.0 110.644 174.338 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -54.77 -54.73 31.4 Favored Glycine 0 CA--C 1.528 0.884 0 N-CA-C 110.597 -1.001 . . . . 1.0 110.597 177.183 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 19.9 tttp -47.77 -62.66 1.34 Allowed 'General case' 0 C--O 1.223 -0.34 0 C-N-CA 123.577 0.751 . . . . 1.0 109.697 174.09 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 63.6 mt -52.29 -48.17 65.5 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 123.073 0.549 . . . . 1.0 110.759 -176.099 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 23.0 t -53.47 -59.74 4.19 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 117.959 0.345 . . . . 1.0 110.661 178.677 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 94.1 mt-30 -61.72 -51.94 66.33 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-O 121.001 0.429 . . . . 1.0 110.669 -176.359 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -55.55 -55.86 26.96 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 127.112 2.165 . . . . 1.0 110.69 -177.117 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 86.7 mt -63.55 -43.6 96.59 Favored 'General case' 0 N--CA 1.455 -0.177 0 O-C-N 121.934 -0.479 . . . . 1.0 110.132 179.451 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 37.7 t60 -57.97 -41.85 83.8 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 122.065 -0.397 . . . . 1.0 111.226 177.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 59.6 tttm -65.82 -44.96 84.04 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 123.779 0.832 . . . . 1.0 109.918 176.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 63.2 tp . . . . . 0 N--CA 1.455 -0.183 0 C-N-CA 123.822 0.849 . . . . 1.0 110.625 179.691 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' CSU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.5 t -81.07 41.03 0.57 Allowed 'General case' 0 CA--C 1.536 0.41 0 O-C-N 121.668 -0.645 . . . . 1.0 109.971 173.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 35.0 p-10 -111.35 59.63 0.62 Allowed 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 124.925 1.29 . . . . 1.0 109.175 -171.044 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -49.92 -43.82 49.98 Favored 'General case' 0 C--O 1.226 -0.162 0 C-N-CA 124.498 1.119 . . . . 1.0 111.586 -177.176 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 32.8 t -53.53 -59.23 4.86 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 122.953 0.501 . . . . 1.0 110.207 176.517 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 3.0 m -54.46 -46.54 73.34 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 123.369 0.668 . . . . 1.0 110.677 178.636 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' CSU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 5.6 p -66.7 -41.51 88.18 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 O-C-N 122.048 -0.407 . . . . 1.0 110.567 -176.106 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 72.6 mt -58.43 -48.6 80.18 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 118.454 0.57 . . . . 1.0 110.18 174.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -53.37 -54.25 30.77 Favored Glycine 0 CA--C 1.525 0.71 0 N-CA-C 110.746 -0.942 . . . . 1.0 110.746 176.74 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 52.7 mttt -51.09 -66.81 0.32 Allowed 'General case' 0 C--O 1.222 -0.364 0 CA-C-O 118.896 -0.574 . . . . 1.0 110.006 174.514 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 84.0 mt -48.83 -48.98 41.28 Favored 'General case' 0 N--CA 1.456 -0.148 0 CA-C-N 118.472 0.578 . . . . 1.0 110.669 -174.334 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 23.1 t -51.81 -62.14 1.81 Allowed 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 122.797 0.439 . . . . 1.0 111.014 176.587 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 71.3 mt-30 -63.0 -52.88 61.23 Favored 'General case' 0 C--O 1.226 -0.175 0 O-C-N 121.75 -0.594 . . . . 1.0 111.076 -175.512 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -56.43 -53.11 61.29 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 127.518 2.327 . . . . 1.0 110.447 -175.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 84.8 mt -65.51 -39.14 91.49 Favored 'General case' 0 CA--C 1.532 0.253 0 O-C-N 121.56 -0.713 . . . . 1.0 110.439 177.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 5.3 t60 -61.7 -39.33 91.08 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 120.71 -1.244 . . . . 1.0 111.103 175.204 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 61.2 mttm -63.01 -46.76 86.11 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 123.038 0.535 . . . . 1.0 110.107 176.516 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 28.7 tp -45.84 -47.5 15.9 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 123.556 0.742 . . . . 1.0 110.804 173.029 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 -57.21 -45.94 83.36 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 118.184 0.447 . . . . 1.0 111.579 176.411 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 74.5 p -75.84 -25.39 56.2 Favored 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 113.212 0.819 . . . . 1.0 113.212 -174.743 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -55.18 142.55 57.67 Favored Pre-proline 0 CA--C 1.538 0.483 0 CA-C-N 118.645 0.657 . . . . 1.0 110.968 -178.62 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -65.53 -45.06 7.48 Favored 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 122.935 2.424 . . . . 1.0 111.454 -175.074 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -165.51 106.4 0.76 Allowed 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 109.73 -0.47 . . . . 1.0 109.73 176.217 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 17.0 p -79.32 -26.31 42.21 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 123.768 0.827 . . . . 1.0 110.973 171.175 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -80.78 62.65 4.89 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.868 0.867 . . . . 1.0 109.388 -169.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 16.0 p -104.46 0.54 29.01 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.483 1.513 . . . . 1.0 112.119 -174.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -50.68 -45.41 48.04 Favored Glycine 0 CA--C 1.53 0.97 0 C-N-CA 124.002 0.811 . . . . 1.0 112.82 -173.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 19.1 p -167.95 -87.66 0.01 OUTLIER 'General case' 0 N--CA 1.456 -0.157 0 N-CA-C 108.463 -0.94 . . . . 1.0 108.463 172.722 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 177.82 131.23 1.5 Allowed Glycine 0 CA--C 1.524 0.639 0 N-CA-C 108.978 -1.649 . . . . 1.0 108.978 179.441 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 13.1 t -65.97 137.82 96.07 Favored Pre-proline 0 CA--C 1.537 0.467 0 N-CA-C 108.945 -0.761 . . . . 1.0 108.945 176.011 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -65.5 86.71 0.21 Allowed 'Trans proline' 0 N--CA 1.454 -0.816 0 C-N-CA 122.165 1.91 . . . . 1.0 109.735 -178.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.338 0.087 0 O-C-N 121.866 -0.521 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' CSU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.8 m -147.39 28.15 0.99 Allowed 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 121.927 0.87 . . . . 1.0 109.318 167.169 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 6.3 m120 -89.84 68.48 7.44 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 108.413 -0.958 . . . . 1.0 108.413 -160.712 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -41.27 -51.74 3.53 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.869 1.268 . . . . 1.0 112.366 -175.543 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.1 m -51.72 -55.73 17.92 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.511 0.724 . . . . 1.0 111.319 177.425 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 4.0 m -58.69 -44.65 90.35 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 123.476 0.71 . . . . 1.0 110.376 179.46 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' CSU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 9.2 p -64.68 -43.45 96.61 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.2 0 O-C-N 122.016 -0.428 . . . . 1.0 110.584 -176.363 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 73.3 mt -58.09 -47.8 82.13 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 118.621 0.646 . . . . 1.0 110.444 175.083 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -52.96 -57.44 14.61 Favored Glycine 0 CA--C 1.524 0.604 0 N-CA-C 110.418 -1.073 . . . . 1.0 110.418 177.446 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 7.7 mtpm? -49.31 -68.67 0.16 Allowed 'General case' 0 C--O 1.221 -0.416 0 N-CA-C 109.055 -0.72 . . . . 1.0 109.055 174.005 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 77.2 mt -44.22 -51.24 8.39 Favored 'General case' 0 C--O 1.225 -0.199 0 C-N-CA 123.605 0.762 . . . . 1.0 111.265 -174.036 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 30.8 t -53.03 -59.65 4.28 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.605 0.762 . . . . 1.0 111.292 177.055 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 86.2 mt-30 -59.04 -42.45 90.29 Favored 'General case' 0 CA--C 1.533 0.301 0 O-C-N 121.814 -0.554 . . . . 1.0 111.032 -177.615 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.29 -50.88 50.61 Favored 'General case' 0 N--CA 1.453 -0.325 0 C-N-CA 126.458 1.903 . . . . 1.0 109.702 -173.047 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.7 pp -66.23 -35.72 81.17 Favored 'General case' 0 C--O 1.234 0.277 0 O-C-N 121.681 -0.637 . . . . 1.0 110.925 177.483 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 11.0 t-80 -58.35 -47.13 84.77 Favored 'General case' 0 CA--C 1.535 0.385 0 O-C-N 122.143 -0.348 . . . . 1.0 110.243 170.632 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 9.1 mttt -58.89 -55.17 38.64 Favored 'General case' 0 C--O 1.225 -0.22 0 N-CA-C 109.8 -0.445 . . . . 1.0 109.8 176.221 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 61.3 tp -48.56 -54.68 13.55 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 124.591 1.156 . . . . 1.0 110.786 -176.798 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -67.74 -7.1 24.54 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 113.32 0.859 . . . . 1.0 113.32 -177.493 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 36.6 p -116.07 10.21 14.98 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.038 0.935 . . . . 1.0 111.92 172.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 2.9 m-30 -86.4 150.41 51.51 Favored Pre-proline 0 CA--C 1.533 0.292 0 CA-C-N 119.132 0.878 . . . . 1.0 109.787 174.754 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_endo -65.78 147.08 85.14 Favored 'Trans proline' 0 N--CA 1.453 -0.899 0 C-N-CA 122.501 2.134 . . . . 1.0 109.645 171.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 21.1 tpt180 -78.52 62.94 3.23 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.385 0.674 . . . . 1.0 110.516 -174.372 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 19.4 p -69.21 -50.94 42.77 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 124.241 1.016 . . . . 1.0 110.51 -179.727 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -71.31 76.18 0.73 Allowed 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 125.095 1.358 . . . . 1.0 110.37 -167.165 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 13.5 p -119.63 60.97 0.84 Allowed 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 126.087 1.755 . . . . 1.0 108.96 -175.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -47.74 -42.95 21.92 Favored Glycine 0 CA--C 1.532 1.114 0 C-N-CA 124.316 0.96 . . . . 1.0 113.23 -174.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 14.9 m 54.93 47.32 22.47 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.805 0.842 . . . . 1.0 112.471 174.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -66.91 168.97 35.78 Favored Glycine 0 CA--C 1.531 1.038 0 N-CA-C 110.644 -0.982 . . . . 1.0 110.644 171.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 1.2 p -98.47 90.35 1.0 Allowed Pre-proline 0 CA--C 1.539 0.536 0 C-N-CA 125.584 1.553 . . . . 1.0 110.449 -176.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -63.87 143.97 87.15 Favored 'Trans proline' 0 N--CA 1.457 -0.67 0 C-N-CA 121.378 1.385 . . . . 1.0 110.313 175.06 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.338 0.074 0 O-C-N 121.848 -0.532 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' CSU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.8 t -150.32 40.78 0.79 Allowed 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 108.346 -0.983 . . . . 1.0 108.346 177.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 20.4 m120 -147.17 83.61 1.57 Allowed 'General case' 0 N--CA 1.456 -0.138 0 N-CA-C 108.366 -0.976 . . . . 1.0 108.366 -169.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -46.5 -52.73 12.66 Favored 'General case' 0 C--O 1.226 -0.164 0 C-N-CA 123.975 0.91 . . . . 1.0 111.098 -177.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.2 m -51.22 -57.58 8.44 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 124.087 0.955 . . . . 1.0 111.247 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 3.8 m -57.24 -48.25 79.31 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 123.426 0.69 . . . . 1.0 110.237 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' CSU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 5.1 p -65.6 -41.85 91.59 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.251 0 CA-C-O 119.138 -0.458 . . . . 1.0 110.541 -175.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 65.9 mt -57.83 -50.85 71.89 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 118.871 0.76 . . . . 1.0 110.408 174.553 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -52.2 -56.19 18.16 Favored Glycine 0 CA--C 1.525 0.695 0 N-CA-C 110.816 -0.914 . . . . 1.0 110.816 177.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.445 ' NZ ' ' OE1' ' A' ' 15' ' ' GLU . 7.9 mtpm? -54.06 -63.79 1.04 Allowed 'General case' 0 C--O 1.217 -0.632 0 CA-C-O 117.829 -1.081 . . . . 1.0 110.217 176.744 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 77.5 mt -45.44 -49.9 13.0 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 119.815 1.188 . . . . 1.0 111.19 -177.599 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 29.4 t -54.53 -58.84 5.91 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 122.988 0.515 . . . . 1.0 110.972 177.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -59.39 -51.9 67.92 Favored 'General case' 0 CA--C 1.535 0.378 0 O-C-N 121.405 -0.809 . . . . 1.0 110.806 -178.403 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.445 ' OE1' ' NZ ' ' A' ' 11' ' ' LYS . 3.4 tp10 -53.32 -53.63 48.22 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 127.25 2.22 . . . . 1.0 110.434 -177.123 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.7 pp -64.84 -40.61 95.44 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 118.377 0.535 . . . . 1.0 110.692 177.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -65.29 -34.93 79.5 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-O 118.571 -0.728 . . . . 1.0 111.738 -177.086 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.64 -39.66 24.08 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 118.977 0.808 . . . . 1.0 111.023 174.443 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 58.4 tp -50.77 -52.35 41.64 Favored 'General case' 0 C--N 1.339 0.15 0 C-N-CA 123.442 0.697 . . . . 1.0 110.709 176.716 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -56.34 -23.97 40.89 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 113.003 0.742 . . . . 1.0 113.003 -179.175 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 10.5 p -98.23 -2.75 38.96 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 123.596 0.758 . . . . 1.0 113.034 177.379 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 10.3 m-30 -65.96 150.3 96.7 Favored Pre-proline 0 CA--C 1.537 0.465 0 CA-C-N 119.641 1.109 . . . . 1.0 110.459 178.251 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_endo -63.38 126.47 17.79 Favored 'Trans proline' 0 N--CA 1.454 -0.818 0 C-N-CA 122.882 2.388 . . . . 1.0 110.443 179.436 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 9.8 tpt180 -76.46 80.99 3.17 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 122.983 0.513 . . . . 1.0 110.589 -173.462 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 7.9 p -49.61 -38.13 30.58 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.478 1.111 . . . . 1.0 112.216 172.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -70.08 66.54 0.27 Allowed 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.501 1.12 . . . . 1.0 112.116 -179.612 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 6.2 m -74.9 59.91 0.93 Allowed 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.518 1.127 . . . . 1.0 109.003 169.182 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 158.98 65.44 0.01 OUTLIER Glycine 0 CA--C 1.525 0.692 0 N-CA-C 109.76 -1.336 . . . . 1.0 109.76 -171.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 61.3 m -154.3 -57.87 0.11 Allowed 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 123.842 0.857 . . . . 1.0 108.697 173.552 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 66.63 -80.65 0.12 Allowed Glycine 0 CA--C 1.527 0.831 0 N-CA-C 111.599 -0.6 . . . . 1.0 111.599 176.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 40.6 p -114.08 76.54 3.48 Favored Pre-proline 0 CA--C 1.534 0.365 0 C-N-CA 126.063 1.745 . . . . 1.0 108.673 -178.617 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -65.95 144.32 76.05 Favored 'Trans proline' 0 N--CA 1.454 -0.799 0 C-N-CA 121.898 1.732 . . . . 1.0 110.084 178.018 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.338 0.082 0 O-C-N 121.843 -0.535 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' CSU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 29.8 p -76.6 63.75 2.13 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.607 1.163 . . . . 1.0 110.607 -175.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 41.3 t-20 -167.13 99.89 0.53 Allowed 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.581 0.752 . . . . 1.0 110.193 -176.134 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -57.42 -55.58 32.91 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 123.649 0.78 . . . . 1.0 111.307 179.69 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 32.7 t -55.82 -60.32 3.63 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-O 121.369 0.604 . . . . 1.0 110.56 -171.694 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 18.8 m -60.84 -40.47 92.95 Favored 'General case' 0 N--CA 1.451 -0.404 0 O-C-N 121.912 -0.493 . . . . 1.0 110.1 -177.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' CSU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 9.8 p -63.74 -43.16 97.9 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 CA-C-N 118.556 0.616 . . . . 1.0 110.835 -175.117 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 72.5 mt -56.6 -49.85 73.72 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 118.143 0.429 . . . . 1.0 110.112 175.675 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -54.9 -51.77 51.11 Favored Glycine 0 CA--C 1.529 0.919 0 N-CA-C 111.014 -0.834 . . . . 1.0 111.014 176.538 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.22 -58.05 8.84 Favored 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 123.91 0.884 . . . . 1.0 109.216 -179.494 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 80.8 mt -55.38 -50.2 70.32 Favored 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 123.076 0.551 . . . . 1.0 110.147 -178.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 22.9 t -52.71 -56.6 14.41 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 122.858 0.463 . . . . 1.0 110.239 179.48 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 27.6 mm-40 -56.25 -55.55 31.9 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 122.954 0.502 . . . . 1.0 110.498 179.596 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -56.28 -53.56 55.79 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.297 1.039 . . . . 1.0 110.491 -174.286 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 80.5 mt -62.07 -46.76 87.69 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 122.825 0.45 . . . . 1.0 110.552 178.115 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 4.4 t-80 -57.09 -33.58 67.45 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-O 118.992 -0.527 . . . . 1.0 111.012 178.231 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 78.5 tttt -78.02 -45.55 23.38 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 123.501 0.721 . . . . 1.0 110.153 177.7 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 60.8 tp -48.27 -52.46 21.15 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 126.08 1.752 . . . . 1.0 111.432 -174.665 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 15.5 pt20 -50.67 -29.64 11.65 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 113.006 0.743 . . . . 1.0 113.006 177.556 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 4.2 p -111.11 16.04 21.29 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.474 1.509 . . . . 1.0 111.585 -178.152 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 3.4 t80 -72.61 152.85 91.66 Favored Pre-proline 0 CA--C 1.535 0.381 0 O-C-N 121.392 -0.818 . . . . 1.0 109.386 -177.811 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -55.37 155.98 18.72 Favored 'Trans proline' 0 N--CA 1.455 -0.763 0 C-N-CA 121.424 1.416 . . . . 1.0 110.152 166.253 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 21.7 ttp85 -78.77 57.56 2.12 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.425 0.69 . . . . 1.0 111.724 -168.013 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 7.9 m -57.12 -56.54 20.4 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 123.835 0.854 . . . . 1.0 109.166 174.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -76.39 73.07 3.15 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 109.48 -0.563 . . . . 1.0 109.48 174.628 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 85.0 m -71.0 71.77 0.56 Allowed 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 108.638 -0.875 . . . . 1.0 108.638 167.706 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -71.33 -37.14 63.13 Favored Glycine 0 CA--C 1.529 0.907 0 N-CA-C 110.905 -0.878 . . . . 1.0 110.905 176.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 21.8 m 55.55 49.66 16.15 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.127 0.971 . . . . 1.0 111.538 177.477 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -81.96 -152.6 10.3 Favored Glycine 0 CA--C 1.53 0.996 0 N-CA-C 111.36 -0.696 . . . . 1.0 111.36 177.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 14.7 t -55.43 138.59 68.03 Favored Pre-proline 0 CA--C 1.54 0.562 0 C-N-CA 123.11 0.564 . . . . 1.0 110.196 178.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -65.67 80.7 0.25 Allowed 'Trans proline' 0 N--CA 1.454 -0.805 0 C-N-CA 122.225 1.95 . . . . 1.0 109.648 -179.042 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.338 0.086 0 O-C-N 121.845 -0.535 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' CSU . . . . . 0.865 ' OD3' ' SG ' ' A' ' 7' ' ' CSU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 85.3 p -159.71 52.37 0.35 Allowed 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 110.173 -0.306 . . . . 1.0 110.173 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 29.3 t30 -164.09 130.52 3.11 Favored 'General case' 0 C--O 1.231 0.108 0 C-N-CA 122.447 0.299 . . . . 1.0 110.46 172.477 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -59.32 -45.2 91.98 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 123.948 0.899 . . . . 1.0 111.3 177.487 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.96 -55.03 40.39 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 119.42 1.009 . . . . 1.0 109.569 -177.449 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.0 m -55.67 -48.58 74.8 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 123.879 0.872 . . . . 1.0 109.906 179.124 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' CSU . . . . . 0.865 ' SG ' ' OD3' ' A' ' 1' ' ' CSU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 4.3 p -66.83 -42.83 89.69 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.165 0 O-C-N 121.967 -0.458 . . . . 1.0 110.75 -174.291 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 82.2 mt -60.15 -47.18 86.99 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 118.589 0.631 . . . . 1.0 109.862 175.078 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -52.98 -50.4 51.25 Favored Glycine 0 CA--C 1.526 0.736 0 N-CA-C 111.022 -0.831 . . . . 1.0 111.022 176.417 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 66.7 mttt -55.48 -69.05 0.15 Allowed 'General case' 0 C--O 1.223 -0.312 0 CA-C-O 118.874 -0.584 . . . . 1.0 109.515 172.819 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 75.2 mt -45.25 -48.53 12.76 Favored 'General case' 0 C--O 1.226 -0.17 0 C-N-CA 124.153 0.981 . . . . 1.0 111.42 -172.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 23.0 t -53.12 -58.42 7.06 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.07 0.548 . . . . 1.0 111.11 177.353 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -62.83 -46.04 89.81 Favored 'General case' 0 CA--C 1.528 0.134 0 O-C-N 121.655 -0.653 . . . . 1.0 110.681 -177.587 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -62.81 -52.31 63.67 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 126.875 2.07 . . . . 1.0 109.64 -173.389 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.9 pp -64.43 -39.72 94.38 Favored 'General case' 0 N--CA 1.456 -0.148 0 O-C-N 121.726 -0.609 . . . . 1.0 110.242 175.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 63.2 t60 -61.15 -40.68 94.76 Favored 'General case' 0 CA--C 1.534 0.332 0 O-C-N 121.905 -0.497 . . . . 1.0 111.298 178.363 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 59.6 mttm -61.54 -52.89 62.58 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.24 -0.652 . . . . 1.0 109.24 171.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 56.6 tp -49.28 -53.86 19.75 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.144 0.577 . . . . 1.0 111.379 -178.523 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -63.85 -11.77 30.35 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 113.174 0.805 . . . . 1.0 113.174 -179.076 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 25.0 p -120.2 22.44 11.38 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.104 0.962 . . . . 1.0 111.199 173.672 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.19 150.96 96.38 Favored Pre-proline 0 CA--C 1.536 0.415 0 O-C-N 121.415 -0.803 . . . . 1.0 111.074 -175.46 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -61.51 144.49 97.95 Favored 'Trans proline' 0 N--CA 1.452 -0.927 0 N-CA-C 108.201 -1.5 . . . . 1.0 108.201 165.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 39.1 ttm180 -68.12 75.9 0.23 Allowed 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.002 0.921 . . . . 1.0 111.005 -171.386 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 18.9 m -74.27 -29.3 61.6 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.676 1.191 . . . . 1.0 110.082 -174.523 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 12.1 t-20 61.06 27.4 17.25 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.28 1.032 . . . . 1.0 112.779 172.169 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -62.38 115.49 4.25 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 124.017 0.927 . . . . 1.0 108.632 170.55 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 164.59 -53.21 0.28 Allowed Glycine 0 CA--C 1.522 0.489 0 N-CA-C 108.17 -1.972 . . . . 1.0 108.17 -174.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 5.3 m 59.72 32.58 21.51 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 112.884 0.698 . . . . 1.0 112.884 162.369 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 159.67 -77.42 0.18 Allowed Glycine 0 C--N 1.335 0.499 0 N-CA-C 107.087 -2.405 . . . . 1.0 107.087 179.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 1.2 p -69.37 159.04 85.15 Favored Pre-proline 0 N--CA 1.449 -0.522 0 N-CA-C 108.499 -0.926 . . . . 1.0 108.499 161.118 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -66.52 149.37 84.38 Favored 'Trans proline' 0 N--CA 1.453 -0.863 0 C-N-CA 122.062 1.841 . . . . 1.0 109.743 171.59 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.338 0.103 0 O-C-N 121.825 -0.547 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' CSU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.7 t -77.25 61.61 2.15 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-O 122.168 0.985 . . . . 1.0 108.806 177.299 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 67.3 m-20 -86.32 56.84 4.17 Favored 'General case' 0 CA--C 1.528 0.131 0 C-N-CA 123.689 0.796 . . . . 1.0 109.422 -165.396 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -54.75 -45.87 74.24 Favored 'General case' 0 C--O 1.227 -0.085 0 C-N-CA 123.677 0.791 . . . . 1.0 111.962 -170.025 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 23.0 t -56.99 -59.29 5.28 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 109.842 -0.429 . . . . 1.0 109.842 -179.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 4.2 m -51.21 -49.38 61.16 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 124.034 0.933 . . . . 1.0 110.819 177.608 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' CSU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 4.6 p -65.24 -43.04 95.36 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.284 0 O-C-N 122.115 -0.365 . . . . 1.0 110.428 -175.316 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 65.0 mt -56.52 -50.42 71.87 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 118.582 0.628 . . . . 1.0 110.145 174.734 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -57.61 -45.61 93.03 Favored Glycine 0 CA--C 1.528 0.882 0 C-N-CA 124.238 0.923 . . . . 1.0 112.179 179.702 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.7 ptmm? -64.12 -54.59 31.56 Favored 'General case' 0 C--O 1.223 -0.322 0 N-CA-C 108.87 -0.789 . . . . 1.0 108.87 177.207 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 68.2 mt -52.14 -48.97 64.6 Favored 'General case' 0 C--O 1.227 -0.105 0 C-N-CA 123.131 0.573 . . . . 1.0 110.613 -175.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 23.2 t -51.86 -56.44 13.99 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 121.227 0.537 . . . . 1.0 111.078 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -65.69 -48.06 73.32 Favored 'General case' 0 CA--C 1.531 0.227 0 O-C-N 121.716 -0.615 . . . . 1.0 110.57 -177.339 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -55.16 -55.58 29.54 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 127.089 2.156 . . . . 1.0 110.319 -177.054 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.7 pp -62.53 -42.2 99.37 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 118.562 0.619 . . . . 1.0 110.326 178.72 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -57.54 -38.7 75.15 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-O 118.85 -0.595 . . . . 1.0 110.676 177.442 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 14.2 mttt -66.97 -54.8 18.35 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 118.373 0.533 . . . . 1.0 110.051 173.342 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 58.3 tp -51.08 -40.02 57.4 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 126.069 1.748 . . . . 1.0 111.787 -171.759 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 16.9 pt20 -65.99 -54.69 22.97 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 120.893 -0.323 . . . . 1.0 111.03 174.022 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 6.2 p -64.42 -24.94 67.8 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 113.363 0.875 . . . . 1.0 113.363 -176.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 2.1 m-30 -54.36 160.65 2.42 Favored Pre-proline 0 CA--C 1.542 0.662 0 C-N-CA 123.832 0.853 . . . . 1.0 112.153 -178.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 79.6 Cg_endo -68.46 -174.69 0.72 Allowed 'Trans proline' 0 N--CA 1.454 -0.835 0 C-N-CA 123.469 2.779 . . . . 1.0 110.396 173.086 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -157.52 149.45 22.3 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 107.057 -1.46 . . . . 1.0 107.057 178.55 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 9.1 p -83.65 -61.7 1.77 Allowed 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 124.864 1.265 . . . . 1.0 108.838 -178.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 50.4 m-20 113.31 74.74 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 130.261 3.424 . . . . 1.0 108.976 179.462 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 2.9 m -66.84 71.68 0.09 Allowed 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.146 1.378 . . . . 1.0 109.651 173.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 74.53 -65.82 2.05 Favored Glycine 0 CA--C 1.529 0.952 0 N-CA-C 110.215 -1.154 . . . . 1.0 110.215 -171.268 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 24.1 p -84.8 -70.68 0.56 Allowed 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 123.936 0.894 . . . . 1.0 110.607 -178.218 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 78.59 34.55 35.07 Favored Glycine 0 CA--C 1.527 0.831 0 N-CA-C 111.373 -0.691 . . . . 1.0 111.373 -171.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -61.54 148.32 86.58 Favored Pre-proline 0 N--CA 1.448 -0.569 0 O-C-N 121.868 -0.783 . . . . 1.0 110.048 174.308 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -67.83 153.31 75.98 Favored 'Trans proline' 0 N--CA 1.452 -0.952 0 C-N-CA 122.294 1.996 . . . . 1.0 109.761 174.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.338 0.077 0 O-C-N 121.838 -0.539 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' CSU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.5 m -72.29 -40.51 67.49 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.994 0.918 . . . . 1.0 109.439 167.043 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 5.1 m-80 74.65 101.77 0.07 Allowed 'General case' 0 C--N 1.341 0.21 0 C-N-CA 126.305 1.842 . . . . 1.0 109.998 172.655 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -47.54 -45.75 27.1 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 124.033 0.933 . . . . 1.0 112.319 -174.027 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 30.1 t -54.51 -60.82 2.84 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 120.933 0.397 . . . . 1.0 110.497 177.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 3.8 m -53.05 -48.41 67.67 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 123.713 0.805 . . . . 1.0 110.788 179.054 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' CSU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 4.1 p -66.89 -41.59 87.84 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.21 0 O-C-N 122.026 -0.421 . . . . 1.0 110.436 -174.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 75.0 mt -59.09 -49.34 78.26 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 118.389 0.541 . . . . 1.0 110.155 175.19 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -52.85 -55.13 25.0 Favored Glycine 0 CA--C 1.526 0.723 0 N-CA-C 110.615 -0.994 . . . . 1.0 110.615 176.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 24.3 mttt -50.05 -67.74 0.23 Allowed 'General case' 0 C--O 1.222 -0.39 0 CA-C-O 118.948 -0.548 . . . . 1.0 110.104 174.534 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 81.0 mt -48.45 -48.82 37.29 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 118.304 0.502 . . . . 1.0 110.539 -174.142 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 29.1 t -51.11 -63.24 1.19 Allowed 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 122.791 0.437 . . . . 1.0 111.023 176.304 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 66.9 mt-30 -64.12 -50.64 67.44 Favored 'General case' 0 CA--C 1.532 0.279 0 O-C-N 121.589 -0.694 . . . . 1.0 111.15 -174.486 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 15.2 tt0 -56.61 -52.62 64.16 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 127.191 2.196 . . . . 1.0 109.786 -176.052 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 83.5 mt -65.2 -43.42 91.67 Favored 'General case' 0 CA--C 1.532 0.267 0 O-C-N 121.586 -0.696 . . . . 1.0 110.746 176.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -56.64 -40.19 75.01 Favored 'General case' 0 C--N 1.341 0.198 0 O-C-N 121.853 -0.53 . . . . 1.0 110.733 177.511 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -65.1 -54.14 34.49 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 109.312 -0.625 . . . . 1.0 109.312 174.469 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 62.1 tp -46.37 -53.36 11.08 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 124.09 0.956 . . . . 1.0 111.493 -178.085 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 15.5 pt20 -61.5 -24.33 66.52 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 113.026 0.75 . . . . 1.0 113.026 -176.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 13.2 p -96.42 1.88 52.1 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.382 0.673 . . . . 1.0 112.294 175.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 24.1 t80 -74.31 143.08 79.29 Favored Pre-proline 0 CA--C 1.536 0.425 0 O-C-N 121.359 -0.838 . . . . 1.0 110.684 -170.08 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -65.76 91.03 0.24 Allowed 'Trans proline' 0 N--CA 1.454 -0.803 0 C-N-CA 122.6 2.2 . . . . 1.0 110.64 176.227 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 61.8 ttp180 -66.41 75.95 0.1 Allowed 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 125.284 1.434 . . . . 1.0 110.776 176.282 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 2.0 p -62.74 -36.92 84.61 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 125.214 1.406 . . . . 1.0 112.808 -179.588 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -82.44 63.35 6.56 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 123.346 0.659 . . . . 1.0 111.379 -163.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 9.6 m -69.28 69.88 0.23 Allowed 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 127.09 2.156 . . . . 1.0 111.504 -177.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -171.21 49.67 0.19 Allowed Glycine 0 CA--C 1.522 0.488 0 N-CA-C 108.077 -2.009 . . . . 1.0 108.077 176.202 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.6 t 54.88 47.46 22.22 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.231 1.012 . . . . 1.0 110.19 -173.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 70.41 57.14 6.93 Favored Glycine 0 CA--C 1.525 0.712 0 N-CA-C 109.514 -1.434 . . . . 1.0 109.514 -174.648 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -45.59 125.79 6.29 Favored Pre-proline 0 CA--C 1.536 0.435 0 C-N-CA 124.653 1.181 . . . . 1.0 111.096 -179.632 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -68.82 158.67 56.91 Favored 'Trans proline' 0 N--CA 1.454 -0.794 0 C-N-CA 122.051 1.834 . . . . 1.0 110.049 176.688 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.338 0.086 0 O-C-N 121.849 -0.532 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' CSU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.1 m 63.85 174.32 0.17 Allowed 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.835 1.254 . . . . 1.0 112.037 -173.452 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 34.7 t30 67.2 130.37 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 126.182 1.793 . . . . 1.0 114.003 177.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -58.86 -53.17 61.36 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 123.548 0.739 . . . . 1.0 110.726 -177.022 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -58.24 -54.05 51.37 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 118.339 0.518 . . . . 1.0 109.882 -176.557 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 20.9 m -52.88 -53.28 51.35 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.247 0.619 . . . . 1.0 110.703 177.487 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' CSU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 4.0 p -66.26 -42.1 90.29 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.157 0 CA-C-O 119.438 -0.315 . . . . 1.0 110.652 -174.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 77.7 mt -60.08 -46.69 88.74 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-N 118.651 0.66 . . . . 1.0 110.089 175.766 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -52.87 -57.35 14.71 Favored Glycine 0 CA--C 1.527 0.821 0 N-CA-C 110.657 -0.977 . . . . 1.0 110.657 175.513 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 66.2 mttt -49.69 -63.15 1.2 Allowed 'General case' 0 C--O 1.223 -0.326 0 CA-C-O 119.17 -0.443 . . . . 1.0 110.328 175.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 74.4 mt -49.77 -49.15 49.45 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.044 0.538 . . . . 1.0 110.54 -176.019 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 22.9 t -54.97 -58.0 9.41 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 122.986 0.514 . . . . 1.0 111.295 178.651 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -62.7 -45.03 94.67 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 121.377 0.608 . . . . 1.0 110.652 -175.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -63.4 -49.37 74.08 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 125.962 1.705 . . . . 1.0 110.052 -176.593 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.6 pp -68.19 -34.7 76.77 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 118.776 0.716 . . . . 1.0 111.072 177.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -58.79 -46.01 88.54 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 121.553 -0.717 . . . . 1.0 109.91 172.394 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 18.5 mttt -58.83 -59.23 5.76 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 118.241 0.473 . . . . 1.0 110.027 174.012 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 57.6 tp -49.09 -45.35 43.12 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.326 1.05 . . . . 1.0 110.805 -174.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 34.5 mt-30 -53.31 -57.19 11.41 Favored 'General case' 0 CA--C 1.532 0.281 0 O-C-N 121.894 -0.504 . . . . 1.0 111.341 175.129 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 11.9 t -79.97 -11.92 59.75 Favored 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 113.711 1.004 . . . . 1.0 113.711 -172.673 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 3.7 m-30 -55.32 151.67 18.38 Favored Pre-proline 0 CA--C 1.541 0.617 0 CA-C-N 119.253 0.933 . . . . 1.0 111.014 176.521 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -70.3 78.05 1.22 Allowed 'Trans proline' 0 N--CA 1.458 -0.598 0 C-N-CA 124.026 3.151 . . . . 1.0 111.613 -173.3 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 22.0 ttm105 -71.85 66.67 0.57 Allowed 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 125.985 1.714 . . . . 1.0 110.14 177.406 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 29.1 p -91.78 -78.64 0.4 Allowed 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 124.205 1.002 . . . . 1.0 108.566 178.309 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 44.9 t30 -70.1 82.26 0.51 Allowed 'General case' 0 C--N 1.339 0.123 0 CA-C-O 123.05 1.405 . . . . 1.0 110.929 -174.725 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 1.2 p -90.64 6.47 43.73 Favored 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 126.291 1.836 . . . . 1.0 110.514 171.284 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -82.03 55.6 4.92 Favored Glycine 0 CA--C 1.531 1.046 0 N-CA-C 111.088 -0.805 . . . . 1.0 111.088 -171.253 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.4 t 59.07 25.94 14.51 Favored 'General case' 0 C--O 1.247 0.959 0 C-N-CA 123.913 0.885 . . . . 1.0 111.304 -179.438 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -84.29 85.27 1.56 Allowed Glycine 0 C--N 1.352 1.434 0 CA-C-O 118.944 -0.92 . . . . 1.0 110.871 -172.629 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 7.3 m 98.22 134.23 0.02 OUTLIER Pre-proline 0 N--CA 1.468 0.473 0 C-N-CA 127.85 2.46 . . . . 1.0 109.002 179.395 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 61.8 Cg_endo -63.43 143.22 87.88 Favored 'Trans proline' 0 N--CA 1.46 -0.462 0 C-N-CA 121.803 1.668 . . . . 1.0 110.152 174.807 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.338 0.071 0 O-C-N 121.835 -0.54 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' CSU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.8 p -78.65 42.17 0.43 Allowed 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.404 1.482 . . . . 1.0 111.566 -173.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 26.7 m120 -104.06 77.22 1.41 Allowed 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.317 1.047 . . . . 1.0 108.363 -171.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -48.03 -46.27 32.95 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.714 0.806 . . . . 1.0 111.714 -175.177 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.0 m -51.54 -55.74 17.34 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.115 0.966 . . . . 1.0 111.312 175.785 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 5.8 m -58.54 -45.77 88.2 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 123.297 0.639 . . . . 1.0 110.022 178.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' CSU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 9.8 p -64.8 -42.52 95.13 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 O-C-N 121.957 -0.464 . . . . 1.0 110.804 -177.007 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 67.8 mt -58.1 -49.56 76.51 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 118.989 0.813 . . . . 1.0 110.598 176.324 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -56.07 -51.21 57.12 Favored Glycine 0 CA--C 1.527 0.786 0 N-CA-C 110.804 -0.918 . . . . 1.0 110.804 177.248 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 46.1 tttm -54.43 -56.69 16.12 Favored 'General case' 0 C--O 1.222 -0.35 0 C-N-CA 123.02 0.528 . . . . 1.0 109.584 178.37 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 76.5 mt -54.16 -48.08 71.26 Favored 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 123.277 0.631 . . . . 1.0 110.687 -179.523 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 25.0 t -53.23 -53.6 48.37 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.027 0.531 . . . . 1.0 110.374 178.023 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 56.3 mm-40 -54.56 -56.72 16.01 Favored 'General case' 0 CA--C 1.531 0.237 0 O-C-N 122.083 -0.386 . . . . 1.0 110.529 175.109 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -52.31 -56.26 15.97 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 125.087 1.355 . . . . 1.0 110.509 -174.546 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.3 pp -64.8 -41.56 95.72 Favored 'General case' 0 N--CA 1.455 -0.208 0 O-C-N 122.321 -0.237 . . . . 1.0 110.464 -178.034 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -62.56 -36.48 82.79 Favored 'General case' 0 CA--C 1.532 0.271 0 O-C-N 121.963 -0.461 . . . . 1.0 110.848 179.476 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.08 -62.13 1.73 Allowed 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 108.836 -0.801 . . . . 1.0 108.836 170.77 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 59.0 tp -44.3 -50.81 8.83 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 125.171 1.389 . . . . 1.0 112.396 -176.357 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 14.3 pt20 -64.42 -22.39 66.94 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 112.926 0.713 . . . . 1.0 112.926 -177.506 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 82.4 p -97.1 -22.94 16.48 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 123.843 0.857 . . . . 1.0 111.964 176.448 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 8.5 m-30 -59.18 155.78 32.4 Favored Pre-proline 0 CA--C 1.535 0.389 0 C-N-CA 123.004 0.522 . . . . 1.0 110.358 175.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -67.14 -179.05 1.6 Allowed 'Trans proline' 0 N--CA 1.452 -0.927 0 C-N-CA 122.535 2.156 . . . . 1.0 110.905 177.007 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -55.2 78.2 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 126.283 1.833 . . . . 1.0 112.357 178.328 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 96.1 m -69.65 -55.8 9.02 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 124.936 1.295 . . . . 1.0 109.678 -173.061 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.9 t30 -155.26 63.14 0.62 Allowed 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 122.181 0.991 . . . . 1.0 108.783 172.068 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 2.6 m -69.37 82.33 0.38 Allowed 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 124.079 0.951 . . . . 1.0 110.502 -176.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 81.13 -45.53 3.22 Favored Glycine 0 CA--C 1.529 0.934 0 O-C-N 121.605 -0.684 . . . . 1.0 112.255 173.236 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 22.6 p 54.14 59.76 4.02 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.68 1.192 . . . . 1.0 111.506 176.786 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -157.91 -98.59 0.14 Allowed Glycine 0 CA--C 1.526 0.727 0 N-CA-C 110.063 -1.215 . . . . 1.0 110.063 176.004 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.9 t -163.25 152.5 12.54 Favored Pre-proline 0 N--CA 1.454 -0.242 0 N-CA-C 107.089 -1.449 . . . . 1.0 107.089 -178.162 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 77.7 Cg_endo -63.82 163.7 24.07 Favored 'Trans proline' 0 N--CA 1.453 -0.892 0 C-N-CA 121.153 1.236 . . . . 1.0 109.065 160.369 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.338 0.07 0 O-C-N 121.834 -0.541 . . . . 1.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' CSU . . . . . 0.404 ' C ' ' H ' ' A' ' 3' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.1 t -74.81 34.0 0.1 Allowed 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.89 0.876 . . . . 1.0 111.922 179.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.404 ' H ' ' C ' ' A' ' 1' ' ' CSU . 20.8 m120 -85.71 71.25 10.72 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 107.624 -1.25 . . . . 1.0 107.624 -172.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -47.43 -42.1 21.64 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.118 0.967 . . . . 1.0 112.506 -171.367 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 33.5 t -54.81 -53.53 54.08 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 123.069 0.548 . . . . 1.0 111.044 175.069 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.6 m -57.3 -47.29 81.88 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 122.983 0.513 . . . . 1.0 109.947 176.452 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' CSU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 6.3 p -64.6 -39.61 86.19 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 CA-C-O 119.241 -0.409 . . . . 1.0 110.92 -177.011 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 57.2 mt -58.47 -48.5 80.54 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 118.983 0.81 . . . . 1.0 110.644 174.338 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -54.77 -54.73 31.4 Favored Glycine 0 CA--C 1.528 0.884 0 N-CA-C 110.597 -1.001 . . . . 1.0 110.597 177.183 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 19.9 tttp -47.77 -62.66 1.34 Allowed 'General case' 0 C--O 1.223 -0.34 0 C-N-CA 123.577 0.751 . . . . 1.0 109.697 174.09 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 63.6 mt -52.29 -48.17 65.5 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 123.073 0.549 . . . . 1.0 110.759 -176.099 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 23.0 t -53.47 -59.74 4.19 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 117.959 0.345 . . . . 1.0 110.661 178.677 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 94.1 mt-30 -61.72 -51.94 66.33 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-O 121.001 0.429 . . . . 1.0 110.669 -176.359 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -55.55 -55.86 26.96 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 127.112 2.165 . . . . 1.0 110.69 -177.117 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 86.7 mt -63.55 -43.6 96.59 Favored 'General case' 0 N--CA 1.455 -0.177 0 O-C-N 121.934 -0.479 . . . . 1.0 110.132 179.451 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 37.7 t60 -57.97 -41.85 83.8 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 122.065 -0.397 . . . . 1.0 111.226 177.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 59.6 tttm -65.82 -44.96 84.04 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 123.779 0.832 . . . . 1.0 109.918 176.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 63.2 tp -56.24 -53.74 53.65 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 123.822 0.849 . . . . 1.0 110.625 179.691 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 -57.11 -33.48 67.37 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 118.407 0.549 . . . . 1.0 112.047 -178.159 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 15.7 p -80.02 -14.35 58.63 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 113.165 0.802 . . . . 1.0 113.165 177.642 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -70.8 152.84 95.07 Favored Pre-proline 0 CA--C 1.536 0.415 0 CA-C-N 119.409 1.004 . . . . 1.0 111.127 -175.117 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -67.6 88.88 0.34 Allowed 'Trans proline' 0 N--CA 1.453 -0.896 0 C-N-CA 122.83 2.353 . . . . 1.0 109.778 175.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -36.4 -44.75 0.44 Allowed 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 126.768 2.027 . . . . 1.0 112.614 179.03 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 2.4 p -55.08 -28.25 51.08 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 126.602 1.961 . . . . 1.0 113.628 -177.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 33.4 t30 -43.26 101.8 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 125.68 1.592 . . . . 1.0 113.33 -173.568 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . 0.258 0.4 OUTLIER 69.77 -57.99 0.54 Allowed 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 126.846 2.058 . . . . 1.0 112.899 172.442 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -77.86 59.52 3.84 Favored Glycine 0 CA--C 1.524 0.636 0 N-CA-C 110.895 -0.882 . . . . 1.0 110.895 -177.178 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 11.5 p -60.19 -67.58 0.38 Allowed 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 108.397 -0.964 . . . . 1.0 108.397 175.437 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 165.95 76.9 0.03 OUTLIER Glycine 0 CA--C 1.528 0.846 0 C-N-CA 127.466 2.46 . . . . 1.0 107.493 -178.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 9.3 t -155.4 146.3 16.4 Favored Pre-proline 0 CA--C 1.532 0.287 0 N-CA-C 107.868 -1.16 . . . . 1.0 107.868 -171.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -65.7 81.62 0.24 Allowed 'Trans proline' 0 N--CA 1.454 -0.801 0 C-N-CA 122.276 1.984 . . . . 1.0 109.558 178.349 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.338 0.071 0 O-C-N 121.844 -0.535 . . . . 1.0 . . . . . . . . . . 0 0 . 1 stop_ save_