data_1bla_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 1bla _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 full ' A' A ' 1' ' ' MET . . . . . 0.587 ' SD ' ' N ' ' A' ' 2' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.558 0 N-CA-C 109.475 -0.565 . . . . 8.5 109.475 . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . 0.587 ' N ' ' SD ' ' A' ' 1' ' ' MET . . . -59.5 111.31 1.35 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.211 -0.93 . . . . 4.6799999999999997 109.469 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -65.75 148.19 52.17 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.196 -0.94 . . . . 4.79 109.461 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 67.24 -176.55 22.57 Favored Glycine 0 N--CA 1.49 2.252 0 N-CA-C 109.519 -1.432 . . . . 2.2400000000000002 109.519 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -84.9 -101.98 0.06 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.246 -1.149 . . . . 3.5600000000000001 109.506 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.414 ' O ' ' O ' ' A' ' 7' ' ' THR . 2.3 mp -87.38 60.74 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 O-C-N 121.254 -0.904 . . . . 3.3599999999999999 109.484 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.414 ' O ' ' O ' ' A' ' 6' ' ' ILE . 11.0 p 49.19 -175.1 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.233 -0.917 . . . . 4.2000000000000002 109.523 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.453 ' O ' ' O ' ' A' ' 9' ' ' LEU . 51.6 m -166.45 -79.01 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.233 -0.917 . . . . 5.3899999999999997 109.532 -179.935 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.453 ' O ' ' O ' ' A' ' 8' ' ' THR . 9.6 mt 60.47 148.9 0.08 OUTLIER Pre-proline 0 N--CA 1.494 1.754 0 N-CA-C 109.058 -0.719 . . . . 5.2199999999999998 109.058 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -55.77 132.39 51.79 Favored 'Trans proline' 0 C--N 1.324 -0.76 0 C-N-CA 121.021 1.147 . . . . 3.7200000000000002 110.285 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -149.9 -172.37 4.14 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.336 -0.853 . . . . 4.1900000000000004 109.446 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.411 ' O ' ' OD1' ' A' ' 15' ' ' ASP . 4.8 tp -162.45 68.92 2.07 Favored Pre-proline 0 N--CA 1.491 1.6 0 O-C-N 121.324 -0.86 . . . . 4.7999999999999998 109.639 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -63.18 148.64 92.96 Favored 'Trans proline' 0 C--N 1.313 -1.34 0 C-N-CA 121.77 1.646 . . . . 3.3599999999999999 110.225 -179.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 55.15 86.63 0.05 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.263 -0.898 . . . . 4.6900000000000004 109.527 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.505 ' OD1' ' N ' ' A' ' 15' ' ' ASP . 2.0 m-20 -91.17 11.39 23.46 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.232 -0.918 . . . . 5.3399999999999999 109.349 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -87.47 60.9 4.25 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.532 -1.427 . . . . 4.1299999999999999 109.532 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -91.8 58.13 2.93 Favored Glycine 0 N--CA 1.491 2.307 0 N-CA-C 109.48 -1.448 . . . . 3.6800000000000002 109.48 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 50.6 m -91.73 57.57 3.26 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.225 -1.161 . . . . 5.0099999999999998 109.499 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 167.89 -92.64 0.1 Allowed Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.529 -1.428 . . . . 4.3700000000000001 109.529 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -152.86 -99.63 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.198 -1.178 . . . . 4.2300000000000004 109.426 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.4 ' CD1' ' N ' ' A' ' 21' ' ' PHE . 1.1 p90 -154.56 70.54 6.02 Favored Pre-proline 0 N--CA 1.491 1.616 0 O-C-N 121.222 -0.924 . . . . 2.7200000000000002 109.404 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -63.37 168.37 11.34 Favored 'Trans proline' 0 C--N 1.313 -1.334 0 C-N-CA 121.769 1.646 . . . . 2.5899999999999999 109.786 -179.646 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -56.52 119.76 7.18 Favored 'Trans proline' 0 C--N 1.315 -1.235 0 C-N-CA 121.602 1.535 . . . . 2.6600000000000001 110.217 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 160.14 7.15 0.05 OUTLIER Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.5 -1.44 . . . . 2.3100000000000001 109.5 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 -137.35 -1.83 2.07 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.528 -0.983 . . . . 2.8999999999999999 109.702 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -96.05 24.2 5.79 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.278 -0.889 . . . . 1.4099999999999999 109.43 179.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 12.3 mttt -94.58 -25.33 16.85 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.304 -0.872 . . . . 4.3499999999999996 109.613 -179.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -114.81 152.56 46.51 Favored Pre-proline 0 N--CA 1.495 1.783 0 N-CA-C 109.003 -0.74 . . . . 1.6000000000000001 109.003 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -56.97 170.66 1.37 Allowed 'Trans proline' 0 C--N 1.323 -0.77 0 C-N-CA 121.146 1.23 . . . . 0.56999999999999995 110.182 179.479 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 76.7 mttt -143.89 128.98 18.64 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.397 -0.814 . . . . 2.25 109.394 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.407 HH11 ' HG3' ' A' ' 31' ' ' ARG . 20.6 mtm-85 -87.32 120.29 28.46 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.213 -0.929 . . . . 3.8199999999999998 109.301 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 13.3 mt -84.67 101.0 11.83 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.183 -0.948 . . . . 1.1100000000000001 109.474 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 37.1 t80 -96.04 120.02 35.58 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.376 -0.828 . . . . 2.1200000000000001 109.488 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 23.0 t -85.27 126.27 33.57 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.272 -0.892 . . . . 0.94999999999999996 109.272 179.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.0 tmtp? -73.91 -17.9 60.97 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.261 -0.899 . . . . 2.3999999999999999 109.709 -179.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . 0.424 ' ND2' ' O ' ' A' ' 144' ' ' LYS . 1.8 m-80 -85.62 105.02 15.88 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.148 -0.97 . . . . 2.0600000000000001 109.626 -179.898 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.511 ' O ' ' CE2' ' A' ' 39' ' ' PHE . . . 80.52 4.88 90.12 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.625 -1.39 . . . . 0.39000000000000001 109.625 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 47.38 85.87 0.01 OUTLIER Glycine 0 N--CA 1.49 2.253 0 N-CA-C 109.607 -1.397 . . . . 0.52000000000000002 109.607 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.511 ' CE2' ' O ' ' A' ' 37' ' ' GLY . 46.9 m-85 -143.71 132.73 22.87 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.413 -1.051 . . . . 0.54000000000000004 109.596 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 48.8 m-85 -94.68 130.43 41.18 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.344 -0.848 . . . . 1.1599999999999999 109.317 179.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 48.9 tp -59.43 144.93 45.54 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.182 -0.949 . . . . 1.1299999999999999 109.358 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.471 ' NH1' ' CG ' ' A' ' 57' ' ' ASP . 32.9 ttt180 -149.2 115.0 5.66 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.278 -0.889 . . . . 2.1299999999999999 109.487 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 84.2 mt -89.87 118.38 35.04 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 121.224 -0.923 . . . . 1.1200000000000001 109.293 179.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . 0.412 ' CD2' ' OD1' ' A' ' 50' ' ' ASP . 57.0 m-70 -79.77 152.28 74.69 Favored Pre-proline 0 N--CA 1.489 1.524 0 O-C-N 121.287 -0.883 . . . . 0.66000000000000003 109.055 -179.758 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.479 ' O ' ' NH1' ' A' ' 81' ' ' ARG . 3.3 Cg_exo -56.9 -29.2 81.03 Favored 'Trans proline' 0 C--N 1.322 -0.845 0 C-N-CA 121.181 1.254 . . . . 0.46999999999999997 110.359 179.644 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 52.7 p-10 -74.95 -0.28 18.18 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.249 -0.907 . . . . 1.24 109.532 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 92.67 -30.9 6.51 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.531 -1.427 . . . . 0.60999999999999999 109.531 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . 0.589 ' CG ' HH11 ' A' ' 48' ' ' ARG . 0.0 OUTLIER -48.37 115.36 1.19 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.222 -1.163 . . . . 4.1399999999999997 109.391 179.989 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 67.1 t -91.26 132.57 35.4 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.265 -0.897 . . . . 1.1899999999999999 109.469 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.412 ' OD1' ' CD2' ' A' ' 44' ' ' HIS . 3.3 p-10 -159.71 149.16 18.13 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.163 -0.961 . . . . 1.22 109.509 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -93.37 159.32 24.11 Favored Glycine 0 N--CA 1.492 2.368 0 N-CA-C 109.516 -1.434 . . . . 0.76000000000000001 109.516 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 32.9 m -148.66 154.21 10.3 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.263 -1.139 . . . . 1.1799999999999999 109.488 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -91.93 -0.05 57.49 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.233 -0.917 . . . . 3.3300000000000001 109.421 179.877 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -83.63 94.24 8.06 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.316 -0.865 . . . . 2.3300000000000001 109.485 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 19.7 pttt -73.55 -5.09 38.04 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.148 -0.97 . . . . 2.5899999999999999 109.397 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 6.6 p -89.18 23.33 2.49 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.292 -0.88 . . . . 1.98 109.249 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . 0.515 ' C ' ' H ' ' A' ' 59' ' ' HIS . 2.9 m-20 -105.12 105.59 52.33 Favored Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 121.6 -0.687 . . . . 1.46 109.207 -179.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -61.53 2.44 0.53 Allowed 'Trans proline' 0 C--O 1.215 -0.658 0 C-N-CA 120.807 1.005 . . . . 1.1299999999999999 110.273 -179.564 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . 0.515 ' H ' ' C ' ' A' ' 57' ' ' ASP . 38.5 m80 -85.24 -13.54 49.52 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.242 -0.911 . . . . 0.64000000000000001 109.304 179.739 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 1.6 pt -83.71 -2.7 7.05 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 O-C-N 121.259 -0.901 . . . . 1.22 109.461 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 27.0 mtpt -76.35 86.54 3.13 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.233 -0.917 . . . . 2.3500000000000001 109.472 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 11.3 mt -89.99 134.95 33.94 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.245 -0.909 . . . . 1.0700000000000001 109.468 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 38.2 tt0 -92.01 112.34 24.23 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.253 -0.904 . . . . 2.5600000000000001 109.431 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.422 ' N ' ' CD1' ' A' ' 64' ' ' LEU . 10.7 mp -92.63 154.18 18.54 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.251 -0.905 . . . . 1.1200000000000001 109.53 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -143.0 123.69 14.13 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.438 -0.789 . . . . 2.5699999999999998 109.358 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -79.82 120.77 24.54 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.191 -0.943 . . . . 1.2 109.455 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -97.17 -86.51 0.33 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.413 -0.804 . . . . 2.1800000000000002 109.443 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -92.46 -163.36 1.03 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.241 -0.912 . . . . 2.3399999999999999 109.404 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 30.8 mtt180 -81.83 111.41 18.03 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.224 -0.922 . . . . 5.0099999999999998 109.462 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 93.07 -19.24 53.46 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.489 -1.444 . . . . 1.0900000000000001 109.489 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 41.0 t -89.96 139.62 17.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.304 -1.115 . . . . 1.28 109.502 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 23.0 m -142.2 126.38 15.94 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.397 -0.814 . . . . 1.3200000000000001 109.593 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 5.3 m -93.26 123.37 36.49 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.287 -0.883 . . . . 1.1699999999999999 109.364 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 67.2 mt -91.39 148.86 4.32 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.513 0 O-C-N 121.271 -0.893 . . . . 1.27 109.517 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 79.8 tttt -147.21 146.76 29.94 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.22 -0.925 . . . . 2.0699999999999998 109.482 179.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -93.68 137.89 13.8 Favored Glycine 0 N--CA 1.49 2.299 0 N-CA-C 109.549 -1.421 . . . . 0.32000000000000001 109.549 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 59.5 t -79.0 -64.81 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 121.258 -1.142 . . . . 1.24 109.447 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 44.4 t -71.45 -33.17 69.11 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.252 -0.905 . . . . 1.8300000000000001 109.483 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -77.88 -25.76 48.8 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.184 -0.947 . . . . 1.05 109.386 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 93.1 m-20 51.06 50.07 19.87 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.229 -0.919 . . . . 1.98 109.575 179.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.479 ' NH1' ' O ' ' A' ' 45' ' ' PRO . 69.4 mtt180 -147.36 148.29 31.19 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.3 -0.875 . . . . 2.6200000000000001 109.416 179.883 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 88.9 m-85 -92.92 132.36 37.11 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.274 -0.891 . . . . 1.01 109.589 -179.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 37.3 tp -60.73 147.34 42.67 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.255 -0.903 . . . . 1.1000000000000001 109.234 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -149.83 131.63 15.08 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.228 -0.92 . . . . 1.1000000000000001 109.515 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 37.0 ttm -97.58 125.45 42.32 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.338 -0.851 . . . . 1.3400000000000001 109.499 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 27.9 mmtt -71.18 -173.22 0.82 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.182 -0.949 . . . . 2.5800000000000001 109.51 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -92.61 -24.5 18.67 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.298 -0.876 . . . . 2.3500000000000001 109.518 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . 0.521 ' N ' ' OD1' ' A' ' 88' ' ' ASP . 3.7 p30 -81.82 -38.96 24.72 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.301 -0.875 . . . . 1.4099999999999999 109.57 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . 0.46 ' O ' ' CD1' ' A' ' 91' ' ' LEU . . . 142.33 -5.27 2.11 Favored Glycine 0 N--CA 1.493 2.452 0 N-CA-C 109.579 -1.408 . . . . 0.59999999999999998 109.579 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 72.6 mtt180 -75.72 120.2 20.79 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.226 -1.161 . . . . 3.54 109.534 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.511 ' N ' ' CD1' ' A' ' 91' ' ' LEU . 8.8 mp -93.98 134.21 36.62 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.268 -0.895 . . . . 1.1000000000000001 109.493 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -148.25 -171.91 3.95 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.209 -0.932 . . . . 1.21 109.546 179.908 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -142.28 154.73 44.97 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.439 -0.788 . . . . 1.0900000000000001 109.463 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 5.1 m -146.26 159.96 42.63 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.358 -0.838 . . . . 1.8 109.404 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 21.4 mtmt -70.28 -30.83 67.95 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.215 -0.928 . . . . 3.0899999999999999 109.539 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 6.1 m -92.49 126.37 37.54 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.251 -0.906 . . . . 1.9399999999999999 109.58 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 4.6 p -73.82 162.37 4.47 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.279 -0.888 . . . . 1.76 109.408 179.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' THR . . . . . 0.434 ' OG1' ' SG ' ' A' ' 101' ' ' CYS . 10.2 p -145.56 -170.89 3.56 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.294 -0.879 . . . . 1.6100000000000001 109.493 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -79.25 -17.26 55.1 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.297 -0.877 . . . . 2.3399999999999999 109.463 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -91.48 6.8 44.13 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.276 -0.89 . . . . 1.8500000000000001 109.468 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . 0.434 ' SG ' ' OG1' ' A' ' 98' ' ' THR . 64.5 m -92.76 -1.86 56.46 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.288 -0.883 . . . . 1.0800000000000001 109.485 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 65.5 m-85 -89.86 158.35 17.49 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.262 -0.899 . . . . 0.72999999999999998 109.522 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -149.91 110.53 4.26 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.285 -0.884 . . . . 0.41999999999999998 109.3 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 36.4 m-85 -58.97 115.04 2.87 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.21 -0.932 . . . . 0.57999999999999996 109.492 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -88.16 143.07 27.27 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.246 -0.909 . . . . 1.6799999999999999 109.475 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.428 ' O ' ' OG1' ' A' ' 114' ' ' THR . 42.9 ttt180 -146.5 121.29 9.9 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.336 -0.852 . . . . 4.0099999999999998 109.374 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -90.59 126.94 36.11 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.248 -0.907 . . . . 1.73 109.493 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -89.04 -173.11 3.93 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.23 -0.919 . . . . 1.8300000000000001 109.452 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' SER . . . . . 0.405 ' O ' ' OD1' ' A' ' 110' ' ' ASN . 16.1 t -92.19 49.47 1.52 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.23 -0.919 . . . . 1.96 109.46 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . 0.528 ' C ' ' H ' ' A' ' 112' ' ' TYR . 63.3 m-20 -151.42 26.71 0.67 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.247 -0.908 . . . . 2.5499999999999998 109.431 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 2.5 m120 60.24 -0.04 0.27 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.352 -0.842 . . . . 1.74 109.709 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' TYR . . . . . 0.528 ' H ' ' C ' ' A' ' 110' ' ' ASN . 34.0 m-85 -95.46 138.4 33.2 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.321 -0.862 . . . . 1.05 109.458 179.877 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 12.3 m-80 -95.41 165.75 12.21 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.331 -0.856 . . . . 1.8600000000000001 109.612 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' THR . . . . . 0.428 ' OG1' ' O ' ' A' ' 106' ' ' ARG . 17.8 p -144.18 116.31 8.41 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.402 -0.811 . . . . 1.1899999999999999 109.367 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 91.8 m-85 -94.93 112.1 23.84 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.362 -0.836 . . . . 0.93000000000000005 109.623 -179.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 39.7 ttp180 -96.98 143.84 27.45 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.412 -0.805 . . . . 3.5299999999999998 109.39 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 4.5 t -68.29 155.46 39.69 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.238 -0.914 . . . . 0.92000000000000004 109.595 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.506 ' C ' ' H ' ' A' ' 120' ' ' TYR . 24.0 ttt180 -93.53 -76.28 0.48 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.261 -0.9 . . . . 3.0899999999999999 109.538 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . 0.454 ' O ' ' CD1' ' A' ' 120' ' ' TYR . 2.8 tptt -50.52 -10.55 0.06 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.25 -0.907 . . . . 2.3900000000000001 109.495 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' TYR . . . . . 0.518 ' C ' ' H ' ' A' ' 122' ' ' SER . 10.2 m-85 -142.82 63.87 1.38 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.354 -0.841 . . . . 1.02 109.429 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 36.8 p -61.36 0.84 0.24 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.287 -0.883 . . . . 1.1699999999999999 109.611 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' SER . . . . . 0.518 ' H ' ' C ' ' A' ' 120' ' ' TYR . 26.8 m -89.88 10.67 22.88 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.199 -0.938 . . . . 1.2 109.526 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' TRP . . . . . . . . . . . . . 2.3 m-90 -154.95 138.16 15.69 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.172 -0.955 . . . . 1.28 109.604 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' TYR . . . . . 0.446 ' CD1' ' N ' ' A' ' 124' ' ' TYR . 26.5 m-85 -103.13 168.29 9.28 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.529 -0.732 . . . . 1.03 109.479 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 65.6 t -90.29 128.91 41.91 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.206 -0.934 . . . . 1.1699999999999999 109.451 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -154.74 140.2 17.79 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.215 -0.928 . . . . 1.1000000000000001 109.537 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 22.0 mt -93.57 175.64 6.67 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.334 -0.854 . . . . 1.24 109.456 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 20.0 mtpt -93.15 -172.2 2.89 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.271 -0.893 . . . . 2.2799999999999998 109.459 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -92.53 -17.88 23.88 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.267 -0.895 . . . . 3.8999999999999999 109.495 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 1.8 t -89.43 5.07 46.94 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.247 -0.908 . . . . 1.3400000000000001 109.432 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 90.73 0.01 76.09 Favored Glycine 0 N--CA 1.49 2.249 0 N-CA-C 109.581 -1.408 . . . . 0.88 109.581 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 19.9 mm-40 -85.72 168.73 14.09 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.237 -1.155 . . . . 2.0800000000000001 109.453 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' TYR . . . . . 0.525 ' CG ' ' O ' ' A' ' 133' ' ' TYR . 32.6 p90 -89.12 120.24 30.34 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.291 -0.88 . . . . 1.0 109.444 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . 0.614 ' HZ2' HE22 ' A' ' 143' ' ' GLN . 14.6 tttt -69.88 134.67 48.7 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.251 -0.906 . . . . 2.21 109.444 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.44 ' C ' ' H ' ' A' ' 137' ' ' SER . 13.6 tp -56.84 139.68 50.49 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.253 -0.905 . . . . 1.1799999999999999 109.318 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -65.36 0.8 4.55 Favored Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.709 -1.356 . . . . 0.78000000000000003 109.709 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' SER . . . . . 0.44 ' H ' ' C ' ' A' ' 135' ' ' LEU . 51.8 p -93.53 -28.88 15.81 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.232 -1.157 . . . . 1.1799999999999999 109.498 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 12.4 mttp -90.02 -10.07 46.24 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.203 -0.935 . . . . 2.52 109.495 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 33.9 p -72.31 156.96 38.54 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.251 -0.906 . . . . 1.1899999999999999 109.496 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . 160.11 -179.91 35.33 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.338 -1.505 . . . . 0.40999999999999998 109.338 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -60.82 171.95 3.27 Favored 'Trans proline' 0 C--N 1.311 -1.401 0 C-N-CA 121.879 1.72 . . . . 0.63 110.206 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 83.42 -45.51 3.47 Favored Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.519 -1.432 . . . . 0.68999999999999995 109.519 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . 0.614 HE22 ' HZ2' ' A' ' 134' ' ' LYS . 5.4 mt-30 -76.07 132.73 40.27 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.201 -1.176 . . . . 2.73 109.429 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' LYS . . . . . 0.424 ' O ' ' ND2' ' A' ' 36' ' ' ASN . 36.2 mtmt -85.11 4.02 36.21 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.215 -0.928 . . . . 2.29 109.499 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -65.1 -2.39 2.8 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.23 -0.919 . . . . 1.1100000000000001 109.542 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' ILE . . . . . 0.413 ' H ' ' C ' ' A' ' 144' ' ' LYS . 22.0 pt -94.26 -6.87 10.21 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.319 -0.863 . . . . 1.24 109.502 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 55.7 mt -81.68 89.24 6.24 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.236 -0.915 . . . . 1.1000000000000001 109.458 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 42.4 m-85 -94.67 164.4 12.97 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.316 -0.865 . . . . 0.34999999999999998 109.495 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 31.8 tp -139.58 70.55 38.13 Favored Pre-proline 0 N--CA 1.492 1.667 0 O-C-N 121.472 -0.768 . . . . 1.0900000000000001 109.493 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -61.75 106.25 0.42 Allowed 'Trans proline' 0 C--N 1.312 -1.342 0 C-N-CA 121.865 1.71 . . . . 0.34000000000000002 110.344 -179.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 151' ' ' MET . . . . . . . . . . . . . 1.5 mtt -97.66 122.56 40.89 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.461 -0.774 . . . . 1.51 109.508 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 8.5 t -70.22 135.47 49.05 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.216 -0.928 . . . . 1.1799999999999999 109.445 179.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -86.11 56.85 4.16 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.251 -0.906 . . . . 1.1799999999999999 109.432 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 45.4 mttt -61.51 -81.14 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.239 -0.913 . . . . 3.0 109.526 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 4.6 m . . . . . 0 N--CA 1.49 1.547 0 CA-C-O 118.038 -0.982 . . . . 3.02 109.463 179.986 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.587 ' SD ' ' N ' ' A' ' 2' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.558 0 N-CA-C 109.475 -0.565 . . . . 8.1199999999999992 109.475 . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.587 ' N ' ' SD ' ' A' ' 1' ' ' MET . . . -59.5 111.31 1.35 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.211 -0.93 . . . . 4.25 109.469 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -65.75 148.19 52.17 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.196 -0.94 . . . . 4.79 109.461 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 67.24 -176.55 22.57 Favored Glycine 0 N--CA 1.49 2.252 0 N-CA-C 109.519 -1.432 . . . . 1.97 109.519 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -84.9 -101.98 0.06 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.246 -1.149 . . . . 3.5600000000000001 109.506 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.429 ' H ' HD12 ' A' ' 6' ' ' ILE . 2.3 mp -87.38 60.74 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 O-C-N 121.254 -0.904 . . . . 2.9399999999999999 109.484 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.414 ' O ' ' O ' ' A' ' 6' ' ' ILE . 11.0 p 49.19 -175.1 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.233 -0.917 . . . . 3.8199999999999998 109.523 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.453 ' O ' ' O ' ' A' ' 9' ' ' LEU . 51.6 m -166.45 -79.01 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.233 -0.917 . . . . 5.0700000000000003 109.532 -179.935 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.453 ' O ' ' O ' ' A' ' 8' ' ' THR . 9.6 mt 60.47 148.9 0.08 OUTLIER Pre-proline 0 N--CA 1.494 1.754 0 N-CA-C 109.058 -0.719 . . . . 4.8700000000000001 109.058 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -55.77 132.39 51.79 Favored 'Trans proline' 0 C--N 1.324 -0.76 0 C-N-CA 121.021 1.147 . . . . 3.3399999999999999 110.285 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -149.9 -172.37 4.14 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.336 -0.853 . . . . 3.7999999999999998 109.446 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.411 ' O ' ' OD1' ' A' ' 15' ' ' ASP . 4.8 tp -162.45 68.92 2.07 Favored Pre-proline 0 N--CA 1.491 1.6 0 O-C-N 121.324 -0.86 . . . . 4.4199999999999999 109.639 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -63.18 148.64 92.96 Favored 'Trans proline' 0 C--N 1.313 -1.34 0 C-N-CA 121.77 1.646 . . . . 3.0 110.225 -179.771 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 55.15 86.63 0.05 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.263 -0.898 . . . . 4.6900000000000004 109.527 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.505 ' OD1' ' N ' ' A' ' 15' ' ' ASP . 2.0 m-20 -91.17 11.39 23.46 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.232 -0.918 . . . . 5.3399999999999999 109.349 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -87.47 60.9 4.25 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.532 -1.427 . . . . 3.5699999999999998 109.532 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -91.8 58.13 2.93 Favored Glycine 0 N--CA 1.491 2.307 0 N-CA-C 109.48 -1.448 . . . . 3.6200000000000001 109.48 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 50.6 m -91.73 57.57 3.26 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.225 -1.161 . . . . 4.6500000000000004 109.499 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 167.89 -92.64 0.1 Allowed Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.529 -1.428 . . . . 4.3700000000000001 109.529 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -152.86 -99.63 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.198 -1.178 . . . . 3.8300000000000001 109.426 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.4 ' CD1' ' N ' ' A' ' 21' ' ' PHE . 1.1 p90 -154.56 70.54 6.02 Favored Pre-proline 0 N--CA 1.491 1.616 0 O-C-N 121.222 -0.924 . . . . 2.0899999999999999 109.404 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -63.37 168.37 11.34 Favored 'Trans proline' 0 C--N 1.313 -1.334 0 C-N-CA 121.769 1.646 . . . . 2.29 109.786 -179.646 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -56.52 119.76 7.18 Favored 'Trans proline' 0 C--N 1.315 -1.235 0 C-N-CA 121.602 1.535 . . . . 2.3399999999999999 110.217 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 160.14 7.15 0.05 OUTLIER Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.5 -1.44 . . . . 2.1099999999999999 109.5 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 -137.35 -1.83 2.07 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.528 -0.983 . . . . 2.2599999999999998 109.702 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -96.05 24.2 5.79 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.278 -0.889 . . . . 1.1899999999999999 109.43 179.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 12.3 mttt -94.58 -25.33 16.85 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.304 -0.872 . . . . 3.8100000000000001 109.613 -179.84 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -114.81 152.56 46.51 Favored Pre-proline 0 N--CA 1.495 1.783 0 N-CA-C 109.003 -0.74 . . . . 1.6000000000000001 109.003 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -56.97 170.66 1.37 Allowed 'Trans proline' 0 C--N 1.323 -0.77 0 C-N-CA 121.146 1.23 . . . . 0.46999999999999997 110.182 179.479 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 76.7 mttt -143.89 128.98 18.64 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.397 -0.814 . . . . 1.6899999999999999 109.394 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.419 HH11 ' HG3' ' A' ' 31' ' ' ARG . 20.6 mtm-85 -87.32 120.29 28.46 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.213 -0.929 . . . . 3.1800000000000002 109.301 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 13.3 mt -84.67 101.0 11.83 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.183 -0.948 . . . . 0.34999999999999998 109.474 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 37.1 t80 -96.04 120.02 35.58 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.376 -0.828 . . . . 1.23 109.488 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 23.0 t -85.27 126.27 33.57 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.272 -0.892 . . . . 0.34000000000000002 109.272 179.859 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.0 tmtp? -73.91 -17.9 60.97 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.261 -0.899 . . . . 1.79 109.709 -179.81 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.424 ' ND2' ' O ' ' A' ' 144' ' ' LYS . 1.8 m-80 -85.62 105.02 15.88 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.148 -0.97 . . . . 1.3999999999999999 109.626 -179.898 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.511 ' O ' ' CE2' ' A' ' 39' ' ' PHE . . . 80.52 4.88 90.12 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.625 -1.39 . . . . 0.38 109.625 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 47.38 85.87 0.01 OUTLIER Glycine 0 N--CA 1.49 2.253 0 N-CA-C 109.607 -1.397 . . . . 0.52000000000000002 109.607 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.511 ' CE2' ' O ' ' A' ' 37' ' ' GLY . 46.9 m-85 -143.71 132.73 22.87 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.413 -1.051 . . . . 0.44 109.596 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 48.8 m-85 -94.68 130.43 41.18 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.344 -0.848 . . . . 0.71999999999999997 109.317 179.835 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 48.9 tp -59.43 144.93 45.54 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.182 -0.949 . . . . 0.35999999999999999 109.358 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.471 ' NH1' ' CG ' ' A' ' 57' ' ' ASP . 32.9 ttt180 -149.2 115.0 5.66 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.278 -0.889 . . . . 1.5800000000000001 109.487 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 84.2 mt -89.87 118.38 35.04 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 121.224 -0.923 . . . . 0.35999999999999999 109.293 179.787 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' HIS . . . . . 0.412 ' CD2' ' OD1' ' A' ' 50' ' ' ASP . 57.0 m-70 -79.77 152.28 74.69 Favored Pre-proline 0 N--CA 1.489 1.524 0 O-C-N 121.287 -0.883 . . . . 0.54000000000000004 109.055 -179.758 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.479 ' O ' ' NH1' ' A' ' 81' ' ' ARG . 3.3 Cg_exo -56.9 -29.2 81.03 Favored 'Trans proline' 0 C--N 1.322 -0.845 0 C-N-CA 121.181 1.254 . . . . 0.46999999999999997 110.359 179.644 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 52.7 p-10 -74.95 -0.28 18.18 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.249 -0.907 . . . . 1.24 109.532 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 92.67 -30.9 6.51 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.531 -1.427 . . . . 0.60999999999999999 109.531 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.605 ' CG ' HH11 ' A' ' 48' ' ' ARG . 0.0 OUTLIER -48.37 115.36 1.19 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.222 -1.163 . . . . 3.4500000000000002 109.391 179.989 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 67.1 t -91.26 132.57 35.4 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.265 -0.897 . . . . 0.45000000000000001 109.469 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.412 ' OD1' ' CD2' ' A' ' 44' ' ' HIS . 3.3 p-10 -159.71 149.16 18.13 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.163 -0.961 . . . . 1.22 109.509 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -93.37 159.32 24.11 Favored Glycine 0 N--CA 1.492 2.368 0 N-CA-C 109.516 -1.434 . . . . 0.41999999999999998 109.516 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 32.9 m -148.66 154.21 10.3 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.263 -1.139 . . . . 0.40999999999999998 109.488 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -91.93 -0.05 57.49 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.233 -0.917 . . . . 2.8199999999999998 109.421 179.877 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -83.63 94.24 8.06 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.316 -0.865 . . . . 2.3300000000000001 109.485 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 19.7 pttt -73.55 -5.09 38.04 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.148 -0.97 . . . . 2.0699999999999998 109.397 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 6.6 p -89.18 23.33 2.49 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.292 -0.88 . . . . 1.5700000000000001 109.249 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ASP . . . . . 0.477 ' C ' ' H ' ' A' ' 59' ' ' HIS . 2.9 m-20 -105.12 105.59 52.33 Favored Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 121.6 -0.687 . . . . 1.46 109.207 -179.994 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -61.53 2.44 0.53 Allowed 'Trans proline' 0 C--O 1.215 -0.658 0 C-N-CA 120.807 1.005 . . . . 0.91000000000000003 110.273 -179.564 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' HIS . . . . . 0.477 ' H ' ' C ' ' A' ' 57' ' ' ASP . 38.5 m80 -85.24 -13.54 49.52 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.242 -0.911 . . . . 0.55000000000000004 109.304 179.739 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 1.6 pt -83.71 -2.7 7.05 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 O-C-N 121.259 -0.901 . . . . 0.55000000000000004 109.461 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 27.0 mtpt -76.35 86.54 3.13 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.233 -0.917 . . . . 1.78 109.472 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 11.3 mt -89.99 134.95 33.94 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.245 -0.909 . . . . 0.27000000000000002 109.468 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 38.2 tt0 -92.01 112.34 24.23 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.253 -0.904 . . . . 1.96 109.431 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.565 HD12 ' N ' ' A' ' 64' ' ' LEU . 10.7 mp -92.63 154.18 18.54 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.251 -0.905 . . . . 0.46000000000000002 109.53 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -143.0 123.69 14.13 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.438 -0.789 . . . . 2.1000000000000001 109.358 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -79.82 120.77 24.54 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.191 -0.943 . . . . 0.63 109.455 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -97.17 -86.51 0.33 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.413 -0.804 . . . . 2.1800000000000002 109.443 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -92.46 -163.36 1.03 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.241 -0.912 . . . . 2.3399999999999999 109.404 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 30.8 mtt180 -81.83 111.41 18.03 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.224 -0.922 . . . . 4.3499999999999996 109.462 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 93.07 -19.24 53.46 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.489 -1.444 . . . . 0.87 109.489 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 41.0 t -89.96 139.62 17.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.304 -1.115 . . . . 0.65000000000000002 109.502 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.517 HG23 ' O ' ' A' ' 72' ' ' VAL . 23.0 m -142.2 126.38 15.94 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.397 -0.814 . . . . 0.79000000000000004 109.593 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 5.3 m -93.26 123.37 36.49 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.287 -0.883 . . . . 0.59999999999999998 109.364 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 67.2 mt -91.39 148.86 4.32 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.513 0 O-C-N 121.271 -0.893 . . . . 0.48999999999999999 109.517 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 79.8 tttt -147.21 146.76 29.94 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.22 -0.925 . . . . 1.54 109.482 179.952 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -93.68 137.89 13.8 Favored Glycine 0 N--CA 1.49 2.299 0 N-CA-C 109.549 -1.421 . . . . 0.28999999999999998 109.549 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 59.5 t -79.0 -64.81 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 121.258 -1.142 . . . . 0.46999999999999997 109.447 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 44.4 t -71.45 -33.17 69.11 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.252 -0.905 . . . . 1.3500000000000001 109.483 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -77.88 -25.76 48.8 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.184 -0.947 . . . . 0.28000000000000003 109.386 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 93.1 m-20 51.06 50.07 19.87 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.229 -0.919 . . . . 1.1599999999999999 109.575 179.935 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.479 ' NH1' ' O ' ' A' ' 45' ' ' PRO . 69.4 mtt180 -147.36 148.29 31.19 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.3 -0.875 . . . . 2.1699999999999999 109.416 179.883 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 88.9 m-85 -92.92 132.36 37.11 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.274 -0.891 . . . . 0.44 109.589 -179.823 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 37.3 tp -60.73 147.34 42.67 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.255 -0.903 . . . . 0.26000000000000001 109.234 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -149.83 131.63 15.08 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.228 -0.92 . . . . 0.5 109.515 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 37.0 ttm -97.58 125.45 42.32 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.338 -0.851 . . . . 0.96999999999999997 109.499 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.434 ' HE3' HD21 ' A' ' 92' ' ' LEU . 27.9 mmtt -71.18 -173.22 0.82 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.182 -0.949 . . . . 2.0899999999999999 109.51 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -92.61 -24.5 18.67 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.298 -0.876 . . . . 2.3500000000000001 109.518 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ASP . . . . . 0.521 ' N ' ' OD1' ' A' ' 88' ' ' ASP . 3.7 p30 -81.82 -38.96 24.72 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.301 -0.875 . . . . 1.4099999999999999 109.57 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' GLY . . . . . 0.46 ' O ' ' CD1' ' A' ' 91' ' ' LEU . . . 142.33 -5.27 2.11 Favored Glycine 0 N--CA 1.493 2.452 0 N-CA-C 109.579 -1.408 . . . . 0.40000000000000002 109.579 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.417 ' C ' HD12 ' A' ' 91' ' ' LEU . 72.6 mtt180 -75.72 120.2 20.79 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.226 -1.161 . . . . 3.0299999999999998 109.534 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.643 ' N ' HD12 ' A' ' 91' ' ' LEU . 8.8 mp -93.98 134.21 36.62 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.268 -0.895 . . . . 0.40000000000000002 109.493 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.549 ' C ' HD12 ' A' ' 92' ' ' LEU . 0.8 OUTLIER -148.25 -171.91 3.95 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.209 -0.932 . . . . 0.54000000000000004 109.546 179.908 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -142.28 154.73 44.97 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.439 -0.788 . . . . 0.37 109.463 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 5.1 m -146.26 159.96 42.63 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.358 -0.838 . . . . 1.4099999999999999 109.404 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 21.4 mtmt -70.28 -30.83 67.95 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.215 -0.928 . . . . 2.6699999999999999 109.539 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 6.1 m -92.49 126.37 37.54 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.251 -0.906 . . . . 1.4299999999999999 109.58 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 4.6 p -73.82 162.37 4.47 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.279 -0.888 . . . . 1.0900000000000001 109.408 179.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 10.2 p -145.56 -170.89 3.56 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.294 -0.879 . . . . 0.91000000000000003 109.493 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -79.25 -17.26 55.1 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.297 -0.877 . . . . 2.3399999999999999 109.463 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -91.48 6.8 44.13 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.276 -0.89 . . . . 1.8500000000000001 109.468 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 64.5 m -92.76 -1.86 56.46 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.288 -0.883 . . . . 0.52000000000000002 109.485 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 65.5 m-85 -89.86 158.35 17.49 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.262 -0.899 . . . . 0.58999999999999997 109.522 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -149.91 110.53 4.26 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.285 -0.884 . . . . 0.38 109.3 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 36.4 m-85 -58.97 115.04 2.87 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.21 -0.932 . . . . 0.57999999999999996 109.492 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -88.16 143.07 27.27 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.246 -0.909 . . . . 1.6799999999999999 109.475 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.42 ' O ' ' OG1' ' A' ' 114' ' ' THR . 42.9 ttt180 -146.5 121.29 9.9 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.336 -0.852 . . . . 3.5299999999999998 109.374 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -90.59 126.94 36.11 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.248 -0.907 . . . . 1.1100000000000001 109.493 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -89.04 -173.11 3.93 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.23 -0.919 . . . . 1.8300000000000001 109.452 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' SER . . . . . 0.405 ' O ' ' OD1' ' A' ' 110' ' ' ASN . 16.1 t -92.19 49.47 1.52 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.23 -0.919 . . . . 1.5 109.46 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 110' ' ' ASN . . . . . 0.489 ' C ' ' H ' ' A' ' 112' ' ' TYR . 63.3 m-20 -151.42 26.71 0.67 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.247 -0.908 . . . . 2.2200000000000002 109.431 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 2.5 m120 60.24 -0.04 0.27 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.352 -0.842 . . . . 1.1699999999999999 109.709 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' TYR . . . . . 0.489 ' H ' ' C ' ' A' ' 110' ' ' ASN . 34.0 m-85 -95.46 138.4 33.2 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.321 -0.862 . . . . 0.76000000000000001 109.458 179.877 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 12.3 m-80 -95.41 165.75 12.21 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.331 -0.856 . . . . 1.3899999999999999 109.612 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' THR . . . . . 0.42 ' OG1' ' O ' ' A' ' 106' ' ' ARG . 17.8 p -144.18 116.31 8.41 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.402 -0.811 . . . . 0.54000000000000004 109.367 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 91.8 m-85 -94.93 112.1 23.84 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.362 -0.836 . . . . 0.52000000000000002 109.623 -179.837 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 39.7 ttp180 -96.98 143.84 27.45 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.412 -0.805 . . . . 2.8399999999999999 109.39 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 4.5 t -68.29 155.46 39.69 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.238 -0.914 . . . . 0.46999999999999997 109.595 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.478 ' O ' ' N ' ' A' ' 120' ' ' TYR . 24.0 ttt180 -93.53 -76.28 0.48 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.261 -0.9 . . . . 2.4500000000000002 109.538 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.454 ' O ' ' CD1' ' A' ' 120' ' ' TYR . 2.8 tptt -50.52 -10.55 0.06 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.25 -0.907 . . . . 1.9199999999999999 109.495 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 120' ' ' TYR . . . . . 0.493 ' C ' ' H ' ' A' ' 122' ' ' SER . 10.2 m-85 -142.82 63.87 1.38 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.354 -0.841 . . . . 0.68999999999999995 109.429 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 36.8 p -61.36 0.84 0.24 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.287 -0.883 . . . . 0.56000000000000005 109.611 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 122' ' ' SER . . . . . 0.493 ' H ' ' C ' ' A' ' 120' ' ' TYR . 26.8 m -89.88 10.67 22.88 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.199 -0.938 . . . . 0.57999999999999996 109.526 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 123' ' ' TRP . . . . . . . . . . . . . 2.3 m-90 -154.95 138.16 15.69 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.172 -0.955 . . . . 1.04 109.604 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' TYR . . . . . 0.446 ' CD1' ' N ' ' A' ' 124' ' ' TYR . 26.5 m-85 -103.13 168.29 9.28 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.529 -0.732 . . . . 0.54000000000000004 109.479 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 65.6 t -90.29 128.91 41.91 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.206 -0.934 . . . . 0.44 109.451 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 126' ' ' ALA . . . . . 0.611 ' HB1' ' CB ' ' A' ' 145' ' ' ALA . . . -154.74 140.2 17.79 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.215 -0.928 . . . . 0.64000000000000001 109.537 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 22.0 mt -93.57 175.64 6.67 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.334 -0.854 . . . . 0.56000000000000005 109.456 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 20.0 mtpt -93.15 -172.2 2.89 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.271 -0.893 . . . . 1.79 109.459 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -92.53 -17.88 23.88 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.267 -0.895 . . . . 3.3900000000000001 109.495 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 130' ' ' THR . . . . . 0.402 ' H ' HG22 ' A' ' 130' ' ' THR . 1.8 t -89.43 5.07 46.94 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.247 -0.908 . . . . 0.87 109.432 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 90.73 0.01 76.09 Favored Glycine 0 N--CA 1.49 2.249 0 N-CA-C 109.581 -1.408 . . . . 0.88 109.581 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 19.9 mm-40 -85.72 168.73 14.09 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.237 -1.155 . . . . 1.9399999999999999 109.453 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' TYR . . . . . 0.525 ' CG ' ' O ' ' A' ' 133' ' ' TYR . 32.6 p90 -89.12 120.24 30.34 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.291 -0.88 . . . . 0.45000000000000001 109.444 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 14.6 tttt -69.88 134.67 48.7 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.251 -0.906 . . . . 1.6799999999999999 109.444 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.636 HD23 ' OG ' ' A' ' 137' ' ' SER . 13.6 tp -56.84 139.68 50.49 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.253 -0.905 . . . . 0.47999999999999998 109.318 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -65.36 0.8 4.55 Favored Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.709 -1.356 . . . . 0.78000000000000003 109.709 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 137' ' ' SER . . . . . 0.636 ' OG ' HD23 ' A' ' 135' ' ' LEU . 51.8 p -93.53 -28.88 15.81 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.232 -1.157 . . . . 0.72999999999999998 109.498 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 12.4 mttp -90.02 -10.07 46.24 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.203 -0.935 . . . . 2.0 109.495 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 33.9 p -72.31 156.96 38.54 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.251 -0.906 . . . . 0.5 109.496 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . 160.11 -179.91 35.33 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.338 -1.505 . . . . 0.38 109.338 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -60.82 171.95 3.27 Favored 'Trans proline' 0 C--N 1.311 -1.401 0 C-N-CA 121.879 1.72 . . . . 0.57999999999999996 110.206 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 83.42 -45.51 3.47 Favored Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.519 -1.432 . . . . 0.64000000000000001 109.519 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -76.07 132.73 40.27 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.201 -1.176 . . . . 2.2200000000000002 109.429 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 144' ' ' LYS . . . . . 0.424 ' O ' ' ND2' ' A' ' 36' ' ' ASN . 36.2 mtmt -85.11 4.02 36.21 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.215 -0.928 . . . . 1.8200000000000001 109.499 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 145' ' ' ALA . . . . . 0.611 ' CB ' ' HB1' ' A' ' 126' ' ' ALA . . . -65.1 -2.39 2.8 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.23 -0.919 . . . . 0.40999999999999998 109.542 -179.857 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 22.0 pt -94.26 -6.87 10.21 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.319 -0.863 . . . . 0.46999999999999997 109.502 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 55.7 mt -81.68 89.24 6.24 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.236 -0.915 . . . . 0.34000000000000002 109.458 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 42.4 m-85 -94.67 164.4 12.97 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.316 -0.865 . . . . 0.29999999999999999 109.495 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 31.8 tp -139.58 70.55 38.13 Favored Pre-proline 0 N--CA 1.492 1.667 0 O-C-N 121.472 -0.768 . . . . 0.34999999999999998 109.493 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -61.75 106.25 0.42 Allowed 'Trans proline' 0 C--N 1.312 -1.342 0 C-N-CA 121.865 1.71 . . . . 0.34000000000000002 110.344 -179.631 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 151' ' ' MET . . . . . . . . . . . . . 1.5 mtt -97.66 122.56 40.89 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.461 -0.774 . . . . 0.93999999999999995 109.508 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 8.5 t -70.22 135.47 49.05 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.216 -0.928 . . . . 0.65000000000000002 109.445 179.84 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -86.11 56.85 4.16 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.251 -0.906 . . . . 1.02 109.432 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 45.4 mttt -61.51 -81.14 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.239 -0.913 . . . . 2.5899999999999999 109.526 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 4.6 m . . . . . 0 N--CA 1.49 1.547 0 CA-C-O 118.038 -0.982 . . . . 2.6699999999999999 109.463 179.986 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.587 ' SD ' ' N ' ' A' ' 2' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.558 0 N-CA-C 109.475 -0.565 . . . . 8.1199999999999992 109.475 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.587 ' N ' ' SD ' ' A' ' 1' ' ' MET . . . -59.5 111.31 1.35 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.211 -0.93 . . . . 4.25 109.469 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -65.75 148.19 52.17 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.196 -0.94 . . . . 4.79 109.461 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 67.24 -176.55 22.57 Favored Glycine 0 N--CA 1.49 2.252 0 N-CA-C 109.519 -1.432 . . . . 1.97 109.519 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -84.9 -101.98 0.06 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.246 -1.149 . . . . 3.5600000000000001 109.506 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.429 ' H ' HD12 ' A' ' 6' ' ' ILE . 2.3 mp -87.38 60.74 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 O-C-N 121.254 -0.904 . . . . 2.9399999999999999 109.484 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.414 ' O ' ' O ' ' A' ' 6' ' ' ILE . 11.0 p 49.19 -175.1 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.233 -0.917 . . . . 3.8199999999999998 109.523 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.453 ' O ' ' O ' ' A' ' 9' ' ' LEU . 51.6 m -166.45 -79.01 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.233 -0.917 . . . . 5.0700000000000003 109.532 -179.935 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.453 ' O ' ' O ' ' A' ' 8' ' ' THR . 9.6 mt 60.47 148.9 0.08 OUTLIER Pre-proline 0 N--CA 1.494 1.754 0 N-CA-C 109.058 -0.719 . . . . 4.8700000000000001 109.058 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -55.77 132.39 51.79 Favored 'Trans proline' 0 C--N 1.324 -0.76 0 C-N-CA 121.021 1.147 . . . . 3.3399999999999999 110.285 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -149.9 -172.37 4.14 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.336 -0.853 . . . . 3.7999999999999998 109.446 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.411 ' O ' ' OD1' ' A' ' 15' ' ' ASP . 4.8 tp -162.45 68.92 2.07 Favored Pre-proline 0 N--CA 1.491 1.6 0 O-C-N 121.324 -0.86 . . . . 4.4199999999999999 109.639 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -63.18 148.64 92.96 Favored 'Trans proline' 0 C--N 1.313 -1.34 0 C-N-CA 121.77 1.646 . . . . 3.0 110.225 -179.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 55.15 86.63 0.05 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.263 -0.898 . . . . 4.6900000000000004 109.527 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.505 ' OD1' ' N ' ' A' ' 15' ' ' ASP . 2.0 m-20 -91.17 11.39 23.46 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.232 -0.918 . . . . 5.3399999999999999 109.349 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -87.47 60.9 4.25 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.532 -1.427 . . . . 3.5699999999999998 109.532 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -91.8 58.13 2.93 Favored Glycine 0 N--CA 1.491 2.307 0 N-CA-C 109.48 -1.448 . . . . 3.6200000000000001 109.48 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 50.6 m -91.73 57.57 3.26 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.225 -1.161 . . . . 4.6500000000000004 109.499 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 167.89 -92.64 0.1 Allowed Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.529 -1.428 . . . . 4.3700000000000001 109.529 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -152.86 -99.63 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.198 -1.178 . . . . 3.8300000000000001 109.426 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.4 ' CD1' ' N ' ' A' ' 21' ' ' PHE . 1.1 p90 -154.56 70.54 6.02 Favored Pre-proline 0 N--CA 1.491 1.616 0 O-C-N 121.222 -0.924 . . . . 2.0899999999999999 109.404 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -63.37 168.37 11.34 Favored 'Trans proline' 0 C--N 1.313 -1.334 0 C-N-CA 121.769 1.646 . . . . 2.29 109.786 -179.646 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -56.52 119.76 7.18 Favored 'Trans proline' 0 C--N 1.315 -1.235 0 C-N-CA 121.602 1.535 . . . . 2.3399999999999999 110.217 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 160.14 7.15 0.05 OUTLIER Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.5 -1.44 . . . . 2.1099999999999999 109.5 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 -137.35 -1.83 2.07 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.528 -0.983 . . . . 2.2599999999999998 109.702 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -96.05 24.2 5.79 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.278 -0.889 . . . . 1.1899999999999999 109.43 179.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 12.3 mttt -94.58 -25.33 16.85 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.304 -0.872 . . . . 3.8100000000000001 109.613 -179.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -114.81 152.56 46.51 Favored Pre-proline 0 N--CA 1.495 1.783 0 N-CA-C 109.003 -0.74 . . . . 1.6000000000000001 109.003 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -56.97 170.66 1.37 Allowed 'Trans proline' 0 C--N 1.323 -0.77 0 C-N-CA 121.146 1.23 . . . . 0.46999999999999997 110.182 179.479 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 76.7 mttt -143.89 128.98 18.64 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.397 -0.814 . . . . 1.6899999999999999 109.394 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.419 HH11 ' HG3' ' A' ' 31' ' ' ARG . 20.6 mtm-85 -87.32 120.29 28.46 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.213 -0.929 . . . . 3.1800000000000002 109.301 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 13.3 mt -84.67 101.0 11.83 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.183 -0.948 . . . . 0.34999999999999998 109.474 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 37.1 t80 -96.04 120.02 35.58 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.376 -0.828 . . . . 1.23 109.488 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 23.0 t -85.27 126.27 33.57 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.272 -0.892 . . . . 0.34000000000000002 109.272 179.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.0 tmtp? -73.91 -17.9 60.97 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.261 -0.899 . . . . 1.79 109.709 -179.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.424 ' ND2' ' O ' ' A' ' 144' ' ' LYS . 1.8 m-80 -85.62 105.02 15.88 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.148 -0.97 . . . . 1.3999999999999999 109.626 -179.898 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.511 ' O ' ' CE2' ' A' ' 39' ' ' PHE . . . 80.52 4.88 90.12 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.625 -1.39 . . . . 0.38 109.625 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 47.38 85.87 0.01 OUTLIER Glycine 0 N--CA 1.49 2.253 0 N-CA-C 109.607 -1.397 . . . . 0.52000000000000002 109.607 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.511 ' CE2' ' O ' ' A' ' 37' ' ' GLY . 46.9 m-85 -143.71 132.73 22.87 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.413 -1.051 . . . . 0.44 109.596 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 48.8 m-85 -94.68 130.43 41.18 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.344 -0.848 . . . . 0.71999999999999997 109.317 179.835 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 48.9 tp -59.43 144.93 45.54 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.182 -0.949 . . . . 0.35999999999999999 109.358 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.471 ' NH1' ' CG ' ' A' ' 57' ' ' ASP . 32.9 ttt180 -149.2 115.0 5.66 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.278 -0.889 . . . . 1.5800000000000001 109.487 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 84.2 mt -89.87 118.38 35.04 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 121.224 -0.923 . . . . 0.35999999999999999 109.293 179.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . 0.412 ' CD2' ' OD1' ' A' ' 50' ' ' ASP . 57.0 m-70 -79.77 152.28 74.69 Favored Pre-proline 0 N--CA 1.489 1.524 0 O-C-N 121.287 -0.883 . . . . 0.54000000000000004 109.055 -179.758 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.479 ' O ' ' NH1' ' A' ' 81' ' ' ARG . 3.3 Cg_exo -56.9 -29.2 81.03 Favored 'Trans proline' 0 C--N 1.322 -0.845 0 C-N-CA 121.181 1.254 . . . . 0.46999999999999997 110.359 179.644 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 52.7 p-10 -74.95 -0.28 18.18 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.249 -0.907 . . . . 1.24 109.532 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 92.67 -30.9 6.51 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.531 -1.427 . . . . 0.60999999999999999 109.531 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.605 ' CG ' HH11 ' A' ' 48' ' ' ARG . 0.0 OUTLIER -48.37 115.36 1.19 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.222 -1.163 . . . . 3.4500000000000002 109.391 179.989 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 67.1 t -91.26 132.57 35.4 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.265 -0.897 . . . . 0.45000000000000001 109.469 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.412 ' OD1' ' CD2' ' A' ' 44' ' ' HIS . 3.3 p-10 -159.71 149.16 18.13 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.163 -0.961 . . . . 1.22 109.509 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -93.37 159.32 24.11 Favored Glycine 0 N--CA 1.492 2.368 0 N-CA-C 109.516 -1.434 . . . . 0.41999999999999998 109.516 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 32.9 m -148.66 154.21 10.3 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.263 -1.139 . . . . 0.40999999999999998 109.488 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -91.93 -0.05 57.49 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.233 -0.917 . . . . 2.8199999999999998 109.421 179.877 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -83.63 94.24 8.06 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.316 -0.865 . . . . 2.3300000000000001 109.485 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 19.7 pttt -73.55 -5.09 38.04 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.148 -0.97 . . . . 2.0699999999999998 109.397 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 6.6 p -89.18 23.33 2.49 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.292 -0.88 . . . . 1.5700000000000001 109.249 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.477 ' C ' ' H ' ' A' ' 59' ' ' HIS . 2.9 m-20 -105.12 105.59 52.33 Favored Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 121.6 -0.687 . . . . 1.46 109.207 -179.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -61.53 2.44 0.53 Allowed 'Trans proline' 0 C--O 1.215 -0.658 0 C-N-CA 120.807 1.005 . . . . 0.91000000000000003 110.273 -179.564 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . 0.477 ' H ' ' C ' ' A' ' 57' ' ' ASP . 38.5 m80 -85.24 -13.54 49.52 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.242 -0.911 . . . . 0.55000000000000004 109.304 179.739 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 1.6 pt -83.71 -2.7 7.05 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 O-C-N 121.259 -0.901 . . . . 0.55000000000000004 109.461 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 27.0 mtpt -76.35 86.54 3.13 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.233 -0.917 . . . . 1.78 109.472 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 11.3 mt -89.99 134.95 33.94 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.245 -0.909 . . . . 0.27000000000000002 109.468 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 38.2 tt0 -92.01 112.34 24.23 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.253 -0.904 . . . . 1.96 109.431 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.565 HD12 ' N ' ' A' ' 64' ' ' LEU . 10.7 mp -92.63 154.18 18.54 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.251 -0.905 . . . . 0.46000000000000002 109.53 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -143.0 123.69 14.13 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.438 -0.789 . . . . 2.1000000000000001 109.358 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -79.82 120.77 24.54 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.191 -0.943 . . . . 0.63 109.455 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -97.17 -86.51 0.33 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.413 -0.804 . . . . 2.1800000000000002 109.443 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -92.46 -163.36 1.03 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.241 -0.912 . . . . 2.3399999999999999 109.404 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 30.8 mtt180 -81.83 111.41 18.03 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.224 -0.922 . . . . 4.3499999999999996 109.462 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 93.07 -19.24 53.46 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.489 -1.444 . . . . 0.87 109.489 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 41.0 t -89.96 139.62 17.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.304 -1.115 . . . . 0.65000000000000002 109.502 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.517 HG23 ' O ' ' A' ' 72' ' ' VAL . 23.0 m -142.2 126.38 15.94 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.397 -0.814 . . . . 0.79000000000000004 109.593 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 5.3 m -93.26 123.37 36.49 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.287 -0.883 . . . . 0.59999999999999998 109.364 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 67.2 mt -91.39 148.86 4.32 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.513 0 O-C-N 121.271 -0.893 . . . . 0.48999999999999999 109.517 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 79.8 tttt -147.21 146.76 29.94 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.22 -0.925 . . . . 1.54 109.482 179.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -93.68 137.89 13.8 Favored Glycine 0 N--CA 1.49 2.299 0 N-CA-C 109.549 -1.421 . . . . 0.28999999999999998 109.549 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 59.5 t -79.0 -64.81 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 121.258 -1.142 . . . . 0.46999999999999997 109.447 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 44.4 t -71.45 -33.17 69.11 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.252 -0.905 . . . . 1.3500000000000001 109.483 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -77.88 -25.76 48.8 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.184 -0.947 . . . . 0.28000000000000003 109.386 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 93.1 m-20 51.06 50.07 19.87 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.229 -0.919 . . . . 1.1599999999999999 109.575 179.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.479 ' NH1' ' O ' ' A' ' 45' ' ' PRO . 69.4 mtt180 -147.36 148.29 31.19 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.3 -0.875 . . . . 2.1699999999999999 109.416 179.883 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 88.9 m-85 -92.92 132.36 37.11 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.274 -0.891 . . . . 0.44 109.589 -179.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 37.3 tp -60.73 147.34 42.67 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.255 -0.903 . . . . 0.26000000000000001 109.234 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -149.83 131.63 15.08 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.228 -0.92 . . . . 0.5 109.515 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 37.0 ttm -97.58 125.45 42.32 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.338 -0.851 . . . . 0.96999999999999997 109.499 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.434 ' HE3' HD21 ' A' ' 92' ' ' LEU . 27.9 mmtt -71.18 -173.22 0.82 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.182 -0.949 . . . . 2.0899999999999999 109.51 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -92.61 -24.5 18.67 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.298 -0.876 . . . . 2.3500000000000001 109.518 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.521 ' N ' ' OD1' ' A' ' 88' ' ' ASP . 3.7 p30 -81.82 -38.96 24.72 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.301 -0.875 . . . . 1.4099999999999999 109.57 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . 0.46 ' O ' ' CD1' ' A' ' 91' ' ' LEU . . . 142.33 -5.27 2.11 Favored Glycine 0 N--CA 1.493 2.452 0 N-CA-C 109.579 -1.408 . . . . 0.40000000000000002 109.579 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.417 ' C ' HD12 ' A' ' 91' ' ' LEU . 72.6 mtt180 -75.72 120.2 20.79 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.226 -1.161 . . . . 3.0299999999999998 109.534 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.643 ' N ' HD12 ' A' ' 91' ' ' LEU . 8.8 mp -93.98 134.21 36.62 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.268 -0.895 . . . . 0.40000000000000002 109.493 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.549 ' C ' HD12 ' A' ' 92' ' ' LEU . 0.8 OUTLIER -148.25 -171.91 3.95 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.209 -0.932 . . . . 0.54000000000000004 109.546 179.908 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -142.28 154.73 44.97 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.439 -0.788 . . . . 0.37 109.463 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 5.1 m -146.26 159.96 42.63 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.358 -0.838 . . . . 1.4099999999999999 109.404 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 21.4 mtmt -70.28 -30.83 67.95 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.215 -0.928 . . . . 2.6699999999999999 109.539 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 6.1 m -92.49 126.37 37.54 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.251 -0.906 . . . . 1.4299999999999999 109.58 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 4.6 p -73.82 162.37 4.47 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.279 -0.888 . . . . 1.0900000000000001 109.408 179.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 10.2 p -145.56 -170.89 3.56 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.294 -0.879 . . . . 0.91000000000000003 109.493 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -79.25 -17.26 55.1 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.297 -0.877 . . . . 2.3399999999999999 109.463 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -91.48 6.8 44.13 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.276 -0.89 . . . . 1.8500000000000001 109.468 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 64.5 m -92.76 -1.86 56.46 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.288 -0.883 . . . . 0.52000000000000002 109.485 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 65.5 m-85 -89.86 158.35 17.49 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.262 -0.899 . . . . 0.58999999999999997 109.522 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -149.91 110.53 4.26 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.285 -0.884 . . . . 0.38 109.3 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 36.4 m-85 -58.97 115.04 2.87 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.21 -0.932 . . . . 0.57999999999999996 109.492 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -88.16 143.07 27.27 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.246 -0.909 . . . . 1.6799999999999999 109.475 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.42 ' O ' ' OG1' ' A' ' 114' ' ' THR . 42.9 ttt180 -146.5 121.29 9.9 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.336 -0.852 . . . . 3.5299999999999998 109.374 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -90.59 126.94 36.11 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.248 -0.907 . . . . 1.1100000000000001 109.493 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -89.04 -173.11 3.93 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.23 -0.919 . . . . 1.8300000000000001 109.452 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . 0.405 ' O ' ' OD1' ' A' ' 110' ' ' ASN . 16.1 t -92.19 49.47 1.52 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.23 -0.919 . . . . 1.5 109.46 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . 0.489 ' C ' ' H ' ' A' ' 112' ' ' TYR . 63.3 m-20 -151.42 26.71 0.67 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.247 -0.908 . . . . 2.2200000000000002 109.431 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 2.5 m120 60.24 -0.04 0.27 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.352 -0.842 . . . . 1.1699999999999999 109.709 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' TYR . . . . . 0.489 ' H ' ' C ' ' A' ' 110' ' ' ASN . 34.0 m-85 -95.46 138.4 33.2 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.321 -0.862 . . . . 0.76000000000000001 109.458 179.877 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 12.3 m-80 -95.41 165.75 12.21 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.331 -0.856 . . . . 1.3899999999999999 109.612 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . 0.42 ' OG1' ' O ' ' A' ' 106' ' ' ARG . 17.8 p -144.18 116.31 8.41 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.402 -0.811 . . . . 0.54000000000000004 109.367 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 91.8 m-85 -94.93 112.1 23.84 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.362 -0.836 . . . . 0.52000000000000002 109.623 -179.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 39.7 ttp180 -96.98 143.84 27.45 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.412 -0.805 . . . . 2.8399999999999999 109.39 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 4.5 t -68.29 155.46 39.69 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.238 -0.914 . . . . 0.46999999999999997 109.595 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.478 ' O ' ' N ' ' A' ' 120' ' ' TYR . 24.0 ttt180 -93.53 -76.28 0.48 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.261 -0.9 . . . . 2.4500000000000002 109.538 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.454 ' O ' ' CD1' ' A' ' 120' ' ' TYR . 2.8 tptt -50.52 -10.55 0.06 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.25 -0.907 . . . . 1.9199999999999999 109.495 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' TYR . . . . . 0.493 ' C ' ' H ' ' A' ' 122' ' ' SER . 10.2 m-85 -142.82 63.87 1.38 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.354 -0.841 . . . . 0.68999999999999995 109.429 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 36.8 p -61.36 0.84 0.24 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.287 -0.883 . . . . 0.56000000000000005 109.611 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . 0.493 ' H ' ' C ' ' A' ' 120' ' ' TYR . 26.8 m -89.88 10.67 22.88 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.199 -0.938 . . . . 0.57999999999999996 109.526 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' TRP . . . . . . . . . . . . . 2.3 m-90 -154.95 138.16 15.69 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.172 -0.955 . . . . 1.04 109.604 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' TYR . . . . . 0.446 ' CD1' ' N ' ' A' ' 124' ' ' TYR . 26.5 m-85 -103.13 168.29 9.28 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.529 -0.732 . . . . 0.54000000000000004 109.479 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 65.6 t -90.29 128.91 41.91 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.206 -0.934 . . . . 0.44 109.451 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . 0.611 ' HB1' ' CB ' ' A' ' 145' ' ' ALA . . . -154.74 140.2 17.79 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.215 -0.928 . . . . 0.64000000000000001 109.537 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 22.0 mt -93.57 175.64 6.67 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.334 -0.854 . . . . 0.56000000000000005 109.456 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 20.0 mtpt -93.15 -172.2 2.89 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.271 -0.893 . . . . 1.79 109.459 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -92.53 -17.88 23.88 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.267 -0.895 . . . . 3.3900000000000001 109.495 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . 0.402 ' H ' HG22 ' A' ' 130' ' ' THR . 1.8 t -89.43 5.07 46.94 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.247 -0.908 . . . . 0.87 109.432 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 90.73 0.01 76.09 Favored Glycine 0 N--CA 1.49 2.249 0 N-CA-C 109.581 -1.408 . . . . 0.88 109.581 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 19.9 mm-40 -85.72 168.73 14.09 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.237 -1.155 . . . . 1.9399999999999999 109.453 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' TYR . . . . . 0.525 ' CG ' ' O ' ' A' ' 133' ' ' TYR . 32.6 p90 -89.12 120.24 30.34 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.291 -0.88 . . . . 0.45000000000000001 109.444 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 14.6 tttt -69.88 134.67 48.7 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.251 -0.906 . . . . 1.6799999999999999 109.444 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.636 HD23 ' OG ' ' A' ' 137' ' ' SER . 13.6 tp -56.84 139.68 50.49 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.253 -0.905 . . . . 0.47999999999999998 109.318 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -65.36 0.8 4.55 Favored Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.709 -1.356 . . . . 0.78000000000000003 109.709 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . 0.636 ' OG ' HD23 ' A' ' 135' ' ' LEU . 51.8 p -93.53 -28.88 15.81 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.232 -1.157 . . . . 0.72999999999999998 109.498 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 12.4 mttp -90.02 -10.07 46.24 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.203 -0.935 . . . . 2.0 109.495 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 33.9 p -72.31 156.96 38.54 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.251 -0.906 . . . . 0.5 109.496 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . 160.11 -179.91 35.33 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.338 -1.505 . . . . 0.38 109.338 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -60.82 171.95 3.27 Favored 'Trans proline' 0 C--N 1.311 -1.401 0 C-N-CA 121.879 1.72 . . . . 0.57999999999999996 110.206 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . 83.42 -45.51 3.47 Favored Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.519 -1.432 . . . . 0.64000000000000001 109.519 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -76.07 132.73 40.27 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.201 -1.176 . . . . 2.2200000000000002 109.429 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' LYS . . . . . 0.424 ' O ' ' ND2' ' A' ' 36' ' ' ASN . 36.2 mtmt -85.11 4.02 36.21 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.215 -0.928 . . . . 1.8200000000000001 109.499 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . 0.611 ' CB ' ' HB1' ' A' ' 126' ' ' ALA . . . -65.1 -2.39 2.8 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.23 -0.919 . . . . 0.40999999999999998 109.542 -179.857 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 22.0 pt -94.26 -6.87 10.21 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.319 -0.863 . . . . 0.46999999999999997 109.502 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 55.7 mt -81.68 89.24 6.24 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.236 -0.915 . . . . 0.34000000000000002 109.458 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 42.4 m-85 -94.67 164.4 12.97 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.316 -0.865 . . . . 0.29999999999999999 109.495 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 31.8 tp -139.58 70.55 38.13 Favored Pre-proline 0 N--CA 1.492 1.667 0 O-C-N 121.472 -0.768 . . . . 0.34999999999999998 109.493 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 150' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -61.75 106.25 0.42 Allowed 'Trans proline' 0 C--N 1.312 -1.342 0 C-N-CA 121.865 1.71 . . . . 0.34000000000000002 110.344 -179.631 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 151' ' ' MET . . . . . . . . . . . . . 1.5 mtt -97.66 122.56 40.89 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.461 -0.774 . . . . 0.93999999999999995 109.508 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 8.5 t -70.22 135.47 49.05 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.216 -0.928 . . . . 0.65000000000000002 109.445 179.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -86.11 56.85 4.16 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.251 -0.906 . . . . 1.02 109.432 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 45.4 mttt -61.51 -81.14 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.239 -0.913 . . . . 2.5899999999999999 109.526 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 4.6 m . . . . . 0 N--CA 1.49 1.547 0 CA-C-O 118.038 -0.982 . . . . 2.6699999999999999 109.463 179.986 . . . . . . . . 0 0 . 1 stop_ save_