data_1a56_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 1a56 _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' ' ' ASP . . . . . 0.447 ' HB2' ' NE1' ' A' ' 76' ' ' TRP . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.609 0 N-CA-C 109.466 -0.568 . . . . 3.1400000000000001 109.466 . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . 0.482 ' O ' ' HB2' ' A' ' 6' ' ' LYS . . . -48.19 -60.58 2.53 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.178 -0.951 . . . . 1.6399999999999999 109.023 179.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.532 ' O ' ' HB2' ' A' ' 7' ' ' LYS . 0.4 OUTLIER -54.96 -25.76 31.84 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.501 -0.749 . . . . 1.75 109.424 179.848 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.465 ' O ' ' HB2' ' A' ' 7' ' ' LYS . 1.7 mt -71.26 -68.04 0.47 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.462 -0.774 . . . . 1.5 108.999 179.913 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.522 ' CB ' HG12 ' A' ' 11' ' ' ILE . . . -51.21 -45.29 61.82 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.088 -1.008 . . . . 1.1100000000000001 108.281 179.172 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.557 ' HG3' ' CG2' ' A' ' 11' ' ' ILE . 0.0 OUTLIER -62.03 -42.9 99.67 Favored 'General case' 0 N--CA 1.485 1.299 0 N-CA-C 107.505 -1.294 . . . . 2.8799999999999999 107.505 178.264 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.532 ' HB2' ' O ' ' A' ' 3' ' ' ASP . 7.8 mttp -51.95 -32.81 34.86 Favored 'General case' 0 C--N 1.299 -1.616 0 N-CA-C 107.633 -1.247 . . . . 3.1899999999999999 107.633 179.251 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . 0.435 ' CG ' HG21 ' A' ' 65' ' ' VAL . 4.5 m-80 -99.01 -88.74 0.33 Allowed 'General case' 0 C--N 1.3 -1.572 0 C-N-CA 119.877 -0.729 . . . . 0.85999999999999999 110.517 -179.163 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.529 ' O ' ' N ' ' A' ' 12' ' ' ALA . 0.0 OUTLIER -160.9 -32.22 0.05 Allowed 'General case' 0 N--CA 1.499 2.019 0 C-N-CA 118.81 -1.156 . . . . 0.80000000000000004 112.609 -178.306 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.55 ' HA ' ' CHC' ' A' ' 82' ' ' HEC . 56.0 m -42.29 -56.99 2.73 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.185 -0.947 . . . . 0.63 108.446 -177.403 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.557 ' CG2' ' HG3' ' A' ' 6' ' ' LYS . 13.0 mm -65.22 -26.96 40.91 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.722 0 C-N-CA 119.387 -0.925 . . . . 1.97 109.171 179.308 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.529 ' N ' ' O ' ' A' ' 9' ' ' ASN . . . -46.75 -47.41 20.69 Favored 'General case' 0 N--CA 1.487 1.382 0 N-CA-C 108.198 -1.038 . . . . 1.1799999999999999 108.198 179.335 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . 0.471 ' HB3' ' CG2' ' A' ' 21' ' ' VAL . 8.1 m -120.48 11.32 11.36 Favored 'General case' 0 N--CA 1.499 2.01 0 C-N-CA 119.016 -1.074 . . . . 0.44 110.66 179.125 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . 0.537 ' O ' ' HA ' ' A' ' 11' ' ' ILE . 93.0 m-70 -133.1 99.13 4.46 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.602 -1.311 . . . . 0.34999999999999998 108.731 179.277 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.537 ' CB ' ' O ' ' A' ' 18' ' ' THR . 0.3 OUTLIER -79.71 -168.56 1.62 Allowed 'General case' 0 C--N 1.29 -2.016 0 O-C-N 121.037 -1.04 . . . . 2.1499999999999999 108.962 179.877 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.457 ' O ' ' HG2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -90.31 -41.05 13.31 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.368 0 O-C-N 121.045 -1.035 . . . . 1.45 110.084 -179.252 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.484 ' HA ' ' HD3' ' A' ' 26' ' ' LYS . 47.2 tt0 -122.06 -32.0 3.78 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.129 -0.982 . . . . 1.96 109.105 179.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.537 ' O ' ' CB ' ' A' ' 15' ' ' GLN . 0.0 OUTLIER -102.67 158.95 15.88 Favored 'General case' 0 C--N 1.302 -1.485 0 O-C-N 121.508 -0.745 . . . . 2.27 109.208 179.831 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.477 ' HB2' ' O ' ' A' ' 22' ' ' GLY . 0.0 OUTLIER -127.3 158.1 38.13 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.04 -1.037 . . . . 2.5899999999999999 109.693 -179.956 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.428 HG22 ' HA ' ' A' ' 13' ' ' CYS . 0.0 OUTLIER -118.31 -62.14 2.24 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.266 -0.896 . . . . 1.51 109.432 179.97 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.471 ' CG2' ' HB3' ' A' ' 13' ' ' CYS . 3.4 t -93.15 -64.35 1.27 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.247 -0.908 . . . . 1.27 109.216 179.822 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.477 ' O ' ' HB2' ' A' ' 19' ' ' LYS . . . -100.45 -147.68 21.33 Favored Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.468 -1.453 . . . . 0.53000000000000003 109.468 179.799 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . 0.606 ' HG3' ' CD2' ' A' ' 54' ' ' TRP . 35.3 Cg_endo -79.54 157.94 25.32 Favored 'Trans proline' 0 C--N 1.305 -1.733 0 C-N-CA 122.799 2.333 . . . . 0.84999999999999998 110.001 179.306 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.543 ' CB ' ' OD1' ' A' ' 27' ' ' ASP . . . -72.74 -177.6 2.38 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.141 -0.975 . . . . 1.25 108.559 179.122 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.516 ' CD2' ' HB3' ' A' ' 14' ' ' HIS . 29.5 mt -83.57 -57.63 3.15 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.05 -1.031 . . . . 1.28 109.965 -179.55 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.535 ' HG3' ' N ' ' A' ' 27' ' ' ASP . 3.5 pttt -45.11 -31.49 1.43 Allowed 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.375 -0.828 . . . . 2.7599999999999998 110.085 -179.541 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . 0.543 ' OD1' ' CB ' ' A' ' 24' ' ' ALA . 0.0 OUTLIER -81.02 -61.31 2.0 Allowed 'General case' 0 C--N 1.304 -1.386 0 O-C-N 121.108 -0.995 . . . . 1.28 109.7 -179.861 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . 0.524 ' CG1' ' HG2' ' A' ' 23' ' ' PRO . 57.6 mt -42.98 -44.93 1.25 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.188 -0.945 . . . . 1.23 109.11 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.421 ' HA ' ' HB1' ' A' ' 33' ' ' ALA . . . -65.88 -57.5 7.76 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.519 -0.738 . . . . 1.49 109.305 179.552 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.455 ' HA ' ' HB2' ' A' ' 34' ' ' ASP . . . -65.72 -8.62 21.93 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.353 -0.842 . . . . 1.6599999999999999 109.685 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.5 ' HB2' ' O ' ' A' ' 27' ' ' ASP . 0.0 OUTLIER -83.5 -49.22 9.48 Favored 'General case' 0 C--N 1.305 -1.352 0 O-C-N 121.243 -0.91 . . . . 2.2400000000000002 109.185 -179.876 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.581 ' O ' ' CB ' ' A' ' 38' ' ' ALA . 87.0 m-85 -132.43 -27.31 1.77 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.384 -0.822 . . . . 2.73 110.601 -179.807 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.468 ' HA ' ' HB2' ' A' ' 38' ' ' ALA . . . -88.65 41.16 1.0 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.084 -1.01 . . . . 3.1699999999999999 109.639 -179.367 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.455 ' HB2' ' HA ' ' A' ' 30' ' ' ALA . 4.5 t70 -124.12 2.24 8.58 Favored 'General case' 0 C--N 1.293 -1.869 0 O-C-N 121.649 -0.657 . . . . 2.6299999999999999 110.011 -179.597 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 16.9 mmtm -114.14 -99.44 0.43 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.036 -1.04 . . . . 5.6900000000000004 111.302 -178.806 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 18.0 t0 -90.08 -131.24 0.09 Allowed 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.181 -0.949 . . . . 5.04 110.787 -178.174 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -87.63 34.21 0.71 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 120.966 -1.084 . . . . 3.3599999999999999 109.347 -179.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.581 ' CB ' ' O ' ' A' ' 32' ' ' TYR . . . -49.35 -22.73 1.19 Allowed 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.281 -0.887 . . . . 1.96 108.955 179.679 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.534 ' HB1' ' CD1' ' A' ' 78' ' ' LEU . . . -54.93 -55.88 25.73 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 121.059 -1.026 . . . . 1.54 108.508 179.409 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.464 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 0.1 OUTLIER -69.73 -47.15 64.11 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 109.002 -0.74 . . . . 2.21 109.002 179.384 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.578 ' C ' ' CD1' ' A' ' 41' ' ' TYR . 3.0 t80 -49.95 -65.96 0.47 Allowed 'General case' 0 N--CA 1.486 1.351 0 CA-C-O 123.13 1.443 . . . . 2.7200000000000002 107.628 178.854 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.548 ' N ' ' HD1' ' A' ' 41' ' ' TYR . 5.2 mt -53.97 -35.51 61.88 Favored 'General case' 0 C--N 1.288 -2.098 0 CA-C-N 114.57 -1.195 . . . . 1.5800000000000001 108.134 -178.63 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.501 ' HB1' ' O ' ' A' ' 39' ' ' ALA . . . -52.02 -29.39 20.79 Favored 'General case' 0 C--N 1.29 -2.003 0 N-CA-C 106.219 -1.771 . . . . 1.6499999999999999 106.219 177.006 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . 0.548 ' N ' ' O ' ' A' ' 41' ' ' TYR . . . -73.15 -39.25 53.47 Favored Glycine 0 N--CA 1.483 1.829 0 N-CA-C 106.722 -2.551 . . . . 1.1599999999999999 106.722 177.732 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.522 ' N ' ' O ' ' A' ' 42' ' ' LEU . 1.1 mttt -65.51 -38.03 88.5 Favored 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 108.728 -0.842 . . . . 2.5699999999999998 108.728 178.46 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.566 HG12 ' CMA' ' A' ' 82' ' ' HEC . 25.4 mt -58.85 -59.38 3.82 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.361 0 O-C-N 121.315 -0.865 . . . . 2.3399999999999999 109.011 179.485 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.476 ' HG3' ' CG2' ' A' ' 63' ' ' VAL . 3.4 tttt -59.46 -30.78 68.76 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 119.434 -0.906 . . . . 2.8799999999999999 109.123 179.894 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -78.77 -16.49 79.03 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.528 -1.429 . . . . 1.26 109.528 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 73.56 174.63 29.28 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.535 -1.426 . . . . 0.82999999999999996 109.535 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.462 ' HB3' ' O2D' ' A' ' 82' ' ' HEC . 0.1 OUTLIER -134.34 151.59 51.32 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.353 -1.086 . . . . 1.6699999999999999 109.559 -179.969 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -129.61 -47.21 1.16 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.195 -0.941 . . . . 2.2400000000000002 109.748 -179.859 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -135.33 26.53 3.21 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.88 -1.288 . . . . 1.3 109.88 -179.801 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.493 HG23 ' NZ ' ' A' ' 45' ' ' LYS . 19.7 t -84.73 -24.76 7.15 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.525 0 O-C-N 121.135 -1.215 . . . . 1.49 109.25 179.768 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.606 ' CD2' ' HG3' ' A' ' 23' ' ' PRO . 79.2 m95 -117.24 -66.54 1.07 Allowed 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.339 -0.85 . . . . 0.95999999999999996 109.681 -179.873 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 142.67 -13.44 2.45 Favored Glycine 0 N--CA 1.494 2.518 0 N-CA-C 109.995 -1.242 . . . . 1.4399999999999999 109.995 179.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . 0.459 ' HB3' ' O ' ' A' ' 21' ' ' VAL . 3.0 mp0 -80.11 -157.38 0.14 Allowed 'General case' 0 C--N 1.286 -2.154 0 O-C-N 121.861 -0.788 . . . . 4.8899999999999997 109.204 -179.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.575 ' CG2' ' HD2' ' A' ' 58' ' ' PRO . 1.0 OUTLIER -79.78 151.52 73.94 Favored Pre-proline 0 N--CA 1.49 1.529 0 N-CA-C 108.071 -1.085 . . . . 2.23 108.071 -179.989 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.575 ' HD2' ' CG2' ' A' ' 57' ' ' ILE . 28.8 Cg_endo -67.99 125.29 12.89 Favored 'Trans proline' 0 C--N 1.31 -1.479 0 C-N-CA 122.095 1.863 . . . . 0.85999999999999999 110.602 -179.558 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.566 ' CG ' ' HD2' ' A' ' 60' ' ' PRO . 22.9 ttp -85.03 142.95 39.11 Favored Pre-proline 0 N--CA 1.487 1.423 0 O-C-N 121.834 -0.541 . . . . 1.21 109.803 -178.931 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.566 ' HD2' ' CG ' ' A' ' 59' ' ' MET . 30.7 Cg_endo -72.83 175.61 10.1 Favored 'Trans proline' 0 C--N 1.311 -1.444 0 C-N-CA 122.347 2.032 . . . . 0.66000000000000003 110.067 179.225 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . 0.512 ' HD2' ' HB2' ' A' ' 60' ' ' PRO . 32.5 Cg_endo -73.29 90.64 0.88 Allowed 'Trans proline' 0 C--N 1.309 -1.537 0 C-N-CA 122.282 1.988 . . . . 0.97999999999999998 111.409 -179.071 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.512 ' OD1' ' N ' ' A' ' 62' ' ' ASN . 3.4 p30 -132.91 104.82 6.76 Favored 'General case' 0 N--CA 1.485 1.282 0 N-CA-C 108.432 -0.951 . . . . 1.02 108.432 179.168 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.476 ' HA ' HG23 ' A' ' 46' ' ' ILE . 1.4 t -65.76 -72.79 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.305 -1.352 0 O-C-N 121.055 -1.028 . . . . 1.5600000000000001 109.02 -179.772 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . 0.535 ' HB3' ' HA ' ' A' ' 70' ' ' ALA . 0.1 OUTLIER -154.49 -59.3 0.12 Allowed 'General case' 0 C--N 1.297 -1.677 0 O-C-N 121.364 -0.835 . . . . 1.8100000000000001 109.088 -179.657 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.506 HG22 ' CD1' ' A' ' 73' ' ' LEU . 57.0 t -160.04 -82.74 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.303 -1.454 0 N-CA-C 108.689 -0.856 . . . . 1.3100000000000001 108.689 179.771 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.425 ' N ' ' HB1' ' A' ' 70' ' ' ALA . 71.0 m -139.34 -121.42 0.12 Allowed 'General case' 0 C--N 1.305 -1.346 0 N-CA-C 108.456 -0.942 . . . . 1.9299999999999999 108.456 179.246 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -90.3 -83.69 0.25 Allowed 'General case' 0 N--CA 1.488 1.455 0 O-C-N 120.835 -1.166 . . . . 2.3700000000000001 109.584 179.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -70.25 -49.46 49.77 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.566 -0.708 . . . . 1.52 109.827 -179.684 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -47.4 -47.75 26.38 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.144 -0.972 . . . . 1.52 109.175 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . 0.535 ' HA ' ' HB3' ' A' ' 64' ' ' ASN . . . -63.14 -54.57 35.72 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.306 -0.871 . . . . 1.3999999999999999 109.452 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 19.4 tttt -50.64 -39.87 51.73 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.163 -0.961 . . . . 3.1699999999999999 108.829 179.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.95 -43.39 98.94 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.564 -0.71 . . . . 1.28 109.337 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.518 ' HB3' ' ND2' ' A' ' 64' ' ' ASN . 9.9 mt -60.56 -58.44 8.47 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.117 -0.989 . . . . 1.5900000000000001 109.129 179.746 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.415 ' C ' ' O ' ' A' ' 73' ' ' LEU . . . -45.67 -47.05 15.07 Favored 'General case' 0 N--CA 1.49 1.57 0 N-CA-C 108.398 -0.964 . . . . 1.3200000000000001 108.398 179.36 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.72 -46.53 88.82 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 108.074 -1.084 . . . . 1.45 108.074 178.898 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' TRP . . . . . 0.534 ' CH2' HD13 ' A' ' 80' ' ' LEU . 20.3 t90 -50.86 -31.34 17.02 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 108.517 -0.92 . . . . 0.90000000000000002 108.517 179.309 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.517 ' O ' ' N ' ' A' ' 80' ' ' LEU . 4.3 mt -71.95 -58.8 4.31 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 N-CA-C 108.662 -0.866 . . . . 1.3600000000000001 108.662 179.351 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.534 ' CD1' ' HB1' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -46.17 -30.96 2.16 Favored 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 107.841 -1.17 . . . . 2.6099999999999999 107.841 178.979 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.28 -30.24 21.04 Favored 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 108.344 -0.984 . . . . 2.54 108.344 178.816 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.534 HD13 ' CH2' ' A' ' 76' ' ' TRP . 6.7 mt -48.07 -38.34 17.25 Favored 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 108.377 -0.971 . . . . 1.4399999999999999 108.377 179.329 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.463 ' C ' ' O ' ' A' ' 80' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.672 0 CA-C-O 117.954 -1.022 . . . . 4.9800000000000004 109.942 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' HEC . . . . . 0.566 ' CMA' HG12 ' A' ' 46' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ASP . . . . . 0.471 ' HB2' ' NE1' ' A' ' 76' ' ' TRP . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.609 0 N-CA-C 109.466 -0.568 . . . . 2.76 109.466 . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.493 ' O ' ' HB2' ' A' ' 6' ' ' LYS . . . -48.19 -60.58 2.53 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.178 -0.951 . . . . 1.53 109.023 179.881 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.528 ' O ' ' HB2' ' A' ' 7' ' ' LYS . 0.4 OUTLIER -54.96 -25.76 31.84 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.501 -0.749 . . . . 1.75 109.424 179.848 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.47 ' O ' ' HB2' ' A' ' 7' ' ' LYS . 1.7 mt -71.26 -68.04 0.47 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.462 -0.774 . . . . 0.9 108.999 179.913 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.711 ' HB1' ' HB2' ' A' ' 10' ' ' CYS . . . -51.21 -45.29 61.82 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.088 -1.008 . . . . 0.43 108.281 179.172 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.836 ' HG3' HG21 ' A' ' 11' ' ' ILE . 0.0 OUTLIER -62.03 -42.9 99.67 Favored 'General case' 0 N--CA 1.485 1.299 0 N-CA-C 107.505 -1.294 . . . . 2.42 107.505 178.264 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.528 ' HB2' ' O ' ' A' ' 3' ' ' ASP . 7.8 mttp -51.95 -32.81 34.86 Favored 'General case' 0 C--N 1.299 -1.616 0 N-CA-C 107.633 -1.247 . . . . 2.71 107.633 179.251 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.721 ' CG ' HG22 ' A' ' 65' ' ' VAL . 4.5 m-80 -99.01 -88.74 0.33 Allowed 'General case' 0 C--N 1.3 -1.572 0 C-N-CA 119.877 -0.729 . . . . 0.85 110.517 -179.163 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.745 ' O ' HMC3 ' A' ' 82' ' ' HEC . 0.0 OUTLIER -160.9 -32.22 0.05 Allowed 'General case' 0 N--CA 1.499 2.019 0 C-N-CA 118.81 -1.156 . . . . 0.64 112.609 -178.306 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.711 ' HB2' ' HB1' ' A' ' 5' ' ' ALA . 56.0 m -42.29 -56.99 2.73 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.185 -0.947 . . . . 0.63 108.446 -177.403 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.836 HG21 ' HG3' ' A' ' 6' ' ' LYS . 13.0 mm -65.22 -26.96 40.91 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.722 0 C-N-CA 119.387 -0.925 . . . . 1.4 109.171 179.308 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.607 ' HB3' ' O ' ' A' ' 9' ' ' ASN . . . -46.75 -47.41 20.69 Favored 'General case' 0 N--CA 1.487 1.382 0 N-CA-C 108.198 -1.038 . . . . 0.45 108.198 179.335 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' CYS . . . . . 0.469 ' HB3' ' CG2' ' A' ' 21' ' ' VAL . 8.1 m -120.48 11.32 11.36 Favored 'General case' 0 N--CA 1.499 2.01 0 C-N-CA 119.016 -1.074 . . . . 0.44 110.66 179.125 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' HIS . . . . . 0.8 ' O ' HD13 ' A' ' 11' ' ' ILE . 93.0 m-70 -133.1 99.13 4.46 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.602 -1.311 . . . . 0.33 108.731 179.277 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.537 ' CB ' ' O ' ' A' ' 18' ' ' THR . 0.3 OUTLIER -79.71 -168.56 1.62 Allowed 'General case' 0 C--N 1.29 -2.016 0 O-C-N 121.037 -1.04 . . . . 2.02 108.962 179.877 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.441 ' O ' ' HG2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -90.31 -41.05 13.31 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.368 0 O-C-N 121.045 -1.035 . . . . 0.87 110.084 -179.252 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.503 ' HA ' ' HD3' ' A' ' 26' ' ' LYS . 47.2 tt0 -122.06 -32.0 3.78 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.129 -0.982 . . . . 1.96 109.105 179.959 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.537 ' O ' ' CB ' ' A' ' 15' ' ' GLN . 0.0 OUTLIER -102.67 158.95 15.88 Favored 'General case' 0 C--N 1.302 -1.485 0 O-C-N 121.508 -0.745 . . . . 1.57 109.208 179.831 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.484 ' HB2' ' O ' ' A' ' 22' ' ' GLY . 0.0 OUTLIER -127.3 158.1 38.13 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.04 -1.037 . . . . 2.13 109.693 -179.956 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -118.31 -62.14 2.24 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.266 -0.896 . . . . 0.91 109.432 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.498 HG12 HMD3 ' A' ' 82' ' ' HEC . 3.4 t -93.15 -64.35 1.27 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.247 -0.908 . . . . 0.63 109.216 179.822 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.484 ' O ' ' HB2' ' A' ' 19' ' ' LYS . . . -100.45 -147.68 21.33 Favored Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.468 -1.453 . . . . 0.49 109.468 179.799 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' PRO . . . . . 0.61 ' HG3' ' CD2' ' A' ' 54' ' ' TRP . 35.3 Cg_endo -79.54 157.94 25.32 Favored 'Trans proline' 0 C--N 1.305 -1.733 0 C-N-CA 122.799 2.333 . . . . 0.85 110.001 179.306 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.753 ' HB3' ' OD1' ' A' ' 27' ' ' ASP . . . -72.74 -177.6 2.38 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.141 -0.975 . . . . 0.68 108.559 179.122 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.539 ' CD2' ' HB3' ' A' ' 14' ' ' HIS . 29.5 mt -83.57 -57.63 3.15 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.05 -1.031 . . . . 0.71 109.965 -179.55 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.552 ' HG3' ' N ' ' A' ' 27' ' ' ASP . 3.5 pttt -45.11 -31.49 1.43 Allowed 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.375 -0.828 . . . . 2.19 110.085 -179.541 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ASP . . . . . 0.753 ' OD1' ' HB3' ' A' ' 24' ' ' ALA . 0.0 OUTLIER -81.02 -61.31 2.0 Allowed 'General case' 0 C--N 1.304 -1.386 0 O-C-N 121.108 -0.995 . . . . 1.28 109.7 -179.861 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.529 ' CG1' ' HG2' ' A' ' 23' ' ' PRO . 57.6 mt -42.98 -44.93 1.25 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.188 -0.945 . . . . 0.73 109.11 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.792 ' HA ' ' HB3' ' A' ' 33' ' ' ALA . . . -65.88 -57.5 7.76 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.519 -0.738 . . . . 1.1 109.305 179.552 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.473 ' HA ' ' HB2' ' A' ' 34' ' ' ASP . . . -65.72 -8.62 21.93 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.353 -0.842 . . . . 1.19 109.685 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.491 ' HB2' ' O ' ' A' ' 27' ' ' ASP . 0.0 OUTLIER -83.5 -49.22 9.48 Favored 'General case' 0 C--N 1.305 -1.352 0 O-C-N 121.243 -0.91 . . . . 1.68 109.185 -179.876 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.794 ' CB ' HD11 ' A' ' 42' ' ' LEU . 87.0 m-85 -132.43 -27.31 1.77 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.384 -0.822 . . . . 2.18 110.601 -179.807 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.839 ' HA ' ' HB3' ' A' ' 38' ' ' ALA . . . -88.65 41.16 1.0 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.084 -1.01 . . . . 3.17 109.639 -179.367 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.473 ' HB2' ' HA ' ' A' ' 30' ' ' ALA . 4.5 t70 -124.12 2.24 8.58 Favored 'General case' 0 C--N 1.293 -1.869 0 O-C-N 121.649 -0.657 . . . . 2.57 110.011 -179.597 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 16.9 mmtm -114.14 -99.44 0.43 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.036 -1.04 . . . . 5.37 111.302 -178.806 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 18.0 t0 -90.08 -131.24 0.09 Allowed 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.181 -0.949 . . . . 5.04 110.787 -178.174 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -87.63 34.21 0.71 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 120.966 -1.084 . . . . 3.36 109.347 -179.649 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.839 ' HB3' ' HA ' ' A' ' 33' ' ' ALA . . . -49.35 -22.73 1.19 Allowed 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.281 -0.887 . . . . 1.46 108.955 179.679 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.773 ' HB2' HD11 ' A' ' 78' ' ' LEU . . . -54.93 -55.88 25.73 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 121.059 -1.026 . . . . 1.09 108.508 179.409 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.67 ' O ' ' HB3' ' A' ' 43' ' ' ALA . 0.1 OUTLIER -69.73 -47.15 64.11 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 109.002 -0.74 . . . . 1.68 109.002 179.384 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.578 ' CD1' ' C ' ' A' ' 41' ' ' TYR . 3.0 t80 -49.95 -65.96 0.47 Allowed 'General case' 0 N--CA 1.486 1.351 0 CA-C-O 123.13 1.443 . . . . 1.91 107.628 178.854 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.794 HD11 ' CB ' ' A' ' 32' ' ' TYR . 5.2 mt -53.97 -35.51 61.88 Favored 'General case' 0 C--N 1.288 -2.098 0 CA-C-N 114.57 -1.195 . . . . 1.04 108.134 -178.63 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.67 ' HB3' ' O ' ' A' ' 40' ' ' THR . . . -52.02 -29.39 20.79 Favored 'General case' 0 C--N 1.29 -2.003 0 N-CA-C 106.219 -1.771 . . . . 1.14 106.219 177.006 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.548 ' N ' ' O ' ' A' ' 41' ' ' TYR . . . -73.15 -39.25 53.47 Favored Glycine 0 N--CA 1.483 1.829 0 N-CA-C 106.722 -2.551 . . . . 1.06 106.722 177.732 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.522 ' N ' ' O ' ' A' ' 42' ' ' LEU . 1.1 mttt -65.51 -38.03 88.5 Favored 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 108.728 -0.842 . . . . 2.19 108.728 178.46 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.739 HG22 ' O ' ' A' ' 62' ' ' ASN . 25.4 mt -58.85 -59.38 3.82 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.361 0 O-C-N 121.315 -0.865 . . . . 1.77 109.011 179.485 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.807 ' HG3' HG22 ' A' ' 63' ' ' VAL . 3.4 tttt -59.46 -30.78 68.76 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 119.434 -0.906 . . . . 2.44 109.123 179.894 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -78.77 -16.49 79.03 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.528 -1.429 . . . . 1.12 109.528 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 73.56 174.63 29.28 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.535 -1.426 . . . . 0.81 109.535 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.476 ' HB3' ' O2D' ' A' ' 82' ' ' HEC . 0.1 OUTLIER -134.34 151.59 51.32 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.353 -1.086 . . . . 1.24 109.559 -179.969 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -129.61 -47.21 1.16 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.195 -0.941 . . . . 1.72 109.748 -179.859 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -135.33 26.53 3.21 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.88 -1.288 . . . . 1.18 109.88 -179.801 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.467 HG21 ' NZ ' ' A' ' 45' ' ' LYS . 19.7 t -84.73 -24.76 7.15 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.525 0 O-C-N 121.135 -1.215 . . . . 0.87 109.25 179.768 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.61 ' CD2' ' HG3' ' A' ' 23' ' ' PRO . 79.2 m95 -117.24 -66.54 1.07 Allowed 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.339 -0.85 . . . . 0.96 109.681 -179.873 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 142.67 -13.44 2.45 Favored Glycine 0 N--CA 1.494 2.518 0 N-CA-C 109.995 -1.242 . . . . 1.06 109.995 179.713 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.454 ' HB3' ' O ' ' A' ' 21' ' ' VAL . 3.0 mp0 -80.11 -157.38 0.14 Allowed 'General case' 0 C--N 1.286 -2.154 0 O-C-N 121.861 -0.788 . . . . 4.18 109.204 -179.938 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.927 HG23 ' HD2' ' A' ' 58' ' ' PRO . 1.0 OUTLIER -79.78 151.52 73.94 Favored Pre-proline 0 N--CA 1.49 1.529 0 N-CA-C 108.071 -1.085 . . . . 1.66 108.071 -179.989 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.927 ' HD2' HG23 ' A' ' 57' ' ' ILE . 28.8 Cg_endo -67.99 125.29 12.89 Favored 'Trans proline' 0 C--N 1.31 -1.479 0 C-N-CA 122.095 1.863 . . . . 0.78 110.602 -179.558 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.574 ' CG ' ' HD2' ' A' ' 60' ' ' PRO . 22.9 ttp -85.03 142.95 39.11 Favored Pre-proline 0 N--CA 1.487 1.423 0 O-C-N 121.834 -0.541 . . . . 0.51 109.803 -178.931 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.574 ' HD2' ' CG ' ' A' ' 59' ' ' MET . 30.7 Cg_endo -72.83 175.61 10.1 Favored 'Trans proline' 0 C--N 1.311 -1.444 0 C-N-CA 122.347 2.032 . . . . 0.57 110.067 179.225 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' PRO . . . . . 0.538 ' HD2' ' HB2' ' A' ' 60' ' ' PRO . 32.5 Cg_endo -73.29 90.64 0.88 Allowed 'Trans proline' 0 C--N 1.309 -1.537 0 C-N-CA 122.282 1.988 . . . . 0.89 111.409 -179.071 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.739 ' O ' HG22 ' A' ' 46' ' ' ILE . 3.4 p30 -132.91 104.82 6.76 Favored 'General case' 0 N--CA 1.485 1.282 0 N-CA-C 108.432 -0.951 . . . . 1.02 108.432 179.168 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.807 HG22 ' HG3' ' A' ' 47' ' ' LYS . 1.4 t -65.76 -72.79 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.305 -1.352 0 O-C-N 121.055 -1.028 . . . . 0.9 109.02 -179.772 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ASN . . . . . 0.779 ' HA ' HBB3 ' A' ' 82' ' ' HEC . 0.8 OUTLIER -154.49 -59.3 0.12 Allowed 'General case' 0 C--N 1.297 -1.677 0 O-C-N 121.364 -0.835 . . . . 1.22 109.088 -179.657 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.822 HG23 HD12 ' A' ' 73' ' ' LEU . 57.0 t -160.04 -82.74 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.303 -1.454 0 N-CA-C 108.689 -0.856 . . . . 0.74 108.689 179.771 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.422 ' N ' HG12 ' A' ' 65' ' ' VAL . 71.0 m -139.34 -121.42 0.12 Allowed 'General case' 0 C--N 1.305 -1.346 0 N-CA-C 108.456 -0.942 . . . . 1.56 108.456 179.246 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -90.3 -83.69 0.25 Allowed 'General case' 0 N--CA 1.488 1.455 0 O-C-N 120.835 -1.166 . . . . 2.37 109.584 179.507 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -70.25 -49.46 49.77 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.566 -0.708 . . . . 0.95 109.827 -179.684 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ASP . . . . . 0.558 ' HB3' HG11 ' A' ' 65' ' ' VAL . 2.6 m-20 -47.4 -47.75 26.38 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.144 -0.972 . . . . 1.52 109.175 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.575 ' HA ' ' HB3' ' A' ' 64' ' ' ASN . . . -63.14 -54.57 35.72 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.306 -0.871 . . . . 0.69 109.452 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 19.4 tttt -50.64 -39.87 51.73 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.163 -0.961 . . . . 2.77 108.829 179.63 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.95 -43.39 98.94 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.564 -0.71 . . . . 0.78 109.337 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.822 HD12 HG23 ' A' ' 65' ' ' VAL . 9.9 mt -60.56 -58.44 8.47 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.117 -0.989 . . . . 1.05 109.129 179.746 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.415 ' C ' ' O ' ' A' ' 73' ' ' LEU . . . -45.67 -47.05 15.07 Favored 'General case' 0 N--CA 1.49 1.57 0 N-CA-C 108.398 -0.964 . . . . 0.76 108.398 179.36 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.72 -46.53 88.82 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 108.074 -1.084 . . . . 1.45 108.074 178.898 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' TRP . . . . . 0.879 ' CH2' HD11 ' A' ' 80' ' ' LEU . 20.3 t90 -50.86 -31.34 17.02 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 108.517 -0.92 . . . . 0.8 108.517 179.309 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.517 ' O ' ' N ' ' A' ' 80' ' ' LEU . 4.3 mt -71.95 -58.8 4.31 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 N-CA-C 108.662 -0.866 . . . . 0.9 108.662 179.351 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.773 HD11 ' HB2' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -46.17 -30.96 2.16 Favored 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 107.841 -1.17 . . . . 2.08 107.841 178.979 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.28 -30.24 21.04 Favored 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 108.344 -0.984 . . . . 2.03 108.344 178.816 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.879 HD11 ' CH2' ' A' ' 76' ' ' TRP . 6.7 mt -48.07 -38.34 17.25 Favored 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 108.377 -0.971 . . . . 1.44 108.377 179.329 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.463 ' C ' ' O ' ' A' ' 80' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.672 0 CA-C-O 117.954 -1.022 . . . . 4.53 109.942 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' HEC . . . . . 0.779 HBB3 ' HA ' ' A' ' 64' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . 0.471 ' HB2' ' NE1' ' A' ' 76' ' ' TRP . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.609 0 N-CA-C 109.466 -0.568 . . . . 2.76 109.466 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.493 ' O ' ' HB2' ' A' ' 6' ' ' LYS . . . -48.19 -60.58 2.53 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.178 -0.951 . . . . 1.53 109.023 179.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.528 ' O ' ' HB2' ' A' ' 7' ' ' LYS . 0.4 OUTLIER -54.96 -25.76 31.84 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.501 -0.749 . . . . 1.75 109.424 179.848 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.47 ' O ' ' HB2' ' A' ' 7' ' ' LYS . 1.7 mt -71.26 -68.04 0.47 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.462 -0.774 . . . . 0.9 108.999 179.913 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.711 ' HB1' ' HB2' ' A' ' 10' ' ' CYS . . . -51.21 -45.29 61.82 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.088 -1.008 . . . . 0.43 108.281 179.172 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.836 ' HG3' HG21 ' A' ' 11' ' ' ILE . 0.0 OUTLIER -62.03 -42.9 99.67 Favored 'General case' 0 N--CA 1.485 1.299 0 N-CA-C 107.505 -1.294 . . . . 2.42 107.505 178.264 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.528 ' HB2' ' O ' ' A' ' 3' ' ' ASP . 7.8 mttp -51.95 -32.81 34.86 Favored 'General case' 0 C--N 1.299 -1.616 0 N-CA-C 107.633 -1.247 . . . . 2.71 107.633 179.251 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.721 ' CG ' HG22 ' A' ' 65' ' ' VAL . 4.5 m-80 -99.01 -88.74 0.33 Allowed 'General case' 0 C--N 1.3 -1.572 0 C-N-CA 119.877 -0.729 . . . . 0.85 110.517 -179.163 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.745 ' O ' HMC3 ' A' ' 82' ' ' HEC . 0.0 OUTLIER -160.9 -32.22 0.05 Allowed 'General case' 0 N--CA 1.499 2.019 0 C-N-CA 118.81 -1.156 . . . . 0.64 112.609 -178.306 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.711 ' HB2' ' HB1' ' A' ' 5' ' ' ALA . 56.0 m -42.29 -56.99 2.73 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.185 -0.947 . . . . 0.63 108.446 -177.403 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.836 HG21 ' HG3' ' A' ' 6' ' ' LYS . 13.0 mm -65.22 -26.96 40.91 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.722 0 C-N-CA 119.387 -0.925 . . . . 1.4 109.171 179.308 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.607 ' HB3' ' O ' ' A' ' 9' ' ' ASN . . . -46.75 -47.41 20.69 Favored 'General case' 0 N--CA 1.487 1.382 0 N-CA-C 108.198 -1.038 . . . . 0.45 108.198 179.335 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . 0.469 ' HB3' ' CG2' ' A' ' 21' ' ' VAL . 8.1 m -120.48 11.32 11.36 Favored 'General case' 0 N--CA 1.499 2.01 0 C-N-CA 119.016 -1.074 . . . . 0.44 110.66 179.125 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . 0.8 ' O ' HD13 ' A' ' 11' ' ' ILE . 93.0 m-70 -133.1 99.13 4.46 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.602 -1.311 . . . . 0.33 108.731 179.277 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.537 ' CB ' ' O ' ' A' ' 18' ' ' THR . 0.3 OUTLIER -79.71 -168.56 1.62 Allowed 'General case' 0 C--N 1.29 -2.016 0 O-C-N 121.037 -1.04 . . . . 2.02 108.962 179.877 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.441 ' O ' ' HG2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -90.31 -41.05 13.31 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.368 0 O-C-N 121.045 -1.035 . . . . 0.87 110.084 -179.252 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.503 ' HA ' ' HD3' ' A' ' 26' ' ' LYS . 47.2 tt0 -122.06 -32.0 3.78 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.129 -0.982 . . . . 1.96 109.105 179.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.537 ' O ' ' CB ' ' A' ' 15' ' ' GLN . 0.0 OUTLIER -102.67 158.95 15.88 Favored 'General case' 0 C--N 1.302 -1.485 0 O-C-N 121.508 -0.745 . . . . 1.57 109.208 179.831 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.484 ' HB2' ' O ' ' A' ' 22' ' ' GLY . 0.0 OUTLIER -127.3 158.1 38.13 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.04 -1.037 . . . . 2.13 109.693 -179.956 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -118.31 -62.14 2.24 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.266 -0.896 . . . . 0.91 109.432 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.498 HG12 HMD3 ' A' ' 82' ' ' HEC . 3.4 t -93.15 -64.35 1.27 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.247 -0.908 . . . . 0.63 109.216 179.822 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.484 ' O ' ' HB2' ' A' ' 19' ' ' LYS . . . -100.45 -147.68 21.33 Favored Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.468 -1.453 . . . . 0.49 109.468 179.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . 0.61 ' HG3' ' CD2' ' A' ' 54' ' ' TRP . 35.3 Cg_endo -79.54 157.94 25.32 Favored 'Trans proline' 0 C--N 1.305 -1.733 0 C-N-CA 122.799 2.333 . . . . 0.85 110.001 179.306 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.753 ' HB3' ' OD1' ' A' ' 27' ' ' ASP . . . -72.74 -177.6 2.38 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.141 -0.975 . . . . 0.68 108.559 179.122 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.539 ' CD2' ' HB3' ' A' ' 14' ' ' HIS . 29.5 mt -83.57 -57.63 3.15 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.05 -1.031 . . . . 0.71 109.965 -179.55 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.552 ' HG3' ' N ' ' A' ' 27' ' ' ASP . 3.5 pttt -45.11 -31.49 1.43 Allowed 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.375 -0.828 . . . . 2.19 110.085 -179.541 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . 0.753 ' OD1' ' HB3' ' A' ' 24' ' ' ALA . 0.0 OUTLIER -81.02 -61.31 2.0 Allowed 'General case' 0 C--N 1.304 -1.386 0 O-C-N 121.108 -0.995 . . . . 1.28 109.7 -179.861 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.529 ' CG1' ' HG2' ' A' ' 23' ' ' PRO . 57.6 mt -42.98 -44.93 1.25 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.188 -0.945 . . . . 0.73 109.11 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.792 ' HA ' ' HB3' ' A' ' 33' ' ' ALA . . . -65.88 -57.5 7.76 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.519 -0.738 . . . . 1.1 109.305 179.552 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.473 ' HA ' ' HB2' ' A' ' 34' ' ' ASP . . . -65.72 -8.62 21.93 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.353 -0.842 . . . . 1.19 109.685 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.491 ' HB2' ' O ' ' A' ' 27' ' ' ASP . 0.0 OUTLIER -83.5 -49.22 9.48 Favored 'General case' 0 C--N 1.305 -1.352 0 O-C-N 121.243 -0.91 . . . . 1.68 109.185 -179.876 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.794 ' CB ' HD11 ' A' ' 42' ' ' LEU . 87.0 m-85 -132.43 -27.31 1.77 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.384 -0.822 . . . . 2.18 110.601 -179.807 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.839 ' HA ' ' HB3' ' A' ' 38' ' ' ALA . . . -88.65 41.16 1.0 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.084 -1.01 . . . . 3.17 109.639 -179.367 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.473 ' HB2' ' HA ' ' A' ' 30' ' ' ALA . 4.5 t70 -124.12 2.24 8.58 Favored 'General case' 0 C--N 1.293 -1.869 0 O-C-N 121.649 -0.657 . . . . 2.57 110.011 -179.597 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 16.9 mmtm -114.14 -99.44 0.43 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.036 -1.04 . . . . 5.37 111.302 -178.806 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 18.0 t0 -90.08 -131.24 0.09 Allowed 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.181 -0.949 . . . . 5.04 110.787 -178.174 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -87.63 34.21 0.71 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 120.966 -1.084 . . . . 3.36 109.347 -179.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.839 ' HB3' ' HA ' ' A' ' 33' ' ' ALA . . . -49.35 -22.73 1.19 Allowed 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.281 -0.887 . . . . 1.46 108.955 179.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.773 ' HB2' HD11 ' A' ' 78' ' ' LEU . . . -54.93 -55.88 25.73 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 121.059 -1.026 . . . . 1.09 108.508 179.409 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.67 ' O ' ' HB3' ' A' ' 43' ' ' ALA . 0.1 OUTLIER -69.73 -47.15 64.11 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 109.002 -0.74 . . . . 1.68 109.002 179.384 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.578 ' CD1' ' C ' ' A' ' 41' ' ' TYR . 3.0 t80 -49.95 -65.96 0.47 Allowed 'General case' 0 N--CA 1.486 1.351 0 CA-C-O 123.13 1.443 . . . . 1.91 107.628 178.854 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.794 HD11 ' CB ' ' A' ' 32' ' ' TYR . 5.2 mt -53.97 -35.51 61.88 Favored 'General case' 0 C--N 1.288 -2.098 0 CA-C-N 114.57 -1.195 . . . . 1.04 108.134 -178.63 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.67 ' HB3' ' O ' ' A' ' 40' ' ' THR . . . -52.02 -29.39 20.79 Favored 'General case' 0 C--N 1.29 -2.003 0 N-CA-C 106.219 -1.771 . . . . 1.14 106.219 177.006 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.548 ' N ' ' O ' ' A' ' 41' ' ' TYR . . . -73.15 -39.25 53.47 Favored Glycine 0 N--CA 1.483 1.829 0 N-CA-C 106.722 -2.551 . . . . 1.06 106.722 177.732 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.522 ' N ' ' O ' ' A' ' 42' ' ' LEU . 1.1 mttt -65.51 -38.03 88.5 Favored 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 108.728 -0.842 . . . . 2.19 108.728 178.46 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.739 HG22 ' O ' ' A' ' 62' ' ' ASN . 25.4 mt -58.85 -59.38 3.82 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.361 0 O-C-N 121.315 -0.865 . . . . 1.77 109.011 179.485 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.807 ' HG3' HG22 ' A' ' 63' ' ' VAL . 3.4 tttt -59.46 -30.78 68.76 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 119.434 -0.906 . . . . 2.44 109.123 179.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -78.77 -16.49 79.03 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.528 -1.429 . . . . 1.12 109.528 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 73.56 174.63 29.28 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.535 -1.426 . . . . 0.81 109.535 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.476 ' HB3' ' O2D' ' A' ' 82' ' ' HEC . 0.1 OUTLIER -134.34 151.59 51.32 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.353 -1.086 . . . . 1.24 109.559 -179.969 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -129.61 -47.21 1.16 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.195 -0.941 . . . . 1.72 109.748 -179.859 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -135.33 26.53 3.21 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.88 -1.288 . . . . 1.18 109.88 -179.801 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.467 HG21 ' NZ ' ' A' ' 45' ' ' LYS . 19.7 t -84.73 -24.76 7.15 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.525 0 O-C-N 121.135 -1.215 . . . . 0.87 109.25 179.768 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.61 ' CD2' ' HG3' ' A' ' 23' ' ' PRO . 79.2 m95 -117.24 -66.54 1.07 Allowed 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.339 -0.85 . . . . 0.96 109.681 -179.873 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 142.67 -13.44 2.45 Favored Glycine 0 N--CA 1.494 2.518 0 N-CA-C 109.995 -1.242 . . . . 1.06 109.995 179.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.454 ' HB3' ' O ' ' A' ' 21' ' ' VAL . 3.0 mp0 -80.11 -157.38 0.14 Allowed 'General case' 0 C--N 1.286 -2.154 0 O-C-N 121.861 -0.788 . . . . 4.18 109.204 -179.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.927 HG23 ' HD2' ' A' ' 58' ' ' PRO . 1.0 OUTLIER -79.78 151.52 73.94 Favored Pre-proline 0 N--CA 1.49 1.529 0 N-CA-C 108.071 -1.085 . . . . 1.66 108.071 -179.989 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.927 ' HD2' HG23 ' A' ' 57' ' ' ILE . 28.8 Cg_endo -67.99 125.29 12.89 Favored 'Trans proline' 0 C--N 1.31 -1.479 0 C-N-CA 122.095 1.863 . . . . 0.78 110.602 -179.558 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.574 ' CG ' ' HD2' ' A' ' 60' ' ' PRO . 22.9 ttp -85.03 142.95 39.11 Favored Pre-proline 0 N--CA 1.487 1.423 0 O-C-N 121.834 -0.541 . . . . 0.51 109.803 -178.931 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.574 ' HD2' ' CG ' ' A' ' 59' ' ' MET . 30.7 Cg_endo -72.83 175.61 10.1 Favored 'Trans proline' 0 C--N 1.311 -1.444 0 C-N-CA 122.347 2.032 . . . . 0.57 110.067 179.225 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . 0.538 ' HD2' ' HB2' ' A' ' 60' ' ' PRO . 32.5 Cg_endo -73.29 90.64 0.88 Allowed 'Trans proline' 0 C--N 1.309 -1.537 0 C-N-CA 122.282 1.988 . . . . 0.89 111.409 -179.071 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.739 ' O ' HG22 ' A' ' 46' ' ' ILE . 3.4 p30 -132.91 104.82 6.76 Favored 'General case' 0 N--CA 1.485 1.282 0 N-CA-C 108.432 -0.951 . . . . 1.02 108.432 179.168 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.807 HG22 ' HG3' ' A' ' 47' ' ' LYS . 1.4 t -65.76 -72.79 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.305 -1.352 0 O-C-N 121.055 -1.028 . . . . 0.9 109.02 -179.772 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . 0.779 ' HA ' HBB3 ' A' ' 82' ' ' HEC . 0.1 OUTLIER -154.49 -59.3 0.12 Allowed 'General case' 0 C--N 1.297 -1.677 0 O-C-N 121.364 -0.835 . . . . 1.22 109.088 -179.657 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.822 HG23 HD12 ' A' ' 73' ' ' LEU . 57.0 t -160.04 -82.74 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.303 -1.454 0 N-CA-C 108.689 -0.856 . . . . 0.74 108.689 179.771 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.422 ' N ' HG12 ' A' ' 65' ' ' VAL . 71.0 m -139.34 -121.42 0.12 Allowed 'General case' 0 C--N 1.305 -1.346 0 N-CA-C 108.456 -0.942 . . . . 1.56 108.456 179.246 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -90.3 -83.69 0.25 Allowed 'General case' 0 N--CA 1.488 1.455 0 O-C-N 120.835 -1.166 . . . . 2.37 109.584 179.507 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -70.25 -49.46 49.77 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.566 -0.708 . . . . 0.95 109.827 -179.684 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . 0.558 ' HB3' HG11 ' A' ' 65' ' ' VAL . 2.6 m-20 -47.4 -47.75 26.38 Favored 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.144 -0.972 . . . . 1.52 109.175 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.575 ' HA ' ' HB3' ' A' ' 64' ' ' ASN . . . -63.14 -54.57 35.72 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.306 -0.871 . . . . 0.69 109.452 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 19.4 tttt -50.64 -39.87 51.73 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.163 -0.961 . . . . 2.77 108.829 179.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.95 -43.39 98.94 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.564 -0.71 . . . . 0.78 109.337 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.822 HD12 HG23 ' A' ' 65' ' ' VAL . 9.9 mt -60.56 -58.44 8.47 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.117 -0.989 . . . . 1.05 109.129 179.746 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.415 ' C ' ' O ' ' A' ' 73' ' ' LEU . . . -45.67 -47.05 15.07 Favored 'General case' 0 N--CA 1.49 1.57 0 N-CA-C 108.398 -0.964 . . . . 0.76 108.398 179.36 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.72 -46.53 88.82 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 108.074 -1.084 . . . . 1.45 108.074 178.898 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' TRP . . . . . 0.879 ' CH2' HD11 ' A' ' 80' ' ' LEU . 20.3 t90 -50.86 -31.34 17.02 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 108.517 -0.92 . . . . 0.8 108.517 179.309 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.517 ' O ' ' N ' ' A' ' 80' ' ' LEU . 4.3 mt -71.95 -58.8 4.31 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 N-CA-C 108.662 -0.866 . . . . 0.9 108.662 179.351 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.773 HD11 ' HB2' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -46.17 -30.96 2.16 Favored 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 107.841 -1.17 . . . . 2.08 107.841 178.979 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.28 -30.24 21.04 Favored 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 108.344 -0.984 . . . . 2.03 108.344 178.816 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.879 HD11 ' CH2' ' A' ' 76' ' ' TRP . 6.7 mt -48.07 -38.34 17.25 Favored 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 108.377 -0.971 . . . . 1.44 108.377 179.329 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.463 ' C ' ' O ' ' A' ' 80' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.672 0 CA-C-O 117.954 -1.022 . . . . 4.53 109.942 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' HEC . . . . . 0.779 HBB3 ' HA ' ' A' ' 64' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 stop_ save_