data_1hdp_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 1hdp _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' ' ' ARG . . . . . 1.607 ' CA ' ' H ' ' A' ' 2' ' ' ARG 1.024 0.0 OUTLIER . . . . . 3 N--CA 0.434 -51.256 1 N-CA-C 90.327 -7.656 . . . . 0.0 90.327 . . . . . . . . . 5 3 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 1.628 ' HD2' ' CB ' ' A' ' 2' ' ' ARG 1.261 0.0 OUTLIER -16.25 -60.83 0.01 OUTLIER 'General case' 4 C--O 0.416 -42.769 1 CA-C-O 30.911 -42.471 . . . . 0.0 115.988 -179.856 . . . . . . . . 6 4 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 1.639 ' CB ' ' HG3' ' A' ' 4' ' ' LYS 1.511 0.0 OUTLIER 53.7 63.35 2.23 Favored 'General case' 4 C--O 0.15 -56.784 5 O-C-N 165.273 26.608 . . . . 0.0 127.318 179.773 . . . . . . . . 6 4 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 1.639 ' HG3' ' CB ' ' A' ' 3' ' ' LYS 1.324 1.9 mptp? -132.87 60.17 1.71 Allowed 'General case' 4 N--CA 0.625 -41.71 5 CA-C-N 161.937 20.335 . . . . 0.0 144.721 -179.844 . . . . . . . . 5 3 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 1.617 HH22 ' CZ ' ' A' ' 5' ' ' ARG 1.132 27.3 ptt180 -71.47 109.25 5.32 Favored 'General case' 4 N--CA 0.827 -31.601 5 N-CA-C 138.3 10.111 . . . . 0.0 138.3 -179.828 . . . . . . . . 5 3 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 1.625 ' CB ' ' H ' ' A' ' 7' ' ' SER 0.997 0.0 OUTLIER -56.85 -177.92 0.02 OUTLIER 'General case' 4 C--O 0.388 -44.256 1 CA-C-N 106.25 -4.977 . . . . 0.0 119.197 179.634 . . . . . . . . 6 4 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 1.625 ' H ' ' CB ' ' A' ' 6' ' ' THR 1.158 44.6 m 142.43 41.4 0.0 OUTLIER 'General case' 4 N--CA 0.668 -39.542 5 CA-C-O 168.757 23.17 . . . . 0.0 142.47 179.783 . . . . . . . . 5 3 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 1.617 HG12 ' CD1' ' A' ' 8' ' ' ILE 0.338 3.4 mp -106.44 -163.83 0.17 Allowed 'Isoleucine or valine' 4 C--O 0.296 -49.108 4 O-C-N 33.054 -56.029 . . . . 0.0 107.995 178.979 . . . . . . . . 5 3 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 1.531 ' HA ' ' CG ' ' A' ' 9' ' ' GLU 0.906 1.6 mt-10 178.18 -58.56 0.01 OUTLIER 'General case' 4 C--O 0.5 -38.346 5 O-C-N 13.97 -67.956 . . . . 0.0 144.074 -177.441 . . . . . . . . 5 3 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' THR . . . . . 1.465 ' HA ' ' N ' ' A' ' 10' ' ' THR 1.102 19.7 m -125.1 -142.33 0.3 Allowed 'General case' 3 C--N 0.743 -25.773 4 O-C-N 86.354 -22.716 . . . . 0.0 158.467 -179.501 . . . . . . . . 5 3 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . 1.533 HD22 ' CB ' ' A' ' 11' ' ' ASN . 0.0 OUTLIER -49.08 -30.96 7.06 Favored 'General case' 3 N--CA 1.209 -12.495 1 O-C-N 130.972 5.17 . . . . 0.0 113.406 -179.567 . . . . . . . . 5 4 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 1.032 HG21 ' CD2' ' A' ' 16' ' ' LEU 0.647 0.3 OUTLIER -63.57 -47.57 90.85 Favored 'Isoleucine or valine' 2 C--N 1.078 -11.211 1 N-CA-C 122.705 4.335 . . . . 0.0 122.705 179.694 . . . . . . . . 6 4 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 1.683 ' HE ' ' CD ' ' A' ' 13' ' ' ARG . 0.0 OUTLIER -55.46 -33.78 63.93 Favored 'General case' 1 N--CA 1.356 -5.172 0 CA-C-N 112.578 -2.101 . . . . 0.0 111.531 179.624 . . . . . . . . 4 4 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.408 ' N ' ' HG2' ' A' ' 13' ' ' ARG . 1.9 t80 -57.5 -48.88 78.04 Favored 'General case' 1 N--CA 1.365 -4.69 0 O-C-N 125.986 2.054 . . . . 0.0 108.46 179.504 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -71.77 -29.13 64.15 Favored 'General case' 0 C--N 1.256 -3.461 0 CA-C-O 122.576 1.179 . . . . 0.0 112.066 179.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 1.032 ' CD2' HG21 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -72.49 -25.54 61.45 Favored 'General case' 0 C--O 1.158 -3.732 0 CA-C-N 113.621 -1.627 . . . . 0.0 109.492 -179.878 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 1.368 ' OE1' ' CG ' ' A' ' 17' ' ' GLU . 0.3 OUTLIER -53.32 -60.25 3.53 Favored 'General case' 1 C--N 1.2 -5.929 0 CA-C-N 114.771 -1.104 . . . . 0.0 112.728 -178.659 . . . . . . . . 4 4 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 1.595 ' HE2' ' CD ' ' A' ' 18' ' ' LYS . 9.6 ttmt -69.1 -27.14 65.33 Favored 'General case' 0 C--N 1.246 -3.899 0 CA-C-O 123.695 1.712 . . . . 0.0 113.241 -179.251 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 2.8 m -78.1 -31.14 49.87 Favored 'General case' 2 C--N 1.21 -5.474 0 CA-C-N 112.867 -1.969 . . . . 0.0 115.478 -178.908 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 1.424 ' CZ ' ' CD1' ' A' ' 20' ' ' PHE . 44.5 t80 -59.03 -56.54 20.96 Favored 'General case' 2 C--O 1.106 -6.471 0 CA-C-O 124.89 2.281 . . . . 0.0 113.163 -179.327 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 1.632 HD11 ' CG ' ' A' ' 21' ' ' LEU . 0.5 OUTLIER -64.27 -26.26 68.42 Favored 'General case' 3 C--N 1.13 -8.966 0 N-CA-C 119.252 3.056 . . . . 0.0 119.252 -179.146 . . . . . . . . 4 4 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.36 -43.21 82.03 Favored 'General case' 4 C--N 1.166 -7.379 0 CA-C-O 123.213 1.483 . . . . 0.0 112.85 -179.561 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 1.279 ' C ' ' CA ' ' A' ' 24' ' ' GLN 0.257 4.3 m-20 -150.83 136.25 17.85 Favored 'General case' 4 C--O 0.751 -25.173 1 CA-C-O 130.213 4.816 . . . . 0.0 107.265 -179.885 . . . . . . . . 5 3 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 1.383 HE21 ' CG ' ' A' ' 24' ' ' GLN 0.254 1.8 tt0 -115.78 15.24 16.42 Favored 'General case' 4 C--N 0.867 -20.37 3 O-C-N 98.477 -15.14 . . . . 0.0 114.521 179.848 . . . . . . . . 5 3 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 1.55 ' HZ2' ' CE ' ' A' ' 25' ' ' LYS . 0.2 OUTLIER -132.67 71.33 78.75 Favored Pre-proline 4 C--N 1.192 -6.276 0 C-N-CA 126.669 1.987 . . . . 0.0 113.851 179.87 . . . . . . . . 4 4 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.501 ' HB2' ' CD1' ' A' ' 31' ' ' ILE . 4.8 Cg_endo -67.57 134.19 32.21 Favored 'Trans proline' 3 N--CA 1.32 -8.688 0 O-C-N 125.34 2.231 . . . . 0.0 114.17 -179.84 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -86.54 -172.08 3.85 Favored 'General case' 1 C--N 1.232 -4.529 0 CA-C-O 122.31 1.052 . . . . 0.0 108.292 179.969 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 30.4 t -73.93 -44.86 53.62 Favored 'General case' 0 C--N 1.261 -3.246 0 CA-C-N 112.93 -1.941 . . . . 0.0 112.056 -179.678 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 1.305 ' CB ' ' CD ' ' A' ' 29' ' ' GLU . 9.5 mt-10 -71.18 -39.98 71.52 Favored 'General case' 0 N--CA 1.393 -3.28 0 CA-C-N 113.603 -1.635 . . . . 0.0 112.6 -179.22 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 1.29 ' HG3' ' OE1' ' A' ' 30' ' ' GLU . 5.4 tp10 -54.83 -37.21 65.86 Favored 'General case' 0 C--N 1.278 -2.512 0 CA-C-N 114.302 -1.317 . . . . 0.0 113.111 -179.477 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 1.328 HD12 ' CG1' ' A' ' 31' ' ' ILE . 21.0 mt -74.51 -48.67 34.35 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.71 0 CA-C-N 114.778 -1.101 . . . . 0.0 112.151 -179.056 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.443 ' C ' HD12 ' A' ' 32' ' ' LEU . 2.0 pp -59.64 -32.24 70.26 Favored 'General case' 0 N--CA 1.408 -2.564 0 CA-C-N 114.109 -1.405 . . . . 0.0 109.963 -179.685 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 1.536 HD22 ' CG ' ' A' ' 33' ' ' LEU . 0.1 OUTLIER -65.94 -48.59 70.86 Favored 'General case' 0 N--CA 1.404 -2.765 0 O-C-N 125.177 1.548 . . . . 0.0 109.739 179.867 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -67.45 -24.12 31.0 Favored 'Isoleucine or valine' 0 C--N 1.279 -2.495 0 CA-C-N 114.347 -1.297 . . . . 0.0 111.473 -179.784 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -69.06 -31.24 69.87 Favored 'General case' 0 C--O 1.166 -3.324 0 CA-C-N 114.674 -1.148 . . . . 0.0 111.233 -179.643 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 1.452 ' HG2' ' CD ' ' A' ' 36' ' ' GLU . 11.8 tt0 -70.2 -16.78 63.11 Favored 'General case' 0 C--O 1.156 -3.829 0 N-CA-C 114.084 1.142 . . . . 0.0 114.084 -179.355 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 1.532 HE21 ' CG ' ' A' ' 37' ' ' GLN . 3.1 tp60 -67.29 -35.06 78.7 Favored 'General case' 3 C--O 1.122 -5.645 0 CA-C-N 115.107 -0.952 . . . . 0.0 111.901 -179.761 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 1.596 ' HG ' ' CA ' ' A' ' 38' ' ' LEU 0.483 0.4 OUTLIER 175.54 -109.11 0.0 OUTLIER 'General case' 3 C--O 0.752 -25.097 2 CA-C-O 136.246 7.689 . . . . 0.0 123.861 179.831 . . . . . . . . 6 4 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . 1.642 ' HD1' ' CD2' ' A' ' 39' ' ' HIS 0.415 22.0 m-70 -107.57 68.22 0.71 Allowed 'General case' 2 C--N 0.729 -26.399 2 O-C-N 97.782 -15.574 . . . . 0.0 123.43 -178.204 . . . . . . . . 5 3 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 1.641 ' HE2' ' SD ' ' A' ' 40' ' ' MET . 0.0 OUTLIER -151.47 132.58 14.38 Favored 'General case' 2 C--O 0.866 -19.108 0 O-C-N 124.563 1.164 . . . . 0.0 109.609 -179.911 . . . . . . . . 4 4 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 1.37 ' CG ' ' CA ' ' A' ' 41' ' ' GLU . 0.2 OUTLIER -123.69 160.14 27.86 Favored 'General case' 2 C--N 1.046 -12.592 3 O-C-N 108.42 -8.925 . . . . 0.0 114.638 -177.956 . . . . . . . . 5 4 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 1.588 ' HE3' ' CD ' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -47.08 -36.1 7.76 Favored 'General case' 0 C--O 1.16 -3.61 0 C-N-CA 124.479 1.112 . . . . 0.0 111.66 -178.397 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 1.356 ' OE2' ' CG ' ' A' ' 43' ' ' GLU . 23.0 tt0 -55.74 -88.02 0.0 OUTLIER 'General case' 0 N--CA 1.397 -3.103 0 CA-C-O 118.415 -0.803 . . . . 0.0 112.621 -178.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.549 ' HA ' HG11 ' A' ' 47' ' ' VAL 0.589 0.2 OUTLIER -44.21 -30.04 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.392 -3.372 0 O-C-N 125.908 2.005 . . . . 0.0 113.635 -179.777 . . . . . . . . 4 4 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.566 HG23 HG23 ' A' ' 31' ' ' ILE . 1.0 OUTLIER -53.25 -68.88 0.13 Allowed 'Isoleucine or valine' 0 C--O 1.185 -2.324 0 O-C-N 123.975 0.797 . . . . 0.0 111.125 -179.677 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 1.628 HH21 ' CZ ' ' A' ' 46' ' ' ARG . 12.1 ttt180 -55.66 -50.03 71.32 Favored 'General case' 0 N--CA 1.397 -3.105 0 CA-C-O 118.325 -0.845 . . . . 0.0 109.222 -179.246 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.549 HG11 ' HA ' ' A' ' 44' ' ' VAL 0.616 0.2 OUTLIER -49.91 -36.16 11.46 Favored 'Isoleucine or valine' 0 C--O 1.174 -2.873 0 O-C-N 124.518 1.136 . . . . 0.0 113.174 179.643 . . . . . . . . 4 4 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' TRP . . . . . 0.745 ' CZ3' ' HB3' ' A' ' 16' ' ' LEU . 33.6 t90 -69.98 -81.14 0.05 OUTLIER 'General case' 0 N--CA 1.391 -3.384 0 N-CA-C 105.693 -1.965 . . . . 0.0 105.693 178.775 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.551 ' CE1' ' HG ' ' A' ' 16' ' ' LEU . 20.2 m-85 -31.63 -41.71 0.05 OUTLIER 'General case' 0 CA--C 1.459 -2.542 0 N-CA-C 116.029 1.863 . . . . 0.0 116.029 179.773 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -62.86 -63.54 1.18 Allowed 'General case' 0 N--CA 1.384 -3.74 0 O-C-N 124.211 0.945 . . . . 0.0 109.079 -179.31 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -65.93 -23.85 66.7 Favored 'General case' 0 C--O 1.175 -2.833 0 O-C-N 124.486 1.116 . . . . 0.0 111.348 -178.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 1.505 ' CZ ' HH21 ' A' ' 52' ' ' ARG . 18.6 tpt180 -66.42 -45.21 80.67 Favored 'General case' 0 N--CA 1.392 -3.368 0 O-C-N 123.973 0.796 . . . . 0.0 111.203 -179.573 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 1.612 HH22 ' CZ ' ' A' ' 53' ' ' ARG . 0.0 OUTLIER -75.83 -15.84 60.17 Favored 'General case' 0 C--N 1.271 -2.843 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 -179.135 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 1.347 ' CD ' ' CB ' ' A' ' 54' ' ' GLN . 43.4 tt0 -72.27 -27.66 62.63 Favored 'General case' 0 N--CA 1.39 -3.432 0 O-C-N 125.071 1.482 . . . . 0.0 110.557 -179.44 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 1.61 ' HE2' ' CD ' ' A' ' 55' ' ' LYS . 25.7 tttt -74.61 -18.41 60.56 Favored 'General case' 1 N--CA 1.377 -4.079 0 O-C-N 125.273 1.608 . . . . 0.0 108.873 -179.336 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 1.369 ' HG2' ' CB ' ' A' ' 56' ' ' GLU . 0.6 OUTLIER -76.62 -48.41 19.22 Favored 'General case' 1 C--O 1.064 -8.687 0 CA-C-O 123.374 1.559 . . . . 0.0 110.523 -179.119 . . . . . . . . 4 4 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 1.631 ' HZ3' ' CB ' ' A' ' 57' ' ' LYS 0.304 2.4 mmtm -61.59 142.8 56.88 Favored 'General case' 4 C--O 0.667 -29.559 1 CA-C-O 136.254 7.692 . . . . 0.0 113.185 -179.124 . . . . . . . . 5 3 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 1.648 ' CB ' ' H ' ' A' ' 59' ' ' ILE 0.901 8.4 mmt85 158.52 72.79 0.0 OUTLIER 'General case' 4 C--O 0.279 -50.004 5 CA-C-O 167.64 22.638 . . . . 0.0 144.455 179.67 . . . . . . . . 5 3 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 1.648 ' H ' ' CB ' ' A' ' 58' ' ' ARG 1.173 0.9 OUTLIER -110.09 11.67 8.76 Favored 'Isoleucine or valine' 4 C--N 0.341 -43.266 5 O-C-N 24.194 -61.566 . . . . 0.0 130.355 178.282 . . . . . . . . 6 4 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . 1.633 ' HA ' ' CD ' ' A' ' 61' ' ' PRO 1.262 0.0 OUTLIER -17.54 -175.18 0.0 OUTLIER Pre-proline 4 C--O 0.091 -59.875 4 N-CA-C 156.508 16.855 . . . . 0.0 156.508 -179.649 . . . . . . . . 6 4 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . 1.651 ' HA ' ' CB ' ' A' ' 62' ' ' CYS 1.583 16.4 Cg_exo 119.77 -86.92 0.0 OUTLIER 'Trans proline' 4 CA--C 0.162 -68.077 5 C-N-CA 171.772 34.982 . . . . 0.0 84.563 179.886 . . . . . . . . 5 3 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . 1.68 ' SG ' ' HB3' ' A' ' 63' ' ' SER 1.511 1.9 t 1.69 -101.61 0.0 OUTLIER 'General case' 4 N--CA 0.177 -64.115 5 CA-C-O 174.003 25.668 . . . . 0.0 56.978 -178.763 . . . . . . . . 5 3 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' SER . . . . . 1.68 ' HB3' ' SG ' ' A' ' 62' ' ' CYS 1.693 0.0 OUTLIER . . . . . 4 N--CA 0.396 -53.166 4 CA-C-N 19.382 -44.463 . . . . 0.0 81.839 179.924 . . . . . . . . 5 3 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.653 HH21 HH12 ' A' ' 2' ' ' ARG 1.024 0.0 OUTLIER . . . . . 3 N--CA 0.434 -51.256 1 N-CA-C 90.327 -7.656 . . . . 0.0 90.327 . . . . . . . . . 5 3 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.653 HH12 HH21 ' A' ' 1' ' ' ARG 1.261 0.0 OUTLIER -16.25 -60.83 0.01 OUTLIER 'General case' 4 C--O 0.416 -42.769 1 CA-C-O 30.911 -42.471 . . . . 0.0 115.988 -179.856 . . . . . . . . 6 4 . 1 . 001 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . 1.511 0.0 OUTLIER 53.7 63.35 2.23 Favored 'General case' 4 C--O 0.15 -56.784 5 O-C-N 165.273 26.608 . . . . 0.0 127.318 179.773 . . . . . . . . 5 3 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . 1.324 1.9 mptp? -132.87 60.17 1.71 Allowed 'General case' 4 N--CA 0.625 -41.71 5 CA-C-N 161.937 20.335 . . . . 0.0 144.721 -179.844 . . . . . . . . 4 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 1.106 ' CZ ' ' HB3' ' A' ' 7' ' ' SER 1.132 27.3 ptt180 -71.47 109.25 5.32 Favored 'General case' 4 N--CA 0.827 -31.601 5 N-CA-C 138.3 10.111 . . . . 0.0 138.3 -179.828 . . . . . . . . 5 3 . 1 . 001 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.498 HG21 ' HG1' ' A' ' 6' ' ' THR 0.997 0.0 OUTLIER -56.85 -177.92 0.02 OUTLIER 'General case' 4 C--O 0.388 -44.256 1 CA-C-N 106.25 -4.977 . . . . 0.0 119.197 179.634 . . . . . . . . 6 4 . 1 . 001 nuclear build full ' A' A ' 7' ' ' SER . . . . . 1.106 ' HB3' ' CZ ' ' A' ' 5' ' ' ARG 1.158 44.6 m 142.43 41.4 0.0 OUTLIER 'General case' 4 N--CA 0.668 -39.542 5 CA-C-O 168.757 23.17 . . . . 0.0 142.47 179.783 . . . . . . . . 5 3 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 1.566 ' CD1' ' CB ' ' A' ' 8' ' ' ILE 0.338 3.4 mp -106.44 -163.83 0.17 Allowed 'Isoleucine or valine' 4 C--O 0.296 -49.108 4 O-C-N 33.054 -56.029 . . . . 0.0 107.995 178.979 . . . . . . . . 5 3 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 1.449 ' CA ' ' O ' ' A' ' 8' ' ' ILE 0.906 1.6 mt-10 178.18 -58.56 0.01 OUTLIER 'General case' 4 C--O 0.5 -38.346 5 O-C-N 13.97 -67.956 . . . . 0.0 144.074 -177.441 . . . . . . . . 5 3 . 1 . 001 nuclear build full ' A' A ' 10' ' ' THR . . . . . 0.422 ' C ' ' N ' ' A' ' 12' ' ' VAL 1.102 19.7 m -125.1 -142.33 0.3 Allowed 'General case' 3 C--N 0.743 -25.773 4 O-C-N 86.354 -22.716 . . . . 0.0 158.467 -179.501 . . . . . . . . 5 3 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ASN . . . . . 1.468 ' CG ' ' CA ' ' A' ' 11' ' ' ASN . 0.0 OUTLIER -49.08 -30.96 7.06 Favored 'General case' 3 N--CA 1.209 -12.495 1 O-C-N 130.972 5.17 . . . . 0.0 113.406 -179.567 . . . . . . . . 5 4 . 1 . 001 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.985 HG23 HD22 ' A' ' 16' ' ' LEU 0.647 0.3 OUTLIER -63.57 -47.57 90.85 Favored 'Isoleucine or valine' 2 C--N 1.078 -11.211 1 N-CA-C 122.705 4.335 . . . . 0.0 122.705 179.694 . . . . . . . . 6 4 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.726 ' HB2' ' HE1' ' A' ' 48' ' ' TRP . 0.0 OUTLIER -55.46 -33.78 63.93 Favored 'General case' 1 N--CA 1.356 -5.172 0 CA-C-N 112.578 -2.101 . . . . 0.0 111.531 179.624 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.651 ' N ' ' HG2' ' A' ' 13' ' ' ARG . 1.9 t80 -57.5 -48.88 78.04 Favored 'General case' 1 N--CA 1.365 -4.69 0 O-C-N 125.986 2.054 . . . . 0.0 108.46 179.504 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -71.77 -29.13 64.15 Favored 'General case' 0 C--N 1.256 -3.461 0 CA-C-O 122.576 1.179 . . . . 0.0 112.066 179.658 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.985 HD22 HG23 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -72.49 -25.54 61.45 Favored 'General case' 0 C--O 1.158 -3.732 0 CA-C-N 113.621 -1.627 . . . . 0.0 109.492 -179.878 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 1.368 ' OE1' ' CG ' ' A' ' 17' ' ' GLU . 0.3 OUTLIER -53.32 -60.25 3.53 Favored 'General case' 1 C--N 1.2 -5.929 0 CA-C-N 114.771 -1.104 . . . . 0.0 112.728 -178.659 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 1.423 ' CG ' ' CA ' ' A' ' 18' ' ' LYS . 9.6 ttmt -69.1 -27.14 65.33 Favored 'General case' 0 C--N 1.246 -3.899 0 CA-C-O 123.695 1.712 . . . . 0.0 113.241 -179.251 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 2.8 m -78.1 -31.14 49.87 Favored 'General case' 2 C--N 1.21 -5.474 0 CA-C-N 112.867 -1.969 . . . . 0.0 115.478 -178.908 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 1.424 ' CZ ' ' CD1' ' A' ' 20' ' ' PHE . 44.5 t80 -59.03 -56.54 20.96 Favored 'General case' 2 C--O 1.106 -6.471 0 CA-C-O 124.89 2.281 . . . . 0.0 113.163 -179.327 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.27 -26.26 68.42 Favored 'General case' 3 C--N 1.13 -8.966 0 N-CA-C 119.252 3.056 . . . . 0.0 119.252 -179.146 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.36 -43.21 82.03 Favored 'General case' 4 C--N 1.166 -7.379 0 CA-C-O 123.213 1.483 . . . . 0.0 112.85 -179.561 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 1.279 ' C ' ' CA ' ' A' ' 24' ' ' GLN 0.257 4.3 m-20 -150.83 136.25 17.85 Favored 'General case' 4 C--O 0.751 -25.173 1 CA-C-O 130.213 4.816 . . . . 0.0 107.265 -179.885 . . . . . . . . 5 3 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 1.279 ' CA ' ' C ' ' A' ' 23' ' ' ASN 0.254 3.5 tt0 -115.78 15.24 16.42 Favored 'General case' 4 C--N 0.867 -20.37 3 O-C-N 98.477 -15.14 . . . . 0.0 114.521 179.848 . . . . . . . . 5 3 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 1.486 ' CB ' ' CD ' ' A' ' 25' ' ' LYS . 0.2 OUTLIER -132.67 71.33 78.75 Favored Pre-proline 4 C--N 1.192 -6.276 0 C-N-CA 126.669 1.987 . . . . 0.0 113.851 179.87 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.6 ' HB2' ' CD1' ' A' ' 31' ' ' ILE . 4.8 Cg_endo -67.57 134.19 32.21 Favored 'Trans proline' 3 N--CA 1.32 -8.688 0 O-C-N 125.34 2.231 . . . . 0.0 114.17 -179.84 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -86.54 -172.08 3.85 Favored 'General case' 1 C--N 1.232 -4.529 0 CA-C-O 122.31 1.052 . . . . 0.0 108.292 179.969 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 30.4 t -73.93 -44.86 53.62 Favored 'General case' 0 C--N 1.261 -3.246 0 CA-C-N 112.93 -1.941 . . . . 0.0 112.056 -179.678 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 1.305 ' CB ' ' CD ' ' A' ' 29' ' ' GLU . 9.5 mt-10 -71.18 -39.98 71.52 Favored 'General case' 0 N--CA 1.393 -3.28 0 CA-C-N 113.603 -1.635 . . . . 0.0 112.6 -179.22 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -54.83 -37.21 65.86 Favored 'General case' 0 C--N 1.278 -2.512 0 CA-C-N 114.302 -1.317 . . . . 0.0 113.111 -179.477 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 1.154 ' CD1' ' CB ' ' A' ' 31' ' ' ILE . 21.0 mt -74.51 -48.67 34.35 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.71 0 CA-C-N 114.778 -1.101 . . . . 0.0 112.151 -179.056 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.568 HD12 ' C ' ' A' ' 32' ' ' LEU . 2.0 pp -59.64 -32.24 70.26 Favored 'General case' 0 N--CA 1.408 -2.564 0 CA-C-N 114.109 -1.405 . . . . 0.0 109.963 -179.685 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.94 -48.59 70.86 Favored 'General case' 0 N--CA 1.404 -2.765 0 O-C-N 125.177 1.548 . . . . 0.0 109.739 179.867 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.425 HG22 ' O ' ' A' ' 31' ' ' ILE . 0.1 OUTLIER -67.45 -24.12 31.0 Favored 'Isoleucine or valine' 0 C--N 1.279 -2.495 0 CA-C-N 114.347 -1.297 . . . . 0.0 111.473 -179.784 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -69.06 -31.24 69.87 Favored 'General case' 0 C--O 1.166 -3.324 0 CA-C-N 114.674 -1.148 . . . . 0.0 111.233 -179.643 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 1.223 ' CG ' ' CA ' ' A' ' 36' ' ' GLU . 11.8 tt0 -70.2 -16.78 63.11 Favored 'General case' 0 C--O 1.156 -3.829 0 N-CA-C 114.084 1.142 . . . . 0.0 114.084 -179.355 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 1.127 ' CD ' ' CB ' ' A' ' 37' ' ' GLN . 3.1 tp60 -67.29 -35.06 78.7 Favored 'General case' 3 C--O 1.122 -5.645 0 CA-C-N 115.107 -0.952 . . . . 0.0 111.901 -179.761 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 1.517 ' CD1' ' CA ' ' A' ' 38' ' ' LEU 0.483 0.4 OUTLIER 175.54 -109.11 0.0 OUTLIER 'General case' 3 C--O 0.752 -25.097 2 CA-C-O 136.246 7.689 . . . . 0.0 123.861 179.831 . . . . . . . . 6 4 . 1 . 001 nuclear build full ' A' A ' 39' ' ' HIS . . . . . 1.613 ' CG ' ' CA ' ' A' ' 39' ' ' HIS 0.415 14.6 m80 -107.57 68.22 0.71 Allowed 'General case' 2 C--N 0.729 -26.399 2 O-C-N 97.782 -15.574 . . . . 0.0 123.43 -178.204 . . . . . . . . 5 3 . 1 . 001 nuclear build full ' A' A ' 40' ' ' MET . . . . . 1.243 ' CE ' ' CG ' ' A' ' 40' ' ' MET . 0.0 OUTLIER -151.47 132.58 14.38 Favored 'General case' 2 C--O 0.866 -19.108 0 O-C-N 124.563 1.164 . . . . 0.0 109.609 -179.911 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 1.37 ' CG ' ' CA ' ' A' ' 41' ' ' GLU . 0.2 OUTLIER -123.69 160.14 27.86 Favored 'General case' 2 C--N 1.046 -12.592 3 O-C-N 108.42 -8.925 . . . . 0.0 114.638 -177.956 . . . . . . . . 5 4 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 1.497 ' NZ ' ' CD ' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -47.08 -36.1 7.76 Favored 'General case' 0 C--O 1.16 -3.61 0 C-N-CA 124.479 1.112 . . . . 0.0 111.66 -178.397 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 1.356 ' OE2' ' CG ' ' A' ' 43' ' ' GLU . 23.0 tt0 -55.74 -88.02 0.0 OUTLIER 'General case' 0 N--CA 1.397 -3.103 0 CA-C-O 118.415 -0.803 . . . . 0.0 112.621 -178.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.636 ' HA ' HG13 ' A' ' 47' ' ' VAL 0.589 0.2 OUTLIER -44.21 -30.04 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.392 -3.372 0 O-C-N 125.908 2.005 . . . . 0.0 113.635 -179.777 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.637 HG21 ' CG2' ' A' ' 31' ' ' ILE . 1.0 OUTLIER -53.25 -68.88 0.13 Allowed 'Isoleucine or valine' 0 C--O 1.185 -2.324 0 O-C-N 123.975 0.797 . . . . 0.0 111.125 -179.677 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.529 ' N ' ' CG2' ' A' ' 45' ' ' ILE . 12.1 ttt180 -55.66 -50.03 71.32 Favored 'General case' 0 N--CA 1.397 -3.105 0 CA-C-O 118.325 -0.845 . . . . 0.0 109.222 -179.246 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.636 HG13 ' HA ' ' A' ' 44' ' ' VAL 0.616 0.2 OUTLIER -49.91 -36.16 11.46 Favored 'Isoleucine or valine' 0 C--O 1.174 -2.873 0 O-C-N 124.518 1.136 . . . . 0.0 113.174 179.643 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' A' A ' 48' ' ' TRP . . . . . 0.806 ' CZ3' ' HB3' ' A' ' 16' ' ' LEU . 33.6 t90 -69.98 -81.14 0.05 OUTLIER 'General case' 0 N--CA 1.391 -3.384 0 N-CA-C 105.693 -1.965 . . . . 0.0 105.693 178.775 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.623 ' CE1' ' HG ' ' A' ' 16' ' ' LEU . 20.2 m-85 -31.63 -41.71 0.05 OUTLIER 'General case' 0 CA--C 1.459 -2.542 0 N-CA-C 116.029 1.863 . . . . 0.0 116.029 179.773 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -62.86 -63.54 1.18 Allowed 'General case' 0 N--CA 1.384 -3.74 0 O-C-N 124.211 0.945 . . . . 0.0 109.079 -179.31 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -65.93 -23.85 66.7 Favored 'General case' 0 C--O 1.175 -2.833 0 O-C-N 124.486 1.116 . . . . 0.0 111.348 -178.767 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 1.408 ' NH2' ' NE ' ' A' ' 52' ' ' ARG . 18.6 tpt180 -66.42 -45.21 80.67 Favored 'General case' 0 N--CA 1.392 -3.368 0 O-C-N 123.973 0.796 . . . . 0.0 111.203 -179.573 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 1.588 ' CB ' ' CD ' ' A' ' 53' ' ' ARG . 0.0 OUTLIER -75.83 -15.84 60.17 Favored 'General case' 0 C--N 1.271 -2.843 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 -179.135 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 1.347 ' CD ' ' CB ' ' A' ' 54' ' ' GLN . 43.4 tt0 -72.27 -27.66 62.63 Favored 'General case' 0 N--CA 1.39 -3.432 0 O-C-N 125.071 1.482 . . . . 0.0 110.557 -179.44 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 1.489 ' NZ ' ' CD ' ' A' ' 55' ' ' LYS . 25.7 tttt -74.61 -18.41 60.56 Favored 'General case' 1 N--CA 1.377 -4.079 0 O-C-N 125.273 1.608 . . . . 0.0 108.873 -179.336 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 1.2 ' CD ' ' CB ' ' A' ' 56' ' ' GLU . 0.6 OUTLIER -76.62 -48.41 19.22 Favored 'General case' 1 C--O 1.064 -8.687 0 CA-C-O 123.374 1.559 . . . . 0.0 110.523 -179.119 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.709 ' HD2' ' N ' ' A' ' 58' ' ' ARG 0.304 2.4 mmtm -61.59 142.8 56.88 Favored 'General case' 4 C--O 0.667 -29.559 1 CA-C-O 136.254 7.692 . . . . 0.0 113.185 -179.124 . . . . . . . . 5 3 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 1.078 ' NH2' ' HB2' ' A' ' 60' ' ' ASN 0.901 8.4 mmt85 158.52 72.79 0.0 OUTLIER 'General case' 4 C--O 0.279 -50.004 5 CA-C-O 167.64 22.638 . . . . 0.0 144.455 179.67 . . . . . . . . 5 3 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . 1.173 0.9 OUTLIER -110.09 11.67 8.76 Favored 'Isoleucine or valine' 4 C--N 0.341 -43.266 5 O-C-N 24.194 -61.566 . . . . 0.0 130.355 178.282 . . . . . . . . 5 3 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ASN . . . . . 1.078 ' HB2' ' NH2' ' A' ' 58' ' ' ARG 1.262 0.0 OUTLIER -17.54 -175.18 0.0 OUTLIER Pre-proline 4 C--O 0.091 -59.875 4 N-CA-C 156.508 16.855 . . . . 0.0 156.508 -179.649 . . . . . . . . 6 4 . 1 . 001 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . 1.583 16.4 Cg_exo 119.77 -86.92 0.0 OUTLIER 'Trans proline' 4 CA--C 0.162 -68.077 5 C-N-CA 171.772 34.982 . . . . 0.0 84.563 179.886 . . . . . . . . 4 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . 1.511 1.9 t 1.69 -101.61 0.0 OUTLIER 'General case' 4 N--CA 0.177 -64.115 5 CA-C-O 174.003 25.668 . . . . 0.0 56.978 -178.763 . . . . . . . . 4 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . 1.693 0.0 OUTLIER . . . . . 4 N--CA 0.396 -53.166 4 CA-C-N 19.382 -44.463 . . . . 0.0 81.839 179.924 . . . . . . . . 4 2 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.653 HH21 HH12 ' A' ' 2' ' ' ARG 1.024 0.0 OUTLIER . . . . . 3 N--CA 0.434 -51.256 1 N-CA-C 90.327 -7.656 . . . . 0.0 90.327 . . . . . . . . . 5 3 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.653 HH12 HH21 ' A' ' 1' ' ' ARG 1.261 0.0 OUTLIER -16.25 -60.83 0.01 OUTLIER 'General case' 4 C--O 0.416 -42.769 1 CA-C-O 30.911 -42.471 . . . . 0.0 115.988 -179.856 . . . . . . . . 6 4 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . 1.511 0.0 OUTLIER 53.7 63.35 2.23 Favored 'General case' 4 C--O 0.15 -56.784 5 O-C-N 165.273 26.608 . . . . 0.0 127.318 179.773 . . . . . . . . 5 3 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . 1.324 1.9 mptp? -132.87 60.17 1.71 Allowed 'General case' 4 N--CA 0.625 -41.71 5 CA-C-N 161.937 20.335 . . . . 0.0 144.721 -179.844 . . . . . . . . 4 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 1.106 ' CZ ' ' HB3' ' A' ' 7' ' ' SER 1.132 27.3 ptt180 -71.47 109.25 5.32 Favored 'General case' 4 N--CA 0.827 -31.601 5 N-CA-C 138.3 10.111 . . . . 0.0 138.3 -179.828 . . . . . . . . 5 3 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.498 HG21 ' HG1' ' A' ' 6' ' ' THR 0.997 0.0 OUTLIER -56.85 -177.92 0.02 OUTLIER 'General case' 4 C--O 0.388 -44.256 1 CA-C-N 106.25 -4.977 . . . . 0.0 119.197 179.634 . . . . . . . . 6 4 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 1.106 ' HB3' ' CZ ' ' A' ' 5' ' ' ARG 1.158 44.6 m 142.43 41.4 0.0 OUTLIER 'General case' 4 N--CA 0.668 -39.542 5 CA-C-O 168.757 23.17 . . . . 0.0 142.47 179.783 . . . . . . . . 5 3 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 1.566 ' CD1' ' CB ' ' A' ' 8' ' ' ILE 0.338 3.4 mp -106.44 -163.83 0.17 Allowed 'Isoleucine or valine' 4 C--O 0.296 -49.108 4 O-C-N 33.054 -56.029 . . . . 0.0 107.995 178.979 . . . . . . . . 5 3 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 1.449 ' CA ' ' O ' ' A' ' 8' ' ' ILE 0.906 1.6 mt-10 178.18 -58.56 0.01 OUTLIER 'General case' 4 C--O 0.5 -38.346 5 O-C-N 13.97 -67.956 . . . . 0.0 144.074 -177.441 . . . . . . . . 5 3 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . 0.422 ' C ' ' N ' ' A' ' 12' ' ' VAL 1.102 19.7 m -125.1 -142.33 0.3 Allowed 'General case' 3 C--N 0.743 -25.773 4 O-C-N 86.354 -22.716 . . . . 0.0 158.467 -179.501 . . . . . . . . 5 3 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . 1.468 ' CG ' ' CA ' ' A' ' 11' ' ' ASN . 0.0 OUTLIER -49.08 -30.96 7.06 Favored 'General case' 3 N--CA 1.209 -12.495 1 O-C-N 130.972 5.17 . . . . 0.0 113.406 -179.567 . . . . . . . . 5 4 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.985 HG23 HD22 ' A' ' 16' ' ' LEU 0.647 0.3 OUTLIER -63.57 -47.57 90.85 Favored 'Isoleucine or valine' 2 C--N 1.078 -11.211 1 N-CA-C 122.705 4.335 . . . . 0.0 122.705 179.694 . . . . . . . . 6 4 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.726 ' HB2' ' HE1' ' A' ' 48' ' ' TRP . 0.0 OUTLIER -55.46 -33.78 63.93 Favored 'General case' 1 N--CA 1.356 -5.172 0 CA-C-N 112.578 -2.101 . . . . 0.0 111.531 179.624 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.651 ' N ' ' HG2' ' A' ' 13' ' ' ARG . 1.9 t80 -57.5 -48.88 78.04 Favored 'General case' 1 N--CA 1.365 -4.69 0 O-C-N 125.986 2.054 . . . . 0.0 108.46 179.504 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -71.77 -29.13 64.15 Favored 'General case' 0 C--N 1.256 -3.461 0 CA-C-O 122.576 1.179 . . . . 0.0 112.066 179.658 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.985 HD22 HG23 ' A' ' 12' ' ' VAL . 0.1 OUTLIER -72.49 -25.54 61.45 Favored 'General case' 0 C--O 1.158 -3.732 0 CA-C-N 113.621 -1.627 . . . . 0.0 109.492 -179.878 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 1.368 ' OE1' ' CG ' ' A' ' 17' ' ' GLU . 0.3 OUTLIER -53.32 -60.25 3.53 Favored 'General case' 1 C--N 1.2 -5.929 0 CA-C-N 114.771 -1.104 . . . . 0.0 112.728 -178.659 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 1.423 ' CG ' ' CA ' ' A' ' 18' ' ' LYS . 9.6 ttmt -69.1 -27.14 65.33 Favored 'General case' 0 C--N 1.246 -3.899 0 CA-C-O 123.695 1.712 . . . . 0.0 113.241 -179.251 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 2.8 m -78.1 -31.14 49.87 Favored 'General case' 2 C--N 1.21 -5.474 0 CA-C-N 112.867 -1.969 . . . . 0.0 115.478 -178.908 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 1.424 ' CZ ' ' CD1' ' A' ' 20' ' ' PHE . 44.5 t80 -59.03 -56.54 20.96 Favored 'General case' 2 C--O 1.106 -6.471 0 CA-C-O 124.89 2.281 . . . . 0.0 113.163 -179.327 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.27 -26.26 68.42 Favored 'General case' 3 C--N 1.13 -8.966 0 N-CA-C 119.252 3.056 . . . . 0.0 119.252 -179.146 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.36 -43.21 82.03 Favored 'General case' 4 C--N 1.166 -7.379 0 CA-C-O 123.213 1.483 . . . . 0.0 112.85 -179.561 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 1.279 ' C ' ' CA ' ' A' ' 24' ' ' GLN 0.257 4.3 m-20 -150.83 136.25 17.85 Favored 'General case' 4 C--O 0.751 -25.173 1 CA-C-O 130.213 4.816 . . . . 0.0 107.265 -179.885 . . . . . . . . 5 3 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 1.279 ' CA ' ' C ' ' A' ' 23' ' ' ASN 0.254 1.8 tt0 -115.78 15.24 16.42 Favored 'General case' 4 C--N 0.867 -20.37 3 O-C-N 98.477 -15.14 . . . . 0.0 114.521 179.848 . . . . . . . . 5 3 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 1.486 ' CB ' ' CD ' ' A' ' 25' ' ' LYS . 0.2 OUTLIER -132.67 71.33 78.75 Favored Pre-proline 4 C--N 1.192 -6.276 0 C-N-CA 126.669 1.987 . . . . 0.0 113.851 179.87 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.6 ' HB2' ' CD1' ' A' ' 31' ' ' ILE . 4.8 Cg_endo -67.57 134.19 32.21 Favored 'Trans proline' 3 N--CA 1.32 -8.688 0 O-C-N 125.34 2.231 . . . . 0.0 114.17 -179.84 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -86.54 -172.08 3.85 Favored 'General case' 1 C--N 1.232 -4.529 0 CA-C-O 122.31 1.052 . . . . 0.0 108.292 179.969 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 30.4 t -73.93 -44.86 53.62 Favored 'General case' 0 C--N 1.261 -3.246 0 CA-C-N 112.93 -1.941 . . . . 0.0 112.056 -179.678 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 1.305 ' CB ' ' CD ' ' A' ' 29' ' ' GLU . 9.5 mt-10 -71.18 -39.98 71.52 Favored 'General case' 0 N--CA 1.393 -3.28 0 CA-C-N 113.603 -1.635 . . . . 0.0 112.6 -179.22 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -54.83 -37.21 65.86 Favored 'General case' 0 C--N 1.278 -2.512 0 CA-C-N 114.302 -1.317 . . . . 0.0 113.111 -179.477 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 1.154 ' CD1' ' CB ' ' A' ' 31' ' ' ILE . 21.0 mt -74.51 -48.67 34.35 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.71 0 CA-C-N 114.778 -1.101 . . . . 0.0 112.151 -179.056 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.568 ' C ' HD12 ' A' ' 32' ' ' LEU . 2.0 pp -59.64 -32.24 70.26 Favored 'General case' 0 N--CA 1.408 -2.564 0 CA-C-N 114.109 -1.405 . . . . 0.0 109.963 -179.685 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.94 -48.59 70.86 Favored 'General case' 0 N--CA 1.404 -2.765 0 O-C-N 125.177 1.548 . . . . 0.0 109.739 179.867 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.425 HG22 ' O ' ' A' ' 31' ' ' ILE . 0.1 OUTLIER -67.45 -24.12 31.0 Favored 'Isoleucine or valine' 0 C--N 1.279 -2.495 0 CA-C-N 114.347 -1.297 . . . . 0.0 111.473 -179.784 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -69.06 -31.24 69.87 Favored 'General case' 0 C--O 1.166 -3.324 0 CA-C-N 114.674 -1.148 . . . . 0.0 111.233 -179.643 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 1.223 ' CG ' ' CA ' ' A' ' 36' ' ' GLU . 11.8 tt0 -70.2 -16.78 63.11 Favored 'General case' 0 C--O 1.156 -3.829 0 N-CA-C 114.084 1.142 . . . . 0.0 114.084 -179.355 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 1.127 ' CD ' ' CB ' ' A' ' 37' ' ' GLN . 3.1 tp60 -67.29 -35.06 78.7 Favored 'General case' 3 C--O 1.122 -5.645 0 CA-C-N 115.107 -0.952 . . . . 0.0 111.901 -179.761 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 1.517 ' CD1' ' CA ' ' A' ' 38' ' ' LEU 0.483 0.4 OUTLIER 175.54 -109.11 0.0 OUTLIER 'General case' 3 C--O 0.752 -25.097 2 CA-C-O 136.246 7.689 . . . . 0.0 123.861 179.831 . . . . . . . . 6 4 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . 1.087 ' HD2' HD23 ' A' ' 38' ' ' LEU 0.415 22.0 m-70 -107.57 68.22 0.71 Allowed 'General case' 2 C--N 0.729 -26.399 2 O-C-N 97.782 -15.574 . . . . 0.0 123.43 -178.204 . . . . . . . . 5 3 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 1.243 ' CE ' ' CG ' ' A' ' 40' ' ' MET . 0.0 OUTLIER -151.47 132.58 14.38 Favored 'General case' 2 C--O 0.866 -19.108 0 O-C-N 124.563 1.164 . . . . 0.0 109.609 -179.911 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 1.37 ' CG ' ' CA ' ' A' ' 41' ' ' GLU . 0.2 OUTLIER -123.69 160.14 27.86 Favored 'General case' 2 C--N 1.046 -12.592 3 O-C-N 108.42 -8.925 . . . . 0.0 114.638 -177.956 . . . . . . . . 5 4 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 1.497 ' NZ ' ' CD ' ' A' ' 42' ' ' LYS . 0.0 OUTLIER -47.08 -36.1 7.76 Favored 'General case' 0 C--O 1.16 -3.61 0 C-N-CA 124.479 1.112 . . . . 0.0 111.66 -178.397 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 1.356 ' OE2' ' CG ' ' A' ' 43' ' ' GLU . 23.0 tt0 -55.74 -88.02 0.0 OUTLIER 'General case' 0 N--CA 1.397 -3.103 0 CA-C-O 118.415 -0.803 . . . . 0.0 112.621 -178.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.636 ' HA ' HG13 ' A' ' 47' ' ' VAL 0.589 0.2 OUTLIER -44.21 -30.04 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.392 -3.372 0 O-C-N 125.908 2.005 . . . . 0.0 113.635 -179.777 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.637 HG21 ' CG2' ' A' ' 31' ' ' ILE . 1.0 OUTLIER -53.25 -68.88 0.13 Allowed 'Isoleucine or valine' 0 C--O 1.185 -2.324 0 O-C-N 123.975 0.797 . . . . 0.0 111.125 -179.677 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.529 ' N ' ' CG2' ' A' ' 45' ' ' ILE . 12.1 ttt180 -55.66 -50.03 71.32 Favored 'General case' 0 N--CA 1.397 -3.105 0 CA-C-O 118.325 -0.845 . . . . 0.0 109.222 -179.246 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.636 HG13 ' HA ' ' A' ' 44' ' ' VAL 0.616 0.2 OUTLIER -49.91 -36.16 11.46 Favored 'Isoleucine or valine' 0 C--O 1.174 -2.873 0 O-C-N 124.518 1.136 . . . . 0.0 113.174 179.643 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' TRP . . . . . 0.806 ' CZ3' ' HB3' ' A' ' 16' ' ' LEU . 33.6 t90 -69.98 -81.14 0.05 OUTLIER 'General case' 0 N--CA 1.391 -3.384 0 N-CA-C 105.693 -1.965 . . . . 0.0 105.693 178.775 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.623 ' CE1' ' HG ' ' A' ' 16' ' ' LEU . 20.2 m-85 -31.63 -41.71 0.05 OUTLIER 'General case' 0 CA--C 1.459 -2.542 0 N-CA-C 116.029 1.863 . . . . 0.0 116.029 179.773 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -62.86 -63.54 1.18 Allowed 'General case' 0 N--CA 1.384 -3.74 0 O-C-N 124.211 0.945 . . . . 0.0 109.079 -179.31 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -65.93 -23.85 66.7 Favored 'General case' 0 C--O 1.175 -2.833 0 O-C-N 124.486 1.116 . . . . 0.0 111.348 -178.767 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 1.408 ' NH2' ' NE ' ' A' ' 52' ' ' ARG . 18.6 tpt180 -66.42 -45.21 80.67 Favored 'General case' 0 N--CA 1.392 -3.368 0 O-C-N 123.973 0.796 . . . . 0.0 111.203 -179.573 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 1.588 ' CB ' ' CD ' ' A' ' 53' ' ' ARG . 0.0 OUTLIER -75.83 -15.84 60.17 Favored 'General case' 0 C--N 1.271 -2.843 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 -179.135 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 1.347 ' CD ' ' CB ' ' A' ' 54' ' ' GLN . 43.4 tt0 -72.27 -27.66 62.63 Favored 'General case' 0 N--CA 1.39 -3.432 0 O-C-N 125.071 1.482 . . . . 0.0 110.557 -179.44 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 1.489 ' NZ ' ' CD ' ' A' ' 55' ' ' LYS . 25.7 tttt -74.61 -18.41 60.56 Favored 'General case' 1 N--CA 1.377 -4.079 0 O-C-N 125.273 1.608 . . . . 0.0 108.873 -179.336 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 1.2 ' CD ' ' CB ' ' A' ' 56' ' ' GLU . 0.6 OUTLIER -76.62 -48.41 19.22 Favored 'General case' 1 C--O 1.064 -8.687 0 CA-C-O 123.374 1.559 . . . . 0.0 110.523 -179.119 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.709 ' HD2' ' N ' ' A' ' 58' ' ' ARG 0.304 2.4 mmtm -61.59 142.8 56.88 Favored 'General case' 4 C--O 0.667 -29.559 1 CA-C-O 136.254 7.692 . . . . 0.0 113.185 -179.124 . . . . . . . . 5 3 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 1.078 ' NH2' ' HB2' ' A' ' 60' ' ' ASN 0.901 8.4 mmt85 158.52 72.79 0.0 OUTLIER 'General case' 4 C--O 0.279 -50.004 5 CA-C-O 167.64 22.638 . . . . 0.0 144.455 179.67 . . . . . . . . 5 3 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . 1.173 0.9 OUTLIER -110.09 11.67 8.76 Favored 'Isoleucine or valine' 4 C--N 0.341 -43.266 5 O-C-N 24.194 -61.566 . . . . 0.0 130.355 178.282 . . . . . . . . 5 3 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . 1.078 ' HB2' ' NH2' ' A' ' 58' ' ' ARG 1.262 0.0 OUTLIER -17.54 -175.18 0.0 OUTLIER Pre-proline 4 C--O 0.091 -59.875 4 N-CA-C 156.508 16.855 . . . . 0.0 156.508 -179.649 . . . . . . . . 6 4 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . 1.583 16.4 Cg_exo 119.77 -86.92 0.0 OUTLIER 'Trans proline' 4 CA--C 0.162 -68.077 5 C-N-CA 171.772 34.982 . . . . 0.0 84.563 179.886 . . . . . . . . 4 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . 1.511 1.9 t 1.69 -101.61 0.0 OUTLIER 'General case' 4 N--CA 0.177 -64.115 5 CA-C-O 174.003 25.668 . . . . 0.0 56.978 -178.763 . . . . . . . . 4 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . 1.693 0.0 OUTLIER . . . . . 4 N--CA 0.396 -53.166 4 CA-C-N 19.382 -44.463 . . . . 0.0 81.839 179.924 . . . . . . . . 4 2 . 1 stop_ save_