data_1blv_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 1blv _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 . . . . . . . . . . . . 2.469 5.0 p-10 . . . . . 0 N--CA 1.476 0.826 0 N-CA-C 106.608 -1.627 . . . . 0.0 106.608 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 19.0 pttm -153.76 174.1 14.99 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 113.332 0.864 . . . . 0.0 113.332 -164.153 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -146.16 150.94 36.83 Favored 'General case' 0 N--CA 1.441 -0.892 0 C-N-CA 129.725 3.21 . . . . 0.0 104.267 -167.416 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 38.4 t -72.04 144.96 12.65 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.811 0 N-CA-C 107.726 -1.213 . . . . 0.0 107.726 168.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 29.6 mtmt -129.63 67.66 1.44 Allowed 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 126.196 1.798 . . . . 0.0 106.716 -174.367 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 42.7 m-85 -57.85 107.28 0.44 Allowed 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 126.791 2.036 . . . . 0.0 110.25 178.769 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -118.46 145.82 44.96 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 123.895 0.878 . . . . 0.0 109.249 -176.584 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 46.1 p -76.55 158.9 30.81 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 123.318 0.647 . . . . 0.0 110.204 -177.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.05 -50.81 60.74 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 110.155 -0.313 . . . . 0.0 110.155 172.671 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -46.68 -54.51 9.46 Favored 'General case' 0 N--CA 1.445 -0.698 0 C-N-CA 124.246 1.018 . . . . 0.0 112.978 176.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -54.77 -46.45 74.37 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 122.757 1.265 . . . . 0.0 109.234 -177.471 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.412 ' CD1' ' CG2' ' A' ' 29' ' ' VAL . 82.0 mt -72.01 -27.37 27.08 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.516 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.967 -174.809 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -71.65 4.77 2.88 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 118.223 -0.894 . . . . 0.0 113.095 168.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 6.5 mmtp -82.0 -60.93 2.06 Favored 'General case' 0 C--N 1.346 0.435 0 CA-C-N 120.908 1.685 . . . . 0.0 108.004 169.842 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -85.8 157.14 20.31 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 115.132 -0.94 . . . . 0.0 110.685 -164.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 24.0 tttt -165.6 -54.72 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.701 0.762 . . . . 0.0 110.162 -155.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . 0.417 ' CG ' ' H ' ' A' ' 18' ' ' SER . 42.7 t0 -94.39 -167.2 1.62 Allowed 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 125.256 1.422 . . . . 0.0 110.419 -170.375 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.417 ' H ' ' CG ' ' A' ' 17' ' ' ASP . 1.0 OUTLIER 61.93 49.21 4.8 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 121.466 0.65 . . . . 0.0 112.028 142.418 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 56.2 40.7 29.97 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.034 0.933 . . . . 0.0 111.419 -176.151 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.8 m -153.89 83.51 1.15 Allowed 'General case' 0 CA--C 1.53 0.19 0 O-C-N 120.566 -1.334 . . . . 0.0 110.947 172.72 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 53.1 m -108.84 85.83 2.17 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 105.413 -2.069 . . . . 0.0 105.413 177.542 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 41.9 m0 -98.1 143.42 28.66 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 108.728 -0.841 . . . . 0.0 108.728 171.042 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -129.21 159.6 41.05 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.327 0 C-N-CA 123.976 0.91 . . . . 0.0 110.508 -174.088 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 1.7 mp -109.91 76.11 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.545 0 N-CA-C 106.421 -1.696 . . . . 0.0 106.421 165.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.5 mp -77.83 141.14 39.35 Favored 'General case' 0 CA--C 1.529 0.146 0 N-CA-C 105.353 -2.091 . . . . 0.0 105.353 155.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 3.3 m80 33.78 53.59 0.49 Allowed 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.958 1.303 . . . . 0.0 114.11 173.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 1.7 m170 59.18 47.28 11.92 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 123.436 0.694 . . . . 0.0 111.668 166.352 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 6.7 mttt -159.65 139.79 11.84 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 118.651 0.66 . . . . 0.0 109.728 172.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.412 ' CG2' ' CD1' ' A' ' 12' ' ' ILE . 91.9 t -72.0 104.58 1.75 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.671 0 C-N-CA 125.095 1.358 . . . . 0.0 108.83 179.61 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -107.86 121.37 44.62 Favored 'General case' 0 N--CA 1.443 -0.799 0 O-C-N 124.432 1.082 . . . . 0.0 109.16 -178.224 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -77.88 120.25 22.49 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 174.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 31.8 mt -99.15 -21.37 16.17 Favored 'General case' 0 C--O 1.216 -0.7 0 CA-C-O 116.825 -1.559 . . . . 0.0 110.659 171.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 20.0 m -36.4 -41.65 0.29 Allowed 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 116.347 1.981 . . . . 0.0 116.347 170.159 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 57.0 mttt -58.43 -55.63 32.5 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 119.824 1.193 . . . . 0.0 110.102 170.263 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -66.09 -23.39 66.51 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 114.997 -1.002 . . . . 0.0 112.924 -175.786 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 6.2 mp -46.21 -28.79 1.36 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.277 1.431 . . . . 0.0 109.604 168.398 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -118.92 39.48 3.52 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.242 0.617 . . . . 0.0 111.122 176.591 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -159.4 -49.09 0.06 Allowed 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 179.687 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 34.1 t-80 -47.88 130.8 11.68 Favored Pre-proline 0 CA--C 1.536 0.437 0 C-N-CA 126.297 1.839 . . . . 0.0 112.642 -172.058 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -70.62 144.87 50.67 Favored 'Trans proline' 0 N--CA 1.451 -0.996 0 C-N-CA 122.313 2.009 . . . . 0.0 110.016 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 102.99 -63.09 0.44 Allowed Glycine 0 CA--C 1.524 0.595 0 N-CA-C 109.923 -1.271 . . . . 0.0 109.923 178.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 171.78 164.63 27.69 Favored Glycine 0 CA--C 1.524 0.6 0 N-CA-C 111.067 -0.813 . . . . 0.0 111.067 177.157 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -103.06 -31.52 10.15 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 125.551 1.54 . . . . 0.0 111.634 179.899 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -51.14 -48.48 61.81 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 179.743 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.3 m -57.62 -36.59 54.83 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 C-N-CA 123.28 0.632 . . . . 0.0 111.346 177.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 70.9 mt -63.71 -49.84 71.53 Favored 'General case' 0 C--N 1.341 0.216 0 CA-C-O 121.835 0.826 . . . . 0.0 108.854 178.026 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 2.6 tmt_? -69.88 -30.54 68.01 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 114.687 -1.142 . . . . 0.0 112.051 -174.624 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -45.19 -59.99 2.35 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 119.181 0.9 . . . . 0.0 111.243 179.412 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -77.08 -60.35 2.4 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 -179.277 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . 51.99 -128.09 2.39 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.238 1.015 . . . . 0.0 111.083 -178.412 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -66.49 75.31 0.14 Allowed Glycine 0 CA--C 1.527 0.808 0 C-N-CA 124.479 1.038 . . . . 0.0 111.006 177.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -148.31 -103.18 0.3 Allowed Glycine 0 CA--C 1.525 0.685 0 N-CA-C 107.966 -2.054 . . . . 0.0 107.966 174.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -163.52 65.1 0.17 Allowed 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 124.208 1.003 . . . . 0.0 109.241 -179.103 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -77.18 51.56 0.84 Allowed 'General case' 0 CA--C 1.534 0.353 0 O-C-N 120.751 -1.218 . . . . 0.0 112.115 -176.365 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 15.8 m -98.33 -65.74 0.94 Allowed 'General case' 0 C--O 1.228 -0.073 0 C-N-CA 123.362 0.665 . . . . 0.0 110.452 -177.27 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -53.14 -53.65 47.33 Favored 'General case' 0 C--O 1.225 -0.216 0 CA-C-O 121.499 0.666 . . . . 0.0 109.223 -169.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 19.4 t-20 -57.76 -46.79 84.04 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 122.366 1.079 . . . . 0.0 110.976 -178.479 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -54.96 -42.75 72.75 Favored 'General case' 0 CA--C 1.539 0.525 0 O-C-N 121.353 -0.842 . . . . 0.0 111.713 174.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -76.48 -36.16 57.99 Favored 'General case' 0 C--O 1.225 -0.195 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 -176.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -51.14 -46.01 61.85 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.802 1.241 . . . . 0.0 110.901 173.29 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 83.8 t -62.58 -24.27 34.88 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 174.685 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 104.43 32.21 4.33 Favored Glycine 0 CA--C 1.523 0.593 0 C-N-CA 124.524 1.059 . . . . 0.0 111.438 175.077 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 73.2 m80 -75.82 74.56 2.77 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 117.94 0.87 . . . . 0.0 110.24 174.245 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 20.6 t -113.93 -166.79 1.13 Allowed 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 166.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 57.07 -141.24 0.8 Allowed 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 122.782 0.433 . . . . 0.0 110.458 172.469 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -33.78 -65.13 0.19 Allowed 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 127.439 2.296 . . . . 0.0 113.317 177.79 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -53.0 -42.33 65.5 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 123.79 0.836 . . . . 0.0 110.437 -177.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.89 -46.13 85.37 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 124.462 1.105 . . . . 0.0 110.284 178.433 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -66.01 -50.62 63.6 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 109.603 -0.518 . . . . 0.0 109.603 177.502 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -51.93 -34.1 40.29 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 124.283 1.033 . . . . 0.0 111.664 175.302 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 19.8 m -45.22 -46.53 12.38 Favored 'General case' 0 C--N 1.341 0.232 0 CA-C-N 119.082 0.855 . . . . 0.0 109.831 173.334 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 21.8 tttt -61.97 -22.92 66.06 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 123.089 0.555 . . . . 0.0 112.428 -176.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -74.05 -23.36 59.37 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.354 0.662 . . . . 0.0 111.39 177.611 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -79.83 7.7 8.22 Favored 'General case' 0 C--N 1.341 0.22 0 O-C-N 121.452 -0.78 . . . . 0.0 111.661 175.497 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 5.6 tp -64.35 113.97 2.01 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.693 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 176.232 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.0 pp -105.9 -36.77 3.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 C-N-CA 124.211 1.004 . . . . 0.0 110.262 176.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -151.22 -13.2 0.08 OUTLIER Glycine 0 CA--C 1.529 0.926 0 N-CA-C 116.848 1.499 . . . . 0.0 116.848 -176.617 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 60.41 170.62 0.09 Allowed 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 119.552 1.676 . . . . 0.0 113.264 -170.224 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 29.2 mt -63.05 157.68 21.45 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.46 170.526 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 3.8 t-80 -54.2 132.77 60.62 Favored Pre-proline 0 N--CA 1.448 -0.543 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 160.154 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_endo -58.21 -20.92 49.27 Favored 'Trans proline' 0 N--CA 1.453 -0.91 0 C-N-CA 122.208 1.938 . . . . 0.0 112.26 -179.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 61.4 t0 -60.29 -76.5 0.05 OUTLIER 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.297 1.039 . . . . 0.0 110.377 174.8 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 84.7 m-20 -39.34 -55.41 1.73 Allowed 'General case' 0 C--N 1.346 0.422 0 C-N-CA 125.353 1.461 . . . . 0.0 109.017 173.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.14 -33.76 69.52 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 124.553 1.141 . . . . 0.0 112.598 -174.064 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.2 t -66.83 -32.12 73.19 Favored 'General case' 0 N--CA 1.457 -0.113 0 CA-C-N 119.065 0.848 . . . . 0.0 110.357 177.446 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 9.3 tmtt? -103.73 20.35 18.19 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 123.717 0.807 . . . . 0.0 110.501 -178.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -61.61 108.07 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 -178.45 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -65.72 145.02 56.52 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 -177.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.43 114.88 10.42 Favored Pre-proline 0 CA--C 1.536 0.417 0 N-CA-C 107.095 -1.446 . . . . 0.0 107.095 179.023 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_endo -67.56 -78.86 0.01 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.792 0 C-N-CA 122.853 2.369 . . . . 0.0 109.443 -162.295 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 174.15 149.46 0.08 Allowed 'General case' 0 N--CA 1.44 -0.937 0 C-N-CA 130.565 3.546 . . . . 0.0 101.68 -175.436 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.454 ' CA ' ' HB ' ' A' ' 93' ' ' THR . 36.0 mm-40 42.4 132.76 0.0 OUTLIER 'General case' 0 CA--C 1.553 1.093 0 N-CA-C 118.433 2.753 . . . . 0.0 118.433 119.438 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' THR . . . . . 0.454 ' HB ' ' CA ' ' A' ' 92' ' ' GLU . 14.4 t 174.26 -46.89 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 127.599 2.36 . . . . 0.0 112.308 13.958 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.248 0.996 0 CA-C-O 117.488 -1.244 . . . . 0.0 111.113 -157.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . 2.469 5.0 p-10 . . . . . 0 N--CA 1.476 0.826 0 N-CA-C 106.608 -1.627 . . . . 0.0 106.608 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 19.0 pttm -153.76 174.1 14.99 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 113.332 0.864 . . . . 0.0 113.332 -164.153 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -146.16 150.94 36.83 Favored 'General case' 0 N--CA 1.441 -0.892 0 C-N-CA 129.725 3.21 . . . . 0.0 104.267 -167.416 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 38.4 t -72.04 144.96 12.65 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.811 0 N-CA-C 107.726 -1.213 . . . . 0.0 107.726 168.84 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 29.6 mtmt -129.63 67.66 1.44 Allowed 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 126.196 1.798 . . . . 0.0 106.716 -174.367 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 42.7 m-85 -57.85 107.28 0.44 Allowed 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 126.791 2.036 . . . . 0.0 110.25 178.769 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -118.46 145.82 44.96 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 123.895 0.878 . . . . 0.0 109.249 -176.584 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 46.1 p -76.55 158.9 30.81 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 123.318 0.647 . . . . 0.0 110.204 -177.572 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.05 -50.81 60.74 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 110.155 -0.313 . . . . 0.0 110.155 172.671 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -46.68 -54.51 9.46 Favored 'General case' 0 N--CA 1.445 -0.698 0 C-N-CA 124.246 1.018 . . . . 0.0 112.978 176.778 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -54.77 -46.45 74.37 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 122.757 1.265 . . . . 0.0 109.234 -177.471 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.424 ' CD1' HG22 ' A' ' 29' ' ' VAL . 82.0 mt -72.01 -27.37 27.08 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.516 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.967 -174.809 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -71.65 4.77 2.88 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 118.223 -0.894 . . . . 0.0 113.095 168.528 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 6.5 mmtp -82.0 -60.93 2.06 Favored 'General case' 0 C--N 1.346 0.435 0 CA-C-N 120.908 1.685 . . . . 0.0 108.004 169.842 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -85.8 157.14 20.31 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 115.132 -0.94 . . . . 0.0 110.685 -164.922 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 24.0 tttt -165.6 -54.72 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.701 0.762 . . . . 0.0 110.162 -155.862 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 42.7 t0 -94.39 -167.2 1.62 Allowed 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 125.256 1.422 . . . . 0.0 110.419 -170.375 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 61.93 49.21 4.8 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 121.466 0.65 . . . . 0.0 112.028 142.418 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 56.2 40.7 29.97 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.034 0.933 . . . . 0.0 111.419 -176.151 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.8 m -153.89 83.51 1.15 Allowed 'General case' 0 CA--C 1.53 0.19 0 O-C-N 120.566 -1.334 . . . . 0.0 110.947 172.72 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 53.1 m -108.84 85.83 2.17 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 105.413 -2.069 . . . . 0.0 105.413 177.542 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 41.9 m0 -98.1 143.42 28.66 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 108.728 -0.841 . . . . 0.0 108.728 171.042 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -129.21 159.6 41.05 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.327 0 C-N-CA 123.976 0.91 . . . . 0.0 110.508 -174.088 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.44 HG22 ' O ' ' A' ' 24' ' ' ILE . 1.7 mp -109.91 76.11 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.545 0 N-CA-C 106.421 -1.696 . . . . 0.0 106.421 165.936 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.5 mp -77.83 141.14 39.35 Favored 'General case' 0 CA--C 1.529 0.146 0 N-CA-C 105.353 -2.091 . . . . 0.0 105.353 155.635 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 3.3 m80 33.78 53.59 0.49 Allowed 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.958 1.303 . . . . 0.0 114.11 173.611 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' HIS . . . . . 0.66 ' CG ' HG13 ' A' ' 87' ' ' ILE . 1.7 m170 59.18 47.28 11.92 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 123.436 0.694 . . . . 0.0 111.668 166.352 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 6.7 mttt -159.65 139.79 11.84 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 118.651 0.66 . . . . 0.0 109.728 172.867 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.424 HG22 ' CD1' ' A' ' 12' ' ' ILE . 91.9 t -72.0 104.58 1.75 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.671 0 C-N-CA 125.095 1.358 . . . . 0.0 108.83 179.61 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -107.86 121.37 44.62 Favored 'General case' 0 N--CA 1.443 -0.799 0 O-C-N 124.432 1.082 . . . . 0.0 109.16 -178.224 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -77.88 120.25 22.49 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 174.484 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 31.8 mt -99.15 -21.37 16.17 Favored 'General case' 0 C--O 1.216 -0.7 0 CA-C-O 116.825 -1.559 . . . . 0.0 110.659 171.873 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 20.0 m -36.4 -41.65 0.29 Allowed 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 116.347 1.981 . . . . 0.0 116.347 170.159 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 57.0 mttt -58.43 -55.63 32.5 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 119.824 1.193 . . . . 0.0 110.102 170.263 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -66.09 -23.39 66.51 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 114.997 -1.002 . . . . 0.0 112.924 -175.786 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 6.2 mp -46.21 -28.79 1.36 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.277 1.431 . . . . 0.0 109.604 168.398 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -118.92 39.48 3.52 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.242 0.617 . . . . 0.0 111.122 176.591 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -159.4 -49.09 0.06 Allowed 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 179.687 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 34.1 t-80 -47.88 130.8 11.68 Favored Pre-proline 0 CA--C 1.536 0.437 0 C-N-CA 126.297 1.839 . . . . 0.0 112.642 -172.058 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -70.62 144.87 50.67 Favored 'Trans proline' 0 N--CA 1.451 -0.996 0 C-N-CA 122.313 2.009 . . . . 0.0 110.016 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 102.99 -63.09 0.44 Allowed Glycine 0 CA--C 1.524 0.595 0 N-CA-C 109.923 -1.271 . . . . 0.0 109.923 178.843 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 171.78 164.63 27.69 Favored Glycine 0 CA--C 1.524 0.6 0 N-CA-C 111.067 -0.813 . . . . 0.0 111.067 177.157 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -103.06 -31.52 10.15 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 125.551 1.54 . . . . 0.0 111.634 179.899 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -51.14 -48.48 61.81 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 179.743 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.3 m -57.62 -36.59 54.83 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 C-N-CA 123.28 0.632 . . . . 0.0 111.346 177.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 70.9 mt -63.71 -49.84 71.53 Favored 'General case' 0 C--N 1.341 0.216 0 CA-C-O 121.835 0.826 . . . . 0.0 108.854 178.026 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 2.6 tmt_? -69.88 -30.54 68.01 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 114.687 -1.142 . . . . 0.0 112.051 -174.624 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -45.19 -59.99 2.35 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 119.181 0.9 . . . . 0.0 111.243 179.412 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -77.08 -60.35 2.4 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 -179.277 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . 51.99 -128.09 2.39 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.238 1.015 . . . . 0.0 111.083 -178.412 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -66.49 75.31 0.14 Allowed Glycine 0 CA--C 1.527 0.808 0 C-N-CA 124.479 1.038 . . . . 0.0 111.006 177.696 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -148.31 -103.18 0.3 Allowed Glycine 0 CA--C 1.525 0.685 0 N-CA-C 107.966 -2.054 . . . . 0.0 107.966 174.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -163.52 65.1 0.17 Allowed 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 124.208 1.003 . . . . 0.0 109.241 -179.103 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -77.18 51.56 0.84 Allowed 'General case' 0 CA--C 1.534 0.353 0 O-C-N 120.751 -1.218 . . . . 0.0 112.115 -176.365 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 15.8 m -98.33 -65.74 0.94 Allowed 'General case' 0 C--O 1.228 -0.073 0 C-N-CA 123.362 0.665 . . . . 0.0 110.452 -177.27 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -53.14 -53.65 47.33 Favored 'General case' 0 C--O 1.225 -0.216 0 CA-C-O 121.499 0.666 . . . . 0.0 109.223 -169.729 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 19.4 t-20 -57.76 -46.79 84.04 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 122.366 1.079 . . . . 0.0 110.976 -178.479 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -54.96 -42.75 72.75 Favored 'General case' 0 CA--C 1.539 0.525 0 O-C-N 121.353 -0.842 . . . . 0.0 111.713 174.822 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -76.48 -36.16 57.99 Favored 'General case' 0 C--O 1.225 -0.195 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 -176.799 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -51.14 -46.01 61.85 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.802 1.241 . . . . 0.0 110.901 173.29 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 83.8 t -62.58 -24.27 34.88 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 174.685 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 104.43 32.21 4.33 Favored Glycine 0 CA--C 1.523 0.593 0 C-N-CA 124.524 1.059 . . . . 0.0 111.438 175.077 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 73.2 m80 -75.82 74.56 2.77 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 117.94 0.87 . . . . 0.0 110.24 174.245 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 20.6 t -113.93 -166.79 1.13 Allowed 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 166.759 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 57.07 -141.24 0.8 Allowed 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 122.782 0.433 . . . . 0.0 110.458 172.469 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -33.78 -65.13 0.19 Allowed 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 127.439 2.296 . . . . 0.0 113.317 177.79 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -53.0 -42.33 65.5 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 123.79 0.836 . . . . 0.0 110.437 -177.855 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.89 -46.13 85.37 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 124.462 1.105 . . . . 0.0 110.284 178.433 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -66.01 -50.62 63.6 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 109.603 -0.518 . . . . 0.0 109.603 177.502 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -51.93 -34.1 40.29 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 124.283 1.033 . . . . 0.0 111.664 175.302 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 19.8 m -45.22 -46.53 12.38 Favored 'General case' 0 C--N 1.341 0.232 0 CA-C-N 119.082 0.855 . . . . 0.0 109.831 173.334 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 21.8 tttt -61.97 -22.92 66.06 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 123.089 0.555 . . . . 0.0 112.428 -176.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -74.05 -23.36 59.37 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.354 0.662 . . . . 0.0 111.39 177.611 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -79.83 7.7 8.22 Favored 'General case' 0 C--N 1.341 0.22 0 O-C-N 121.452 -0.78 . . . . 0.0 111.661 175.497 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 5.6 tp -64.35 113.97 2.01 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.693 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 176.232 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.0 pp -105.9 -36.77 3.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 C-N-CA 124.211 1.004 . . . . 0.0 110.262 176.449 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -151.22 -13.2 0.08 OUTLIER Glycine 0 CA--C 1.529 0.926 0 N-CA-C 116.848 1.499 . . . . 0.0 116.848 -176.617 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 60.41 170.62 0.09 Allowed 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 119.552 1.676 . . . . 0.0 113.264 -170.224 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 29.2 mt -63.05 157.68 21.45 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.46 170.526 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 3.8 t-80 -54.2 132.77 60.62 Favored Pre-proline 0 N--CA 1.448 -0.543 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 160.154 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_endo -58.21 -20.92 49.27 Favored 'Trans proline' 0 N--CA 1.453 -0.91 0 C-N-CA 122.208 1.938 . . . . 0.0 112.26 -179.718 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 61.4 t0 -60.29 -76.5 0.05 OUTLIER 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.297 1.039 . . . . 0.0 110.377 174.8 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 84.7 m-20 -39.34 -55.41 1.73 Allowed 'General case' 0 C--N 1.346 0.422 0 C-N-CA 125.353 1.461 . . . . 0.0 109.017 173.881 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.14 -33.76 69.52 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 124.553 1.141 . . . . 0.0 112.598 -174.064 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.2 t -66.83 -32.12 73.19 Favored 'General case' 0 N--CA 1.457 -0.113 0 CA-C-N 119.065 0.848 . . . . 0.0 110.357 177.446 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 9.3 tmtt? -103.73 20.35 18.19 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 123.717 0.807 . . . . 0.0 110.501 -178.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.66 HG13 ' CG ' ' A' ' 27' ' ' HIS . 0.0 OUTLIER -61.61 108.07 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 -178.45 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -65.72 145.02 56.52 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 -177.786 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.43 114.88 10.42 Favored Pre-proline 0 CA--C 1.536 0.417 0 N-CA-C 107.095 -1.446 . . . . 0.0 107.095 179.023 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_endo -67.56 -78.86 0.01 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.792 0 C-N-CA 122.853 2.369 . . . . 0.0 109.443 -162.295 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 174.15 149.46 0.08 Allowed 'General case' 0 N--CA 1.44 -0.937 0 C-N-CA 130.565 3.546 . . . . 0.0 101.68 -175.436 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.579 ' CA ' ' HB ' ' A' ' 93' ' ' THR . 36.0 mm-40 42.4 132.76 0.0 OUTLIER 'General case' 0 CA--C 1.553 1.093 0 N-CA-C 118.433 2.753 . . . . 0.0 118.433 119.438 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.579 ' HB ' ' CA ' ' A' ' 92' ' ' GLU . 14.4 t 174.26 -46.89 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 127.599 2.36 . . . . 0.0 112.308 13.958 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.248 0.996 0 CA-C-O 117.488 -1.244 . . . . 0.0 111.113 -157.751 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . 2.469 5.0 p-10 . . . . . 0 N--CA 1.476 0.826 0 N-CA-C 106.608 -1.627 . . . . 0.0 106.608 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 19.0 pttm -153.76 174.1 14.99 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 113.332 0.864 . . . . 0.0 113.332 -164.153 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -146.16 150.94 36.83 Favored 'General case' 0 N--CA 1.441 -0.892 0 C-N-CA 129.725 3.21 . . . . 0.0 104.267 -167.416 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 38.4 t -72.04 144.96 12.65 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.811 0 N-CA-C 107.726 -1.213 . . . . 0.0 107.726 168.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 29.6 mtmt -129.63 67.66 1.44 Allowed 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 126.196 1.798 . . . . 0.0 106.716 -174.367 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 42.7 m-85 -57.85 107.28 0.44 Allowed 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 126.791 2.036 . . . . 0.0 110.25 178.769 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -118.46 145.82 44.96 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 123.895 0.878 . . . . 0.0 109.249 -176.584 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 46.1 p -76.55 158.9 30.81 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 123.318 0.647 . . . . 0.0 110.204 -177.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.05 -50.81 60.74 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 110.155 -0.313 . . . . 0.0 110.155 172.671 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -46.68 -54.51 9.46 Favored 'General case' 0 N--CA 1.445 -0.698 0 C-N-CA 124.246 1.018 . . . . 0.0 112.978 176.778 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -54.77 -46.45 74.37 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 122.757 1.265 . . . . 0.0 109.234 -177.471 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.424 ' CD1' HG22 ' A' ' 29' ' ' VAL . 82.0 mt -72.01 -27.37 27.08 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.516 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.967 -174.809 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -71.65 4.77 2.88 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 118.223 -0.894 . . . . 0.0 113.095 168.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 6.5 mmtp -82.0 -60.93 2.06 Favored 'General case' 0 C--N 1.346 0.435 0 CA-C-N 120.908 1.685 . . . . 0.0 108.004 169.842 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -85.8 157.14 20.31 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 115.132 -0.94 . . . . 0.0 110.685 -164.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 24.0 tttt -165.6 -54.72 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.701 0.762 . . . . 0.0 110.162 -155.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 42.7 t0 -94.39 -167.2 1.62 Allowed 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 125.256 1.422 . . . . 0.0 110.419 -170.375 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 61.93 49.21 4.8 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 121.466 0.65 . . . . 0.0 112.028 142.418 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 56.2 40.7 29.97 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.034 0.933 . . . . 0.0 111.419 -176.151 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.8 m -153.89 83.51 1.15 Allowed 'General case' 0 CA--C 1.53 0.19 0 O-C-N 120.566 -1.334 . . . . 0.0 110.947 172.72 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 53.1 m -108.84 85.83 2.17 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 105.413 -2.069 . . . . 0.0 105.413 177.542 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 41.9 m0 -98.1 143.42 28.66 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 108.728 -0.841 . . . . 0.0 108.728 171.042 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -129.21 159.6 41.05 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.327 0 C-N-CA 123.976 0.91 . . . . 0.0 110.508 -174.088 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.44 HG22 ' O ' ' A' ' 24' ' ' ILE . 1.7 mp -109.91 76.11 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.545 0 N-CA-C 106.421 -1.696 . . . . 0.0 106.421 165.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.5 mp -77.83 141.14 39.35 Favored 'General case' 0 CA--C 1.529 0.146 0 N-CA-C 105.353 -2.091 . . . . 0.0 105.353 155.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 3.3 m80 33.78 53.59 0.49 Allowed 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.958 1.303 . . . . 0.0 114.11 173.611 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . 0.66 ' CG ' HG13 ' A' ' 87' ' ' ILE . 1.7 m170 59.18 47.28 11.92 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 123.436 0.694 . . . . 0.0 111.668 166.352 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 6.7 mttt -159.65 139.79 11.84 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 118.651 0.66 . . . . 0.0 109.728 172.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.424 HG22 ' CD1' ' A' ' 12' ' ' ILE . 91.9 t -72.0 104.58 1.75 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.671 0 C-N-CA 125.095 1.358 . . . . 0.0 108.83 179.61 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -107.86 121.37 44.62 Favored 'General case' 0 N--CA 1.443 -0.799 0 O-C-N 124.432 1.082 . . . . 0.0 109.16 -178.224 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -77.88 120.25 22.49 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 174.484 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 31.8 mt -99.15 -21.37 16.17 Favored 'General case' 0 C--O 1.216 -0.7 0 CA-C-O 116.825 -1.559 . . . . 0.0 110.659 171.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 20.0 m -36.4 -41.65 0.29 Allowed 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 116.347 1.981 . . . . 0.0 116.347 170.159 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 57.0 mttt -58.43 -55.63 32.5 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 119.824 1.193 . . . . 0.0 110.102 170.263 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -66.09 -23.39 66.51 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 114.997 -1.002 . . . . 0.0 112.924 -175.786 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 6.2 mp -46.21 -28.79 1.36 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.277 1.431 . . . . 0.0 109.604 168.398 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -118.92 39.48 3.52 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.242 0.617 . . . . 0.0 111.122 176.591 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -159.4 -49.09 0.06 Allowed 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 179.687 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 34.1 t-80 -47.88 130.8 11.68 Favored Pre-proline 0 CA--C 1.536 0.437 0 C-N-CA 126.297 1.839 . . . . 0.0 112.642 -172.058 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -70.62 144.87 50.67 Favored 'Trans proline' 0 N--CA 1.451 -0.996 0 C-N-CA 122.313 2.009 . . . . 0.0 110.016 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 102.99 -63.09 0.44 Allowed Glycine 0 CA--C 1.524 0.595 0 N-CA-C 109.923 -1.271 . . . . 0.0 109.923 178.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 171.78 164.63 27.69 Favored Glycine 0 CA--C 1.524 0.6 0 N-CA-C 111.067 -0.813 . . . . 0.0 111.067 177.157 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -103.06 -31.52 10.15 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 125.551 1.54 . . . . 0.0 111.634 179.899 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -51.14 -48.48 61.81 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 179.743 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.3 m -57.62 -36.59 54.83 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 C-N-CA 123.28 0.632 . . . . 0.0 111.346 177.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 70.9 mt -63.71 -49.84 71.53 Favored 'General case' 0 C--N 1.341 0.216 0 CA-C-O 121.835 0.826 . . . . 0.0 108.854 178.026 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 2.6 tmt_? -69.88 -30.54 68.01 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 114.687 -1.142 . . . . 0.0 112.051 -174.624 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -45.19 -59.99 2.35 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 119.181 0.9 . . . . 0.0 111.243 179.412 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -77.08 -60.35 2.4 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 -179.277 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . 51.99 -128.09 2.39 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.238 1.015 . . . . 0.0 111.083 -178.412 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -66.49 75.31 0.14 Allowed Glycine 0 CA--C 1.527 0.808 0 C-N-CA 124.479 1.038 . . . . 0.0 111.006 177.696 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -148.31 -103.18 0.3 Allowed Glycine 0 CA--C 1.525 0.685 0 N-CA-C 107.966 -2.054 . . . . 0.0 107.966 174.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -163.52 65.1 0.17 Allowed 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 124.208 1.003 . . . . 0.0 109.241 -179.103 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -77.18 51.56 0.84 Allowed 'General case' 0 CA--C 1.534 0.353 0 O-C-N 120.751 -1.218 . . . . 0.0 112.115 -176.365 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 15.8 m -98.33 -65.74 0.94 Allowed 'General case' 0 C--O 1.228 -0.073 0 C-N-CA 123.362 0.665 . . . . 0.0 110.452 -177.27 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -53.14 -53.65 47.33 Favored 'General case' 0 C--O 1.225 -0.216 0 CA-C-O 121.499 0.666 . . . . 0.0 109.223 -169.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 19.4 t-20 -57.76 -46.79 84.04 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 122.366 1.079 . . . . 0.0 110.976 -178.479 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -54.96 -42.75 72.75 Favored 'General case' 0 CA--C 1.539 0.525 0 O-C-N 121.353 -0.842 . . . . 0.0 111.713 174.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -76.48 -36.16 57.99 Favored 'General case' 0 C--O 1.225 -0.195 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 -176.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -51.14 -46.01 61.85 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.802 1.241 . . . . 0.0 110.901 173.29 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 83.8 t -62.58 -24.27 34.88 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 174.685 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 104.43 32.21 4.33 Favored Glycine 0 CA--C 1.523 0.593 0 C-N-CA 124.524 1.059 . . . . 0.0 111.438 175.077 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 73.2 m80 -75.82 74.56 2.77 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 117.94 0.87 . . . . 0.0 110.24 174.245 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 20.6 t -113.93 -166.79 1.13 Allowed 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 166.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 57.07 -141.24 0.8 Allowed 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 122.782 0.433 . . . . 0.0 110.458 172.469 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -33.78 -65.13 0.19 Allowed 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 127.439 2.296 . . . . 0.0 113.317 177.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -53.0 -42.33 65.5 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 123.79 0.836 . . . . 0.0 110.437 -177.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.89 -46.13 85.37 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 124.462 1.105 . . . . 0.0 110.284 178.433 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -66.01 -50.62 63.6 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 109.603 -0.518 . . . . 0.0 109.603 177.502 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -51.93 -34.1 40.29 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 124.283 1.033 . . . . 0.0 111.664 175.302 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 19.8 m -45.22 -46.53 12.38 Favored 'General case' 0 C--N 1.341 0.232 0 CA-C-N 119.082 0.855 . . . . 0.0 109.831 173.334 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 21.8 tttt -61.97 -22.92 66.06 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 123.089 0.555 . . . . 0.0 112.428 -176.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -74.05 -23.36 59.37 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.354 0.662 . . . . 0.0 111.39 177.611 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -79.83 7.7 8.22 Favored 'General case' 0 C--N 1.341 0.22 0 O-C-N 121.452 -0.78 . . . . 0.0 111.661 175.497 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 5.6 tp -64.35 113.97 2.01 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.693 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 176.232 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.0 pp -105.9 -36.77 3.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 C-N-CA 124.211 1.004 . . . . 0.0 110.262 176.449 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -151.22 -13.2 0.08 OUTLIER Glycine 0 CA--C 1.529 0.926 0 N-CA-C 116.848 1.499 . . . . 0.0 116.848 -176.617 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 60.41 170.62 0.09 Allowed 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 119.552 1.676 . . . . 0.0 113.264 -170.224 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 29.2 mt -63.05 157.68 21.45 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.46 170.526 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 3.8 t-80 -54.2 132.77 60.62 Favored Pre-proline 0 N--CA 1.448 -0.543 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 160.154 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_endo -58.21 -20.92 49.27 Favored 'Trans proline' 0 N--CA 1.453 -0.91 0 C-N-CA 122.208 1.938 . . . . 0.0 112.26 -179.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 61.4 t0 -60.29 -76.5 0.05 OUTLIER 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.297 1.039 . . . . 0.0 110.377 174.8 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 84.7 m-20 -39.34 -55.41 1.73 Allowed 'General case' 0 C--N 1.346 0.422 0 C-N-CA 125.353 1.461 . . . . 0.0 109.017 173.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.14 -33.76 69.52 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 124.553 1.141 . . . . 0.0 112.598 -174.064 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.2 t -66.83 -32.12 73.19 Favored 'General case' 0 N--CA 1.457 -0.113 0 CA-C-N 119.065 0.848 . . . . 0.0 110.357 177.446 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 9.3 tmtt? -103.73 20.35 18.19 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 123.717 0.807 . . . . 0.0 110.501 -178.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.66 HG13 ' CG ' ' A' ' 27' ' ' HIS . 0.0 OUTLIER -61.61 108.07 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 -178.45 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -65.72 145.02 56.52 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 -177.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.43 114.88 10.42 Favored Pre-proline 0 CA--C 1.536 0.417 0 N-CA-C 107.095 -1.446 . . . . 0.0 107.095 179.023 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_endo -67.56 -78.86 0.01 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.792 0 C-N-CA 122.853 2.369 . . . . 0.0 109.443 -162.295 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 174.15 149.46 0.08 Allowed 'General case' 0 N--CA 1.44 -0.937 0 C-N-CA 130.565 3.546 . . . . 0.0 101.68 -175.436 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.579 ' CA ' ' HB ' ' A' ' 93' ' ' THR . 36.0 mm-40 42.4 132.76 0.0 OUTLIER 'General case' 0 CA--C 1.553 1.093 0 N-CA-C 118.433 2.753 . . . . 0.0 118.433 119.438 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.579 ' HB ' ' CA ' ' A' ' 92' ' ' GLU . 14.4 t 174.26 -46.89 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 127.599 2.36 . . . . 0.0 112.308 13.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.248 0.996 0 CA-C-O 117.488 -1.244 . . . . 0.0 111.113 -157.751 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_