data_2ezm_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 2ezm _Structure_validation_residue.Date_analyzed 2016-10-07 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' ' ' LEU . . . . . . . . . . . . . 94.6 mt . . . . . 0 N--CA 1.491 1.592 0 CA-C-O 121.495 0.664 . . . . 1.0800000000000001 109.946 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 65.41 -142.6 44.51 Favored Glycine 0 N--CA 1.492 2.38 0 N-CA-C 110.318 -1.113 . . . . 0.19 110.318 179.726 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 92.5 mttt 78.74 18.69 0.92 Allowed 'General case' 0 N--CA 1.504 2.275 0 CA-C-N 117.608 0.704 . . . . 2.4399999999999999 110.236 -179.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 22.6 p90 -47.03 -20.61 0.16 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.361 -0.837 . . . . 0.14999999999999999 110.205 179.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 86.6 p -70.07 -13.28 62.14 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 120.447 -1.408 . . . . 0.91000000000000003 111.074 -178.398 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 -71.66 -27.6 63.17 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.705 -1.247 . . . . 1.8899999999999999 110.23 179.084 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 49.1 p -126.68 19.3 7.29 Favored 'General case' 0 N--CA 1.502 2.159 0 O-C-N 121.327 -0.858 . . . . 1.03 110.793 -179.323 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 64.1 m -130.11 153.68 48.25 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 120.996 -1.065 . . . . 0.12 108.401 178.627 -57.315 -115.502 116.34 104.879 2.023 104.368 -77.046 -70.0 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 42.3 p90 -147.45 172.11 14.45 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.006 -1.059 . . . . 0.93000000000000005 110.111 -179.178 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 68.5 m-20 56.19 35.7 26.18 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.368 -0.833 . . . . 0.84999999999999998 109.498 -178.464 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 53.6 m -67.71 144.4 55.47 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.338 -0.851 . . . . 0.95999999999999996 109.736 179.614 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -144.89 154.43 42.61 Favored 'General case' 0 N--CA 1.495 1.812 0 CA-C-O 121.383 0.611 . . . . 1.04 109.485 -179.271 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 58.7 mt -134.18 134.39 55.27 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.859 0 CA-C-O 121.77 0.795 . . . . 1.04 109.724 179.486 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 59.6 tt0 -135.79 111.87 9.64 Favored 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 107.323 -1.362 . . . . 2.2200000000000002 107.323 178.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 70.05 -118.15 7.9 Favored Glycine 0 N--CA 1.483 1.828 0 N-CA-C 107.902 -2.079 . . . . 0.19 107.902 -178.095 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 97.6 p -111.59 4.25 18.55 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.247 -1.149 . . . . 0.44 109.894 178.618 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 75.1 t -92.8 123.47 44.91 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.271 0 O-C-N 120.899 -1.125 . . . . 1.0600000000000001 112.229 -177.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 37.8 tp -94.21 128.39 40.62 Favored 'General case' 0 N--CA 1.496 1.856 0 N-CA-C 107.237 -1.394 . . . . 1.0600000000000001 107.237 176.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 99.4 m -128.25 130.65 48.24 Favored 'General case' 0 N--CA 1.499 1.98 0 N-CA-C 108.893 -0.78 . . . . 1.05 108.893 -179.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.5 t -157.33 157.16 33.62 Favored 'General case' 0 N--CA 1.496 1.863 0 C-N-CA 118.086 -1.446 . . . . 0.92000000000000004 111.121 -179.389 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 88.2 m -98.22 122.68 41.68 Favored 'General case' 0 N--CA 1.497 1.916 0 N-CA-C 107.114 -1.439 . . . . 1.01 107.114 178.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 93.4 m -120.07 153.99 35.3 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.431 -0.793 . . . . 0.13 111.086 -178.911 -70.0 -77.046 116.34 104.368 2.023 104.879 -115.502 -57.315 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 85.7 tt0 -84.87 141.58 30.32 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-O 122.294 1.045 . . . . 0.27000000000000002 110.589 179.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 64.6 mtt180 -81.13 154.8 26.55 Favored 'General case' 0 C--N 1.299 -1.61 0 CA-C-O 121.838 0.827 . . . . 2.8799999999999999 110.229 178.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 5.4 m -60.04 -40.01 87.92 Favored 'General case' 0 C--N 1.302 -1.479 0 N-CA-C 108.217 -1.031 . . . . 1.74 108.217 179.013 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -88.27 26.48 1.41 Allowed 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.445 -0.784 . . . . 3.1600000000000001 109.845 -177.134 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 73.8 155.96 3.97 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.015 -1.634 . . . . 0.20999999999999999 109.015 -179.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 104.54 161.56 24.18 Favored Glycine 0 N--CA 1.502 3.081 0 N-CA-C 106.54 -2.624 . . . . 0.29999999999999999 106.54 -175.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 41.1 m-85 -116.6 145.9 43.05 Favored 'General case' 0 N--CA 1.505 2.313 0 CA-C-N 119.316 1.558 . . . . 0.93999999999999995 110.265 179.474 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 48.3 t30 -126.7 146.85 50.05 Favored 'General case' 0 N--CA 1.498 1.945 0 N-CA-C 108.597 -0.89 . . . . 0.5 108.597 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 93.9 m -119.89 130.12 54.69 Favored 'General case' 0 N--CA 1.501 2.093 0 N-CA-C 108.55 -0.907 . . . . 1.0700000000000001 108.55 -178.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 89.2 p -151.3 167.49 27.72 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 120.633 -1.292 . . . . 0.55000000000000004 110.658 -179.059 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 18.5 m -138.46 148.92 44.92 Favored 'General case' 0 N--CA 1.49 1.561 0 CA-C-O 121.64 0.733 . . . . 0.87 109.801 -179.437 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 20.4 tt -142.82 140.32 27.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 N-CA-C 109.02 -0.733 . . . . 1.0700000000000001 109.02 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 53.7 t0 -81.45 116.51 21.29 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.018 -1.051 . . . . 0.22 109.368 -179.402 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 23.0 mt -79.92 -2.92 45.88 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 120.915 -1.116 . . . . 1.04 108.918 179.121 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -59.59 -38.48 81.34 Favored 'General case' 0 C--N 1.299 -1.623 0 O-C-N 120.842 -1.161 . . . . 0.23000000000000001 109.834 -178.495 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 93.2 p -72.5 3.84 4.46 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.155 -0.966 . . . . 0.94999999999999996 112.276 -178.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.489 ' O ' ' N ' ' A' ' 50' ' ' GLN . 3.4 m -135.92 -5.05 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.51 2.566 0 O-C-N 120.321 -1.487 . . . . 1.04 112.299 -178.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 82.1 mt -114.06 133.38 60.28 Favored 'Isoleucine or valine' 0 N--CA 1.516 2.859 0 O-C-N 120.75 -1.219 . . . . 1.1499999999999999 111.28 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.507 ' OE1' ' NE2' ' A' ' 50' ' ' GLN . 71.9 tt0 -122.3 155.79 35.21 Favored 'General case' 0 N--CA 1.51 2.567 0 N-CA-C 109.056 -0.72 . . . . 0.40999999999999998 109.056 178.853 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 42.3 t30 -102.09 117.87 35.7 Favored 'General case' 0 N--CA 1.495 1.816 0 N-CA-C 107.275 -1.38 . . . . 0.26000000000000001 107.275 177.291 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 89.6 t -111.66 98.27 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.302 0 CA-C-O 122.285 1.04 . . . . 1.1100000000000001 110.418 -179.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.439 ' O ' ' OD1' ' A' ' 44' ' ' ASP . 46.1 t0 48.6 39.74 14.0 Favored 'General case' 0 C--N 1.3 -1.56 0 CA-C-N 115.713 -0.676 . . . . 0.29999999999999999 111.981 177.716 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 115.07 -16.84 17.72 Favored Glycine 0 N--CA 1.506 3.326 0 C-N-CA 120.187 -1.006 . . . . 0.23999999999999999 113.257 178.062 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 7.9 t -121.62 143.61 49.22 Favored 'General case' 0 N--CA 1.508 2.427 0 CA-C-N 120.647 2.224 . . . . 1.8600000000000001 112.306 -176.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 86.1 mt -79.6 130.0 34.98 Favored 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 109.314 -0.625 . . . . 1.05 109.314 177.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 14.1 mmtt -125.49 161.6 26.76 Favored 'General case' 0 N--CA 1.507 2.418 0 O-C-N 121.625 -0.672 . . . . 2.21 110.202 -179.517 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 78.1 m95 -76.42 80.92 3.15 Favored 'General case' 0 N--CA 1.501 2.099 0 O-C-N 121.436 -0.79 . . . . 0.17000000000000001 111.265 -179.158 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.507 ' NE2' ' OE1' ' A' ' 41' ' ' GLU . 8.7 tt0 -165.75 139.27 3.61 Favored Pre-proline 0 N--CA 1.499 1.977 0 O-C-N 120.944 -1.097 . . . . 1.24 108.372 179.761 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_endo -64.33 144.34 85.69 Favored 'Trans proline' 0 N--CA 1.505 2.165 0 C-N-CA 121.585 1.523 . . . . 0.25 112.966 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 174.41 12.36 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.176 0 O-C-N 121.492 -0.755 . . . . 1.5900000000000001 109.68 178.79 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 37.8 t-20 58.49 59.71 2.86 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.075 -1.016 . . . . 0.34000000000000002 109.498 -179.755 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.462 ' CG ' ' N ' ' A' ' 55' ' ' ILE . 15.7 p90 -60.03 -39.98 87.74 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.395 -0.816 . . . . 0.17999999999999999 111.261 -178.853 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ILE . . . . . 0.462 ' N ' ' CG ' ' A' ' 54' ' ' PHE . 3.5 tp -57.75 -21.42 16.33 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 O-C-N 121.087 -1.008 . . . . 1.3100000000000001 110.187 -178.368 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 80.8 tt0 -63.38 -31.42 72.57 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.002 -1.061 . . . . 1.24 109.028 179.015 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 48.8 p -117.57 18.33 14.26 Favored 'General case' 0 N--CA 1.513 2.682 0 C-N-CA 119.796 -0.762 . . . . 1.0700000000000001 110.505 -179.268 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 71.0 m -134.01 155.65 49.61 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.047 -1.033 . . . . 0.13 109.555 179.49 -62.414 -110.889 121.699 103.948 2.019 105.01 -79.427 -72.32 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 32.7 ptt180 -141.32 178.48 7.39 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.443 -0.785 . . . . 0.31 110.179 -177.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 48.1 t-20 47.9 49.92 16.32 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.67 -0.644 . . . . 0.35999999999999999 111.238 178.356 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 41.5 p -75.33 132.21 40.81 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 107.624 -1.251 . . . . 1.04 107.624 177.434 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 -149.22 162.55 39.78 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 120.81 -1.181 . . . . 3.1499999999999999 110.449 -178.6 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 17.0 tp -85.72 127.54 34.54 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.314 -0.866 . . . . 1.0800000000000001 108.895 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -119.8 129.95 54.7 Favored 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 109.28 -0.637 . . . . 1.04 109.28 -179.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 66.26 -150.44 51.87 Favored Glycine 0 N--CA 1.491 2.307 0 C-N-CA 120.015 -1.088 . . . . 0.22 110.725 178.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -89.86 -39.3 13.15 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.619 -0.93 . . . . 1.72 110.893 -178.918 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 94.4 p -133.57 9.07 3.95 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.244 -0.91 . . . . 0.51000000000000001 112.564 -177.363 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -99.16 140.05 33.89 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 120.386 -1.446 . . . . 1.6799999999999999 111.33 -178.262 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.5 tp -109.45 120.07 41.39 Favored 'General case' 0 N--CA 1.496 1.864 0 N-CA-C 108.008 -1.108 . . . . 1.0700000000000001 108.008 178.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -105.62 140.48 38.62 Favored 'General case' 0 N--CA 1.496 1.868 0 N-CA-C 108.952 -0.759 . . . . 1.04 108.952 -179.102 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -155.92 174.95 14.59 Favored 'General case' 0 C--N 1.3 -1.583 0 N-CA-C 108.822 -0.807 . . . . 1.03 108.822 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -118.09 132.57 56.34 Favored 'General case' 0 N--CA 1.493 1.72 0 N-CA-C 105.787 -1.931 . . . . 0.51000000000000001 105.787 177.08 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 67.4 m -132.68 148.25 52.34 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 120.82 -1.175 . . . . 0.14999999999999999 111.678 -178.089 -72.32 -79.427 121.699 105.01 2.019 103.948 -110.889 -62.414 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 44.8 mtpt -73.49 133.32 43.61 Favored 'General case' 0 C--N 1.302 -1.466 0 CA-C-O 122.127 0.965 . . . . 1.1499999999999999 111.709 -179.218 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 22.7 p -91.56 173.17 8.03 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 106.874 -1.528 . . . . 1.03 106.874 177.35 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 23.8 mtm180 -58.65 -22.41 56.66 Favored 'General case' 0 C--N 1.294 -1.806 0 C-N-CA 118.575 -1.25 . . . . 3.77 109.16 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -83.78 10.09 10.34 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 120.557 -1.339 . . . . 1.0 110.131 -178.424 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 98.6 mm-40 65.05 35.49 8.01 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.113 -0.992 . . . . 0.81000000000000005 111.684 -179.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -120.11 141.33 49.91 Favored 'General case' 0 N--CA 1.505 2.281 0 O-C-N 121.376 -0.827 . . . . 2.98 109.076 178.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -87.13 124.39 33.2 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 120.774 -1.204 . . . . 0.20999999999999999 109.18 179.747 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.4 m -125.74 161.57 30.5 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.457 0 O-C-N 121.203 -0.935 . . . . 1.04 109.026 179.047 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 18.9 t -72.12 130.12 40.12 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 120.886 -1.134 . . . . 0.92000000000000004 111.169 -178.378 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' THR . . . . . 0.459 ' HG1' ' N ' ' A' ' 84' ' ' LYS . 7.1 t -135.2 157.48 46.82 Favored 'General case' 0 N--CA 1.497 1.902 0 N-CA-C 108.784 -0.821 . . . . 1.02 108.784 179.29 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.459 ' N ' ' HG1' ' A' ' 83' ' ' THR . 35.9 pttt -155.72 160.26 40.19 Favored 'General case' 0 N--CA 1.489 1.475 0 CA-C-O 122.074 0.94 . . . . 2.54 109.896 -179.588 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 19.3 tt -148.8 148.14 16.14 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 N-CA-C 109.146 -0.687 . . . . 1.0700000000000001 109.146 -179.116 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 46.6 t-20 -87.74 112.8 22.78 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.496 -0.752 . . . . 0.26000000000000001 109.927 -179.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 41.2 mt -67.59 -21.47 65.41 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.133 -0.98 . . . . 1.04 110.042 178.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 93.7 m-20 -68.25 -13.66 62.42 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.847 -1.158 . . . . 0.16 111.882 -177.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -62.87 -39.88 95.78 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 120.216 -1.553 . . . . 0.20000000000000001 113.024 -177.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 98.5 m-70 -138.73 -9.91 1.38 Allowed 'General case' 0 N--CA 1.506 2.35 0 O-C-N 120.749 -1.22 . . . . 0.22 112.334 -176.115 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 42.7 mm -84.7 110.18 18.76 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 O-C-N 120.551 -1.343 . . . . 1.1000000000000001 109.07 179.341 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -118.76 168.63 10.56 Favored 'General case' 0 N--CA 1.504 2.263 0 CA-C-O 121.895 0.855 . . . . 1.03 110.803 -179.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 26.2 t30 -111.38 111.03 21.78 Favored 'General case' 0 N--CA 1.494 1.762 0 N-CA-C 107.643 -1.243 . . . . 0.19 107.643 178.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 77.0 mt -113.47 107.03 21.91 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.165 0 N-CA-C 107.193 -1.41 . . . . 1.0600000000000001 107.193 179.202 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 23.7 t0 65.67 33.21 8.54 Favored 'General case' 0 N--CA 1.49 1.562 0 CA-C-N 115.59 -0.732 . . . . 0.22 112.253 178.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 84.61 1.17 89.24 Favored Glycine 0 N--CA 1.498 2.829 0 O-C-N 120.511 -1.368 . . . . 0.16 110.747 178.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 24.0 m -118.7 137.36 53.38 Favored 'General case' 0 N--CA 1.503 2.192 0 O-C-N 121.457 -1.025 . . . . 1.05 109.106 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 60.5 mt -82.26 138.65 34.55 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.068 -1.02 . . . . 1.05 109.807 -179.24 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 33.7 mttt -149.34 130.32 14.35 Favored 'General case' 0 N--CA 1.495 1.802 0 N-CA-C 109.256 -0.646 . . . . 2.0699999999999998 109.256 179.025 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 33.0 t80 -69.98 139.82 52.86 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.002 -1.061 . . . . 0.93999999999999995 108.964 179.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 24.7 pt-20 . . . . . 0 N--CA 1.497 1.892 0 O-C-N 121.069 -1.019 . . . . 1.0900000000000001 109.444 179.347 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 94.6 mt . . . . . 0 N--CA 1.491 1.592 0 CA-C-O 121.495 0.664 . . . . 0.33000000000000002 109.946 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLY . . . . . 0.412 ' O ' ' HB2' ' A' ' 3' ' ' LYS . . . 65.41 -142.6 44.51 Favored Glycine 0 N--CA 1.492 2.38 0 N-CA-C 110.318 -1.113 . . . . 0.19 110.318 179.726 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.412 ' HB2' ' O ' ' A' ' 2' ' ' GLY . 92.5 mttt 78.74 18.69 0.92 Allowed 'General case' 0 N--CA 1.504 2.275 0 CA-C-N 117.608 0.704 . . . . 1.9099999999999999 110.236 -179.701 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 22.6 p90 -47.03 -20.61 0.16 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.361 -0.837 . . . . 0.13 110.205 179.203 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 86.6 p -70.07 -13.28 62.14 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 120.447 -1.408 . . . . 0.19 111.074 -178.398 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -71.66 -27.6 63.17 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.705 -1.247 . . . . 1.1200000000000001 110.23 179.084 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 49.1 p -126.68 19.3 7.29 Favored 'General case' 0 N--CA 1.502 2.159 0 O-C-N 121.327 -0.858 . . . . 0.13 110.793 -179.323 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 64.1 m -130.11 153.68 48.25 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 120.996 -1.065 . . . . 0.11 108.401 178.627 -57.315 -115.502 116.34 104.879 2.023 104.368 -77.046 -70.0 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 42.3 p90 -147.45 172.11 14.45 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.006 -1.059 . . . . 0.27000000000000002 110.111 -179.178 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 68.5 m-20 56.19 35.7 26.18 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.368 -0.833 . . . . 0.54000000000000004 109.498 -178.464 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 53.6 m -67.71 144.4 55.47 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.338 -0.851 . . . . 0.19 109.736 179.614 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -144.89 154.43 42.61 Favored 'General case' 0 N--CA 1.495 1.812 0 CA-C-O 121.383 0.611 . . . . 0.14000000000000001 109.485 -179.271 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 58.7 mt -134.18 134.39 55.27 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.859 0 CA-C-O 121.77 0.795 . . . . 0.14000000000000001 109.724 179.486 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 59.6 tt0 -135.79 111.87 9.64 Favored 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 107.323 -1.362 . . . . 1.6799999999999999 107.323 178.65 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 70.05 -118.15 7.9 Favored Glycine 0 N--CA 1.483 1.828 0 N-CA-C 107.902 -2.079 . . . . 0.14999999999999999 107.902 -178.095 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 97.6 p -111.59 4.25 18.55 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.247 -1.149 . . . . 0.20000000000000001 109.894 178.618 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 75.1 t -92.8 123.47 44.91 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.271 0 O-C-N 120.899 -1.125 . . . . 0.20000000000000001 112.229 -177.822 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 37.8 tp -94.21 128.39 40.62 Favored 'General case' 0 N--CA 1.496 1.856 0 N-CA-C 107.237 -1.394 . . . . 0.19 107.237 176.835 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 99.4 m -128.25 130.65 48.24 Favored 'General case' 0 N--CA 1.499 1.98 0 N-CA-C 108.893 -0.78 . . . . 0.16 108.893 -179.777 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.5 t -157.33 157.16 33.62 Favored 'General case' 0 N--CA 1.496 1.863 0 C-N-CA 118.086 -1.446 . . . . 0.20000000000000001 111.121 -179.389 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 88.2 m -98.22 122.68 41.68 Favored 'General case' 0 N--CA 1.497 1.916 0 N-CA-C 107.114 -1.439 . . . . 0.14000000000000001 107.114 178.586 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 93.4 m -120.07 153.99 35.3 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.431 -0.793 . . . . 0.12 111.086 -178.911 -70.0 -77.046 116.34 104.368 2.023 104.879 -115.502 -57.315 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 85.7 tt0 -84.87 141.58 30.32 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-O 122.294 1.045 . . . . 0.27000000000000002 110.589 179.764 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 64.6 mtt180 -81.13 154.8 26.55 Favored 'General case' 0 C--N 1.299 -1.61 0 CA-C-O 121.838 0.827 . . . . 2.4100000000000001 110.229 178.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 5.4 m -60.04 -40.01 87.92 Favored 'General case' 0 C--N 1.302 -1.479 0 N-CA-C 108.217 -1.031 . . . . 1.1100000000000001 108.217 179.013 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -88.27 26.48 1.41 Allowed 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.445 -0.784 . . . . 2.3599999999999999 109.845 -177.134 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 73.8 155.96 3.97 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.015 -1.634 . . . . 0.20999999999999999 109.015 -179.605 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 104.54 161.56 24.18 Favored Glycine 0 N--CA 1.502 3.081 0 N-CA-C 106.54 -2.624 . . . . 0.29999999999999999 106.54 -175.809 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 41.1 m-85 -116.6 145.9 43.05 Favored 'General case' 0 N--CA 1.505 2.313 0 CA-C-N 119.316 1.558 . . . . 0.26000000000000001 110.265 179.474 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 48.3 t30 -126.7 146.85 50.05 Favored 'General case' 0 N--CA 1.498 1.945 0 N-CA-C 108.597 -0.89 . . . . 0.39000000000000001 108.597 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 93.9 m -119.89 130.12 54.69 Favored 'General case' 0 N--CA 1.501 2.093 0 N-CA-C 108.55 -0.907 . . . . 0.47999999999999998 108.55 -178.735 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 89.2 p -151.3 167.49 27.72 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 120.633 -1.292 . . . . 0.25 110.658 -179.059 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 18.5 m -138.46 148.92 44.92 Favored 'General case' 0 N--CA 1.49 1.561 0 CA-C-O 121.64 0.733 . . . . 0.23000000000000001 109.801 -179.437 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 20.4 tt -142.82 140.32 27.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 N-CA-C 109.02 -0.733 . . . . 0.23999999999999999 109.02 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 53.7 t0 -81.45 116.51 21.29 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.018 -1.051 . . . . 0.22 109.368 -179.402 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 23.0 mt -79.92 -2.92 45.88 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 120.915 -1.116 . . . . 0.14999999999999999 108.918 179.121 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -59.59 -38.48 81.34 Favored 'General case' 0 C--N 1.299 -1.623 0 O-C-N 120.842 -1.161 . . . . 0.23000000000000001 109.834 -178.495 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 93.2 p -72.5 3.84 4.46 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.155 -0.966 . . . . 0.16 112.276 -178.567 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.489 ' O ' ' N ' ' A' ' 50' ' ' GLN . 3.4 m -135.92 -5.05 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.51 2.566 0 O-C-N 120.321 -1.487 . . . . 0.14999999999999999 112.299 -178.886 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 82.1 mt -114.06 133.38 60.28 Favored 'Isoleucine or valine' 0 N--CA 1.516 2.859 0 O-C-N 120.75 -1.219 . . . . 0.42999999999999999 111.28 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.507 ' OE1' ' NE2' ' A' ' 50' ' ' GLN . 71.9 tt0 -122.3 155.79 35.21 Favored 'General case' 0 N--CA 1.51 2.567 0 N-CA-C 109.056 -0.72 . . . . 0.40999999999999998 109.056 178.853 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 42.3 t30 -102.09 117.87 35.7 Favored 'General case' 0 N--CA 1.495 1.816 0 N-CA-C 107.275 -1.38 . . . . 0.22 107.275 177.291 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 89.6 t -111.66 98.27 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.302 0 CA-C-O 122.285 1.04 . . . . 0.28000000000000003 110.418 -179.654 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.439 ' O ' ' OD1' ' A' ' 44' ' ' ASP . 46.1 t0 48.6 39.74 14.0 Favored 'General case' 0 C--N 1.3 -1.56 0 CA-C-N 115.713 -0.676 . . . . 0.29999999999999999 111.981 177.716 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 115.07 -16.84 17.72 Favored Glycine 0 N--CA 1.506 3.326 0 C-N-CA 120.187 -1.006 . . . . 0.20999999999999999 113.257 178.062 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 7.9 t -121.62 143.61 49.22 Favored 'General case' 0 N--CA 1.508 2.427 0 CA-C-N 120.647 2.224 . . . . 1.3899999999999999 112.306 -176.862 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.602 HD21 ' SG ' ' A' ' 73' ' ' CYS . 86.1 mt -79.6 130.0 34.98 Favored 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 109.314 -0.625 . . . . 0.23999999999999999 109.314 177.975 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 14.1 mmtt -125.49 161.6 26.76 Favored 'General case' 0 N--CA 1.507 2.418 0 O-C-N 121.625 -0.672 . . . . 1.6799999999999999 110.202 -179.517 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 78.1 m95 -76.42 80.92 3.15 Favored 'General case' 0 N--CA 1.501 2.099 0 O-C-N 121.436 -0.79 . . . . 0.14999999999999999 111.265 -179.158 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.507 ' NE2' ' OE1' ' A' ' 41' ' ' GLU . 8.7 tt0 -165.75 139.27 3.61 Favored Pre-proline 0 N--CA 1.499 1.977 0 O-C-N 120.944 -1.097 . . . . 0.95999999999999996 108.372 179.761 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_endo -64.33 144.34 85.69 Favored 'Trans proline' 0 N--CA 1.505 2.165 0 C-N-CA 121.585 1.523 . . . . 0.22 112.966 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 174.41 12.36 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.176 0 O-C-N 121.492 -0.755 . . . . 1.1399999999999999 109.68 178.79 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 37.8 t-20 58.49 59.71 2.86 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.075 -1.016 . . . . 0.26000000000000001 109.498 -179.755 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.462 ' CG ' ' N ' ' A' ' 55' ' ' ILE . 15.7 p90 -60.03 -39.98 87.74 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.395 -0.816 . . . . 0.14999999999999999 111.261 -178.853 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ILE . . . . . 0.462 ' N ' ' CG ' ' A' ' 54' ' ' PHE . 3.5 tp -57.75 -21.42 16.33 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 O-C-N 121.087 -1.008 . . . . 0.63 110.187 -178.368 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 80.8 tt0 -63.38 -31.42 72.57 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.002 -1.061 . . . . 1.24 109.028 179.015 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 48.8 p -117.57 18.33 14.26 Favored 'General case' 0 N--CA 1.513 2.682 0 C-N-CA 119.796 -0.762 . . . . 0.22 110.505 -179.268 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 71.0 m -134.01 155.65 49.61 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.047 -1.033 . . . . 0.12 109.555 179.49 -62.414 -110.889 121.699 103.948 2.019 105.01 -79.427 -72.32 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 32.7 ptt180 -141.32 178.48 7.39 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.443 -0.785 . . . . 0.28000000000000003 110.179 -177.944 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 48.1 t-20 47.9 49.92 16.32 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.67 -0.644 . . . . 0.28999999999999998 111.238 178.356 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 41.5 p -75.33 132.21 40.81 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 107.624 -1.251 . . . . 0.13 107.624 177.434 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 -149.22 162.55 39.78 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 120.81 -1.181 . . . . 2.6800000000000002 110.449 -178.6 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 17.0 tp -85.72 127.54 34.54 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.314 -0.866 . . . . 0.23999999999999999 108.895 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -119.8 129.95 54.7 Favored 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 109.28 -0.637 . . . . 0.16 109.28 -179.791 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 66.26 -150.44 51.87 Favored Glycine 0 N--CA 1.491 2.307 0 C-N-CA 120.015 -1.088 . . . . 0.20000000000000001 110.725 178.736 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -89.86 -39.3 13.15 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.619 -0.93 . . . . 1.23 110.893 -178.918 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 94.4 p -133.57 9.07 3.95 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.244 -0.91 . . . . 0.22 112.564 -177.363 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -99.16 140.05 33.89 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 120.386 -1.446 . . . . 1.6799999999999999 111.33 -178.262 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.542 HD12 ' N ' ' A' ' 70' ' ' ALA . 3.5 tp -109.45 120.07 41.39 Favored 'General case' 0 N--CA 1.496 1.864 0 N-CA-C 108.008 -1.108 . . . . 0.27000000000000002 108.008 178.836 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.542 ' N ' HD12 ' A' ' 69' ' ' LEU . . . -105.62 140.48 38.62 Favored 'General case' 0 N--CA 1.496 1.868 0 N-CA-C 108.952 -0.759 . . . . 0.13 108.952 -179.102 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -155.92 174.95 14.59 Favored 'General case' 0 C--N 1.3 -1.583 0 N-CA-C 108.822 -0.807 . . . . 0.12 108.822 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -118.09 132.57 56.34 Favored 'General case' 0 N--CA 1.493 1.72 0 N-CA-C 105.787 -1.931 . . . . 0.51000000000000001 105.787 177.08 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' CYS . . . . . 0.602 ' SG ' HD21 ' A' ' 47' ' ' LEU . 67.4 m -132.68 148.25 52.34 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 120.82 -1.175 . . . . 0.12 111.678 -178.089 -72.32 -79.427 121.699 105.01 2.019 103.948 -110.889 -62.414 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 44.8 mtpt -73.49 133.32 43.61 Favored 'General case' 0 C--N 1.302 -1.466 0 CA-C-O 122.127 0.965 . . . . 0.52000000000000002 111.709 -179.218 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 22.7 p -91.56 173.17 8.03 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 106.874 -1.528 . . . . 0.14000000000000001 106.874 177.35 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 23.8 mtm180 -58.65 -22.41 56.66 Favored 'General case' 0 C--N 1.294 -1.806 0 C-N-CA 118.575 -1.25 . . . . 3.2200000000000002 109.16 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -83.78 10.09 10.34 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 120.557 -1.339 . . . . 0.16 110.131 -178.424 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 98.6 mm-40 65.05 35.49 8.01 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.113 -0.992 . . . . 0.81000000000000005 111.684 -179.681 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -120.11 141.33 49.91 Favored 'General case' 0 N--CA 1.505 2.281 0 O-C-N 121.376 -0.827 . . . . 2.46 109.076 178.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -87.13 124.39 33.2 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 120.774 -1.204 . . . . 0.17999999999999999 109.18 179.747 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.4 m -125.74 161.57 30.5 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.457 0 O-C-N 121.203 -0.935 . . . . 0.13 109.026 179.047 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 18.9 t -72.12 130.12 40.12 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 120.886 -1.134 . . . . 0.22 111.169 -178.378 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 7.1 t -135.2 157.48 46.82 Favored 'General case' 0 N--CA 1.497 1.902 0 N-CA-C 108.784 -0.821 . . . . 0.19 108.784 179.29 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 35.9 pttt -155.72 160.26 40.19 Favored 'General case' 0 N--CA 1.489 1.475 0 CA-C-O 122.074 0.94 . . . . 2.04 109.896 -179.588 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 19.3 tt -148.8 148.14 16.14 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 N-CA-C 109.146 -0.687 . . . . 0.22 109.146 -179.116 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 46.6 t-20 -87.74 112.8 22.78 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.496 -0.752 . . . . 0.22 109.927 -179.529 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 41.2 mt -67.59 -21.47 65.41 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.133 -0.98 . . . . 0.17999999999999999 110.042 178.744 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 93.7 m-20 -68.25 -13.66 62.42 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.847 -1.158 . . . . 0.16 111.882 -177.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -62.87 -39.88 95.78 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 120.216 -1.553 . . . . 0.20000000000000001 113.024 -177.883 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 98.5 m-70 -138.73 -9.91 1.38 Allowed 'General case' 0 N--CA 1.506 2.35 0 O-C-N 120.749 -1.22 . . . . 0.17999999999999999 112.334 -176.115 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 42.7 mm -84.7 110.18 18.76 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 O-C-N 120.551 -1.343 . . . . 0.28999999999999998 109.07 179.341 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -118.76 168.63 10.56 Favored 'General case' 0 N--CA 1.504 2.263 0 CA-C-O 121.895 0.855 . . . . 0.10000000000000001 110.803 -179.787 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 26.2 t30 -111.38 111.03 21.78 Favored 'General case' 0 N--CA 1.494 1.762 0 N-CA-C 107.643 -1.243 . . . . 0.17000000000000001 107.643 178.436 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 77.0 mt -113.47 107.03 21.91 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.165 0 N-CA-C 107.193 -1.41 . . . . 0.19 107.193 179.202 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 23.7 t0 65.67 33.21 8.54 Favored 'General case' 0 N--CA 1.49 1.562 0 CA-C-N 115.59 -0.732 . . . . 0.22 112.253 178.635 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 84.61 1.17 89.24 Favored Glycine 0 N--CA 1.498 2.829 0 O-C-N 120.511 -1.368 . . . . 0.16 110.747 178.87 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 24.0 m -118.7 137.36 53.38 Favored 'General case' 0 N--CA 1.503 2.192 0 O-C-N 121.457 -1.025 . . . . 0.23000000000000001 109.106 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 60.5 mt -82.26 138.65 34.55 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.068 -1.02 . . . . 0.20999999999999999 109.807 -179.24 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 33.7 mttt -149.34 130.32 14.35 Favored 'General case' 0 N--CA 1.495 1.802 0 N-CA-C 109.256 -0.646 . . . . 1.49 109.256 179.025 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 33.0 t80 -69.98 139.82 52.86 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.002 -1.061 . . . . 0.20999999999999999 108.964 179.343 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 24.7 pt-20 . . . . . 0 N--CA 1.497 1.892 0 O-C-N 121.069 -1.019 . . . . 1.0900000000000001 109.444 179.347 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 94.6 mt . . . . . 0 N--CA 1.491 1.592 0 CA-C-O 121.495 0.664 . . . . 0.33 109.946 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . 0.412 ' O ' ' HB2' ' A' ' 3' ' ' LYS . . . 65.41 -142.6 44.51 Favored Glycine 0 N--CA 1.492 2.38 0 N-CA-C 110.318 -1.113 . . . . 0.19 110.318 179.726 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.414 ' HB3' HE21 ' A' ' 6' ' ' GLN . 92.5 mttt 78.74 18.69 0.92 Allowed 'General case' 0 N--CA 1.504 2.275 0 CA-C-N 117.608 0.704 . . . . 1.91 110.236 -179.701 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 22.6 p90 -47.03 -20.61 0.16 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.361 -0.837 . . . . 0.13 110.205 179.203 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 86.6 p -70.07 -13.28 62.14 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 120.447 -1.408 . . . . 0.19 111.074 -178.398 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.414 HE21 ' HB3' ' A' ' 3' ' ' LYS . 77.3 mt-30 -71.66 -27.6 63.17 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.705 -1.247 . . . . 1.12 110.23 179.084 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 49.1 p -126.68 19.3 7.29 Favored 'General case' 0 N--CA 1.502 2.159 0 O-C-N 121.327 -0.858 . . . . 0.13 110.793 -179.323 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 64.1 m -130.11 153.68 48.25 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 120.996 -1.065 . . . . 0.11 108.401 178.627 -57.315 -115.502 116.34 104.879 2.023 104.368 -77.046 -70.0 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 42.3 p90 -147.45 172.11 14.45 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.006 -1.059 . . . . 0.27 110.111 -179.178 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 68.5 m-20 56.19 35.7 26.18 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.368 -0.833 . . . . 0.54 109.498 -178.464 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 53.6 m -67.71 144.4 55.47 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.338 -0.851 . . . . 0.19 109.736 179.614 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -144.89 154.43 42.61 Favored 'General case' 0 N--CA 1.495 1.812 0 CA-C-O 121.383 0.611 . . . . 0.14 109.485 -179.271 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 58.7 mt -134.18 134.39 55.27 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.859 0 CA-C-O 121.77 0.795 . . . . 0.14 109.724 179.486 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 59.6 tt0 -135.79 111.87 9.64 Favored 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 107.323 -1.362 . . . . 1.68 107.323 178.65 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 70.05 -118.15 7.9 Favored Glycine 0 N--CA 1.483 1.828 0 N-CA-C 107.902 -2.079 . . . . 0.15 107.902 -178.095 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 97.6 p -111.59 4.25 18.55 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.247 -1.149 . . . . 0.2 109.894 178.618 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 75.1 t -92.8 123.47 44.91 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.271 0 O-C-N 120.899 -1.125 . . . . 0.2 112.229 -177.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 37.8 tp -94.21 128.39 40.62 Favored 'General case' 0 N--CA 1.496 1.856 0 N-CA-C 107.237 -1.394 . . . . 0.19 107.237 176.835 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 99.4 m -128.25 130.65 48.24 Favored 'General case' 0 N--CA 1.499 1.98 0 N-CA-C 108.893 -0.78 . . . . 0.16 108.893 -179.777 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.5 t -157.33 157.16 33.62 Favored 'General case' 0 N--CA 1.496 1.863 0 C-N-CA 118.086 -1.446 . . . . 0.2 111.121 -179.389 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 88.2 m -98.22 122.68 41.68 Favored 'General case' 0 N--CA 1.497 1.916 0 N-CA-C 107.114 -1.439 . . . . 0.14 107.114 178.586 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 93.4 m -120.07 153.99 35.3 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.431 -0.793 . . . . 0.12 111.086 -178.911 -70.0 -77.046 116.34 104.368 2.023 104.879 -115.502 -57.315 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 85.7 tt0 -84.87 141.58 30.32 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-O 122.294 1.045 . . . . 0.27 110.589 179.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 64.6 mtt180 -81.13 154.8 26.55 Favored 'General case' 0 C--N 1.299 -1.61 0 CA-C-O 121.838 0.827 . . . . 2.41 110.229 178.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 5.4 m -60.04 -40.01 87.92 Favored 'General case' 0 C--N 1.302 -1.479 0 N-CA-C 108.217 -1.031 . . . . 1.11 108.217 179.013 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -88.27 26.48 1.41 Allowed 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.445 -0.784 . . . . 2.36 109.845 -177.134 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 73.8 155.96 3.97 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.015 -1.634 . . . . 0.21 109.015 -179.605 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 104.54 161.56 24.18 Favored Glycine 0 N--CA 1.502 3.081 0 N-CA-C 106.54 -2.624 . . . . 0.3 106.54 -175.809 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 41.1 m-85 -116.6 145.9 43.05 Favored 'General case' 0 N--CA 1.505 2.313 0 CA-C-N 119.316 1.558 . . . . 0.26 110.265 179.474 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 48.3 t30 -126.7 146.85 50.05 Favored 'General case' 0 N--CA 1.498 1.945 0 N-CA-C 108.597 -0.89 . . . . 0.39 108.597 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 93.9 m -119.89 130.12 54.69 Favored 'General case' 0 N--CA 1.501 2.093 0 N-CA-C 108.55 -0.907 . . . . 0.48 108.55 -178.735 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 89.2 p -151.3 167.49 27.72 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 120.633 -1.292 . . . . 0.25 110.658 -179.059 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 18.5 m -138.46 148.92 44.92 Favored 'General case' 0 N--CA 1.49 1.561 0 CA-C-O 121.64 0.733 . . . . 0.23 109.801 -179.437 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 20.4 tt -142.82 140.32 27.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 N-CA-C 109.02 -0.733 . . . . 0.24 109.02 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 53.7 t0 -81.45 116.51 21.29 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.018 -1.051 . . . . 0.22 109.368 -179.402 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 23.0 mt -79.92 -2.92 45.88 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 120.915 -1.116 . . . . 0.15 108.918 179.121 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -59.59 -38.48 81.34 Favored 'General case' 0 C--N 1.299 -1.623 0 O-C-N 120.842 -1.161 . . . . 0.23 109.834 -178.495 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 93.2 p -72.5 3.84 4.46 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.155 -0.966 . . . . 0.16 112.276 -178.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.489 ' O ' ' N ' ' A' ' 50' ' ' GLN . 3.4 m -135.92 -5.05 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.51 2.566 0 O-C-N 120.321 -1.487 . . . . 0.15 112.299 -178.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 82.1 mt -114.06 133.38 60.28 Favored 'Isoleucine or valine' 0 N--CA 1.516 2.859 0 O-C-N 120.75 -1.219 . . . . 0.43 111.28 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.507 ' OE1' ' NE2' ' A' ' 50' ' ' GLN . 71.9 tt0 -122.3 155.79 35.21 Favored 'General case' 0 N--CA 1.51 2.567 0 N-CA-C 109.056 -0.72 . . . . 0.41 109.056 178.853 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 42.3 t30 -102.09 117.87 35.7 Favored 'General case' 0 N--CA 1.495 1.816 0 N-CA-C 107.275 -1.38 . . . . 0.22 107.275 177.291 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 89.6 t -111.66 98.27 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.302 0 CA-C-O 122.285 1.04 . . . . 0.28 110.418 -179.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.439 ' OD1' ' O ' ' A' ' 44' ' ' ASP . 46.1 t0 48.6 39.74 14.0 Favored 'General case' 0 C--N 1.3 -1.56 0 CA-C-N 115.713 -0.676 . . . . 0.3 111.981 177.716 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 115.07 -16.84 17.72 Favored Glycine 0 N--CA 1.506 3.326 0 C-N-CA 120.187 -1.006 . . . . 0.21 113.257 178.062 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 7.9 t -121.62 143.61 49.22 Favored 'General case' 0 N--CA 1.508 2.427 0 CA-C-N 120.647 2.224 . . . . 1.39 112.306 -176.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.602 HD21 ' SG ' ' A' ' 73' ' ' CYS . 86.1 mt -79.6 130.0 34.98 Favored 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 109.314 -0.625 . . . . 0.24 109.314 177.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 14.1 mmtt -125.49 161.6 26.76 Favored 'General case' 0 N--CA 1.507 2.418 0 O-C-N 121.625 -0.672 . . . . 1.68 110.202 -179.517 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 78.1 m95 -76.42 80.92 3.15 Favored 'General case' 0 N--CA 1.501 2.099 0 O-C-N 121.436 -0.79 . . . . 0.15 111.265 -179.158 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.507 ' NE2' ' OE1' ' A' ' 41' ' ' GLU . 8.7 tt0 -165.75 139.27 3.61 Favored Pre-proline 0 N--CA 1.499 1.977 0 O-C-N 120.944 -1.097 . . . . 0.96 108.372 179.761 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_endo -64.33 144.34 85.69 Favored 'Trans proline' 0 N--CA 1.505 2.165 0 C-N-CA 121.585 1.523 . . . . 0.22 112.966 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 174.41 12.36 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.176 0 O-C-N 121.492 -0.755 . . . . 1.14 109.68 178.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 37.8 t-20 58.49 59.71 2.86 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.075 -1.016 . . . . 0.26 109.498 -179.755 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.462 ' CG ' ' N ' ' A' ' 55' ' ' ILE . 15.7 p90 -60.03 -39.98 87.74 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.395 -0.816 . . . . 0.15 111.261 -178.853 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.462 ' N ' ' CG ' ' A' ' 54' ' ' PHE . 3.5 tp -57.75 -21.42 16.33 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 O-C-N 121.087 -1.008 . . . . 0.63 110.187 -178.368 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 80.8 tt0 -63.38 -31.42 72.57 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.002 -1.061 . . . . 1.24 109.028 179.015 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 48.8 p -117.57 18.33 14.26 Favored 'General case' 0 N--CA 1.513 2.682 0 C-N-CA 119.796 -0.762 . . . . 0.22 110.505 -179.268 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 71.0 m -134.01 155.65 49.61 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.047 -1.033 . . . . 0.12 109.555 179.49 -62.414 -110.889 121.699 103.948 2.019 105.01 -79.427 -72.32 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 32.7 ptt180 -141.32 178.48 7.39 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.443 -0.785 . . . . 0.28 110.179 -177.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 48.1 t-20 47.9 49.92 16.32 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.67 -0.644 . . . . 0.29 111.238 178.356 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 41.5 p -75.33 132.21 40.81 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 107.624 -1.251 . . . . 0.13 107.624 177.434 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 -149.22 162.55 39.78 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 120.81 -1.181 . . . . 2.68 110.449 -178.6 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 17.0 tp -85.72 127.54 34.54 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.314 -0.866 . . . . 0.24 108.895 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -119.8 129.95 54.7 Favored 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 109.28 -0.637 . . . . 0.16 109.28 -179.791 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 66.26 -150.44 51.87 Favored Glycine 0 N--CA 1.491 2.307 0 C-N-CA 120.015 -1.088 . . . . 0.2 110.725 178.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -89.86 -39.3 13.15 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.619 -0.93 . . . . 1.23 110.893 -178.918 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 94.4 p -133.57 9.07 3.95 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.244 -0.91 . . . . 0.22 112.564 -177.363 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -99.16 140.05 33.89 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 120.386 -1.446 . . . . 1.68 111.33 -178.262 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.542 HD12 ' N ' ' A' ' 70' ' ' ALA . 3.5 tp -109.45 120.07 41.39 Favored 'General case' 0 N--CA 1.496 1.864 0 N-CA-C 108.008 -1.108 . . . . 0.27 108.008 178.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.542 ' N ' HD12 ' A' ' 69' ' ' LEU . . . -105.62 140.48 38.62 Favored 'General case' 0 N--CA 1.496 1.868 0 N-CA-C 108.952 -0.759 . . . . 0.13 108.952 -179.102 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -155.92 174.95 14.59 Favored 'General case' 0 C--N 1.3 -1.583 0 N-CA-C 108.822 -0.807 . . . . 0.12 108.822 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 93.5 mt-10 -118.09 132.57 56.34 Favored 'General case' 0 N--CA 1.493 1.72 0 N-CA-C 105.787 -1.931 . . . . 0.51 105.787 177.08 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . 0.602 ' SG ' HD21 ' A' ' 47' ' ' LEU . 67.4 m -132.68 148.25 52.34 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 120.82 -1.175 . . . . 0.12 111.678 -178.089 -72.32 -79.427 121.699 105.01 2.019 103.948 -110.889 -62.414 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 44.8 mtpt -73.49 133.32 43.61 Favored 'General case' 0 C--N 1.302 -1.466 0 CA-C-O 122.127 0.965 . . . . 0.52 111.709 -179.218 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 22.7 p -91.56 173.17 8.03 Favored 'General case' 0 C--N 1.3 -1.544 0 N-CA-C 106.874 -1.528 . . . . 0.14 106.874 177.35 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 23.8 mtm180 -58.65 -22.41 56.66 Favored 'General case' 0 C--N 1.294 -1.806 0 C-N-CA 118.575 -1.25 . . . . 3.22 109.16 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -83.78 10.09 10.34 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 120.557 -1.339 . . . . 0.16 110.131 -178.424 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 98.6 mm-40 65.05 35.49 8.01 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.113 -0.992 . . . . 0.81 111.684 -179.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -120.11 141.33 49.91 Favored 'General case' 0 N--CA 1.505 2.281 0 O-C-N 121.376 -0.827 . . . . 2.46 109.076 178.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -87.13 124.39 33.2 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 120.774 -1.204 . . . . 0.18 109.18 179.747 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.4 m -125.74 161.57 30.5 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.457 0 O-C-N 121.203 -0.935 . . . . 0.13 109.026 179.047 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 18.9 t -72.12 130.12 40.12 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 120.886 -1.134 . . . . 0.22 111.169 -178.378 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 7.1 t -135.2 157.48 46.82 Favored 'General case' 0 N--CA 1.497 1.902 0 N-CA-C 108.784 -0.821 . . . . 0.19 108.784 179.29 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 35.9 pttt -155.72 160.26 40.19 Favored 'General case' 0 N--CA 1.489 1.475 0 CA-C-O 122.074 0.94 . . . . 2.04 109.896 -179.588 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 19.3 tt -148.8 148.14 16.14 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 N-CA-C 109.146 -0.687 . . . . 0.22 109.146 -179.116 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 46.6 t-20 -87.74 112.8 22.78 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.496 -0.752 . . . . 0.22 109.927 -179.529 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 41.2 mt -67.59 -21.47 65.41 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.133 -0.98 . . . . 0.18 110.042 178.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 93.7 m-20 -68.25 -13.66 62.42 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.847 -1.158 . . . . 0.16 111.882 -177.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -62.87 -39.88 95.78 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 120.216 -1.553 . . . . 0.2 113.024 -177.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 98.5 m-70 -138.73 -9.91 1.38 Allowed 'General case' 0 N--CA 1.506 2.35 0 O-C-N 120.749 -1.22 . . . . 0.18 112.334 -176.115 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 42.7 mm -84.7 110.18 18.76 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 O-C-N 120.551 -1.343 . . . . 0.29 109.07 179.341 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -118.76 168.63 10.56 Favored 'General case' 0 N--CA 1.504 2.263 0 CA-C-O 121.895 0.855 . . . . 0.1 110.803 -179.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 26.2 t30 -111.38 111.03 21.78 Favored 'General case' 0 N--CA 1.494 1.762 0 N-CA-C 107.643 -1.243 . . . . 0.17 107.643 178.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 77.0 mt -113.47 107.03 21.91 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.165 0 N-CA-C 107.193 -1.41 . . . . 0.19 107.193 179.202 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 23.7 t0 65.67 33.21 8.54 Favored 'General case' 0 N--CA 1.49 1.562 0 CA-C-N 115.59 -0.732 . . . . 0.22 112.253 178.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 84.61 1.17 89.24 Favored Glycine 0 N--CA 1.498 2.829 0 O-C-N 120.511 -1.368 . . . . 0.16 110.747 178.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 24.0 m -118.7 137.36 53.38 Favored 'General case' 0 N--CA 1.503 2.192 0 O-C-N 121.457 -1.025 . . . . 0.23 109.106 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 60.5 mt -82.26 138.65 34.55 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.068 -1.02 . . . . 0.21 109.807 -179.24 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 33.7 mttt -149.34 130.32 14.35 Favored 'General case' 0 N--CA 1.495 1.802 0 N-CA-C 109.256 -0.646 . . . . 1.49 109.256 179.025 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 33.0 t80 -69.98 139.82 52.86 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.002 -1.061 . . . . 0.21 108.964 179.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 24.7 pt-20 . . . . . 0 N--CA 1.497 1.892 0 O-C-N 121.069 -1.019 . . . . 1.09 109.444 179.347 . . . . . . . . 0 0 . 1 stop_ save_