data_2l7x_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 2l7x _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 ' 29' ' ' ARG . . . . . . . . . . . . . 56.3 mtm-85 . . . . . 0 N--CA 1.49 1.536 0 CA-C-O 120.869 0.366 . . . . 20.0 111.205 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 79.0 mm-40 -135.71 163.59 29.83 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 126.271 1.828 . . . . 20.0 110.891 178.632 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 60.0 tp -65.59 126.25 27.75 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.544 1.138 . . . . 20.0 110.334 178.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 37.4 ttpt -57.77 125.91 74.55 Favored Pre-proline 0 CA--C 1.548 0.888 0 C-N-CA 124.041 0.937 . . . . 20.0 112.207 -178.416 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_endo -78.67 175.77 10.64 Favored 'Trans proline' 0 CA--C 1.544 0.991 0 C-N-CA 123.891 3.061 . . . . 20.0 112.977 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 30.6 tt0 -61.82 153.79 27.72 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.38 1.472 . . . . 20.0 112.603 177.598 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -52.21 145.76 10.22 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 127.203 2.201 . . . . 20.0 112.562 174.368 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 38.7 t -63.94 125.88 25.85 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 108.204 -1.036 . . . . 20.0 108.204 173.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 2.2 p -78.75 5.85 10.31 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 126.239 1.816 . . . . 20.0 113.739 -177.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 1.2 mt -124.49 -51.22 2.23 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 C-N-CA 124.456 1.103 . . . . 20.0 112.395 -171.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 12.2 p -106.75 -6.97 17.45 Favored 'General case' 0 N--CA 1.481 1.106 0 N-CA-C 114.303 1.223 . . . . 20.0 114.303 176.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . 0.281 3.3 tt0 60.06 6.47 0.97 Allowed 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 126.983 2.113 . . . . 20.0 116.506 -175.706 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 92.3 m -76.15 105.54 7.25 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 124.407 1.083 . . . . 20.0 109.066 173.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 4.9 m -54.42 112.9 4.41 Favored Pre-proline 0 N--CA 1.473 0.704 0 C-N-CA 124.786 1.234 . . . . 20.0 113.35 -176.313 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -71.53 147.12 51.21 Favored 'Trans proline' 0 CA--C 1.535 0.561 0 C-N-CA 123.005 2.47 . . . . 20.0 110.829 177.086 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.464 ' HB ' HD21 ' A' ' 45' ' ' ASN . 99.6 t -78.64 -43.71 25.78 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 C-N-CA 124.229 1.012 . . . . 20.0 112.043 -177.585 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . 0.464 HD21 ' HB ' ' A' ' 44' ' ' VAL . 8.9 p30 -136.97 170.31 16.32 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 127.269 2.228 . . . . 20.0 114.002 -172.589 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.42 -37.45 87.32 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 114.643 1.349 . . . . 20.0 114.643 -176.211 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 52.5 mt -64.63 -51.35 68.67 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 C-N-CA 123.809 0.844 . . . . 20.0 109.135 178.092 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 19.8 t0 -58.92 -43.53 91.14 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.712 1.605 . . . . 20.0 110.754 176.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -66.03 -40.5 91.09 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.746 1.218 . . . . 20.0 113.68 179.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -72.13 -44.89 62.45 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 121.459 -0.776 . . . . 20.0 110.66 177.219 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 63.4 ttp -51.64 -49.79 61.59 Favored 'General case' 0 CA--C 1.51 -0.583 0 C-N-CA 124.833 1.253 . . . . 20.0 107.959 177.634 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -54.96 -46.5 75.04 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 125.498 1.519 . . . . 20.0 113.042 174.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -64.73 -23.5 67.27 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 122.272 1.034 . . . . 20.0 110.944 -178.312 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -80.37 -54.34 5.8 Favored 'General case' 0 N--CA 1.426 -1.67 0 C-N-CA 126.353 1.861 . . . . 20.0 114.954 178.151 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 12.0 p30 -79.31 -24.33 42.91 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-O 117.969 -1.015 . . . . 20.0 112.635 -179.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 98.1 m -76.04 -29.47 58.07 Favored 'General case' 0 N--CA 1.44 -0.963 0 C-N-CA 118.699 -1.2 . . . . 20.0 109.335 -179.164 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.8 t -61.33 -19.26 61.61 Favored 'General case' 0 CA--C 1.548 0.891 0 CA-C-O 121.371 0.605 . . . . 20.0 112.182 175.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 16.3 m-85 -113.92 4.49 15.82 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 128.504 2.722 . . . . 20.0 111.838 178.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . 0.291 0.0 OUTLIER 45.78 58.55 4.24 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 129.649 3.18 . . . . 20.0 112.19 -175.496 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 23.8 mt -125.0 137.99 55.77 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 N-CA-C 105.804 -1.925 . . . . 20.0 105.804 179.114 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 38.0 t -60.41 134.18 91.18 Favored Pre-proline 0 CA--C 1.547 0.841 0 CA-C-N 121.13 1.786 . . . . 20.0 111.612 178.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_exo -59.89 -19.41 54.76 Favored 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 122.548 2.165 . . . . 20.0 114.013 176.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . 0.505 ' CG ' ' HA ' ' A' ' 83' ' ' ARG . 17.4 m-85 -117.11 -33.67 4.62 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 116.014 1.857 . . . . 20.0 116.014 -169.231 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 13.4 p -120.9 -2.97 9.69 Favored 'General case' 0 CA--C 1.55 0.959 0 N-CA-C 114.412 1.264 . . . . 20.0 114.412 178.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 53.03 47.13 25.31 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.271 1.828 . . . . 20.0 113.36 177.634 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 14.8 p -71.38 -7.65 48.59 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 117.506 2.41 . . . . 20.0 117.506 -174.532 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . 0.371 0.0 OUTLIER 48.71 56.94 6.9 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-O 124.235 1.969 . . . . 20.0 115.24 178.13 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 17.5 mt -57.43 177.0 0.11 Allowed 'General case' 0 CA--C 1.548 0.867 1 C-N-CA 131.817 4.047 . . . . 20.0 111.923 174.576 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 70.9 p -107.6 167.29 10.06 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 124.71 1.204 . . . . 20.0 108.768 170.578 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 89.5 p -62.8 -10.81 14.37 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 115.813 1.782 . . . . 20.0 115.813 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -118.26 -5.29 10.88 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.817 1.647 . . . . 20.0 112.074 175.132 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -90.88 -32.9 8.66 Favored Glycine 0 N--CA 1.47 0.943 0 N-CA-C 108.849 -1.7 . . . . 20.0 108.849 175.053 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 4.7 tp -42.26 -59.88 1.66 Allowed 'General case' 0 N--CA 1.446 -0.642 1 C-N-CA 131.704 4.002 . . . . 20.0 114.533 174.1 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.59 -44.24 87.23 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 119.362 -0.935 . . . . 20.0 111.478 -176.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 82.0 mtt85 -64.43 -38.83 92.41 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 118.527 -0.749 . . . . 20.0 112.014 178.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 55.0 t60 -80.14 -46.26 16.73 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-O 117.865 -1.064 . . . . 20.0 111.836 -179.455 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 4.8 t -62.53 -28.23 44.35 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.781 0 C-N-CA 118.314 -1.355 . . . . 20.0 110.366 179.015 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 98.3 m -70.88 -19.75 62.59 Favored 'General case' 0 N--CA 1.48 1.055 0 O-C-N 120.994 -1.066 . . . . 20.0 113.568 173.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 75.7 mt-30 -120.6 -15.51 8.45 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 117.22 2.304 . . . . 20.0 117.22 -171.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 41.3 t -50.49 135.48 24.91 Favored Pre-proline 0 CA--C 1.54 0.585 0 C-N-CA 125.648 1.579 . . . . 20.0 112.396 179.056 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -88.36 -20.35 1.73 Allowed 'Trans proline' 0 N--CA 1.454 -0.812 0 C-N-CA 122.022 1.814 . . . . 20.0 113.853 176.402 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 29.8 mmtm -72.62 -20.41 61.28 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.894 0.877 . . . . 20.0 110.141 177.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.505 ' HA ' ' CG ' ' A' ' 63' ' ' TYR . 5.3 ttt-85 -53.99 -55.57 26.01 Favored 'General case' 0 C--O 1.219 -0.515 0 C-N-CA 126.57 1.948 . . . . 20.0 109.566 175.02 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 40.3 ttpt -56.9 -43.43 81.33 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 127.087 2.155 . . . . 20.0 111.563 175.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -67.7 -48.8 65.51 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 119.144 0.884 . . . . 20.0 112.811 -178.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -67.58 -33.62 75.39 Favored 'General case' 0 CA--C 1.509 -0.623 0 O-C-N 121.403 -0.81 . . . . 20.0 109.951 179.284 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . 0.343 40.5 t -80.97 -27.35 10.95 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.627 0 C-N-CA 120.3 -0.56 . . . . 20.0 112.082 -176.557 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 64.3 mt-10 -70.07 -24.59 63.26 Favored 'General case' 0 CA--C 1.543 0.703 0 N-CA-C 107.741 -1.207 . . . . 20.0 107.741 168.141 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -71.21 -36.68 71.98 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 120.928 -1.107 . . . . 20.0 110.756 170.011 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 66.5 p -68.72 -20.37 64.4 Favored 'General case' 0 N--CA 1.482 1.144 0 O-C-N 121.434 -0.791 . . . . 20.0 112.651 177.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 -66.64 -19.03 65.68 Favored 'General case' 0 CA--C 1.547 0.848 0 O-C-N 121.334 -0.853 . . . . 20.0 110.02 169.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 7.2 mp -118.21 46.36 1.81 Allowed 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.906 2.082 . . . . 20.0 109.969 176.405 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 16.6 p90 -54.27 -13.01 0.75 Allowed 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 128.403 2.681 . . . . 20.0 114.267 176.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -60.58 -20.95 61.98 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 125.835 1.654 . . . . 20.0 111.662 174.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -66.12 174.25 2.66 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 123.686 1.708 . . . . 20.0 112.959 174.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -71.84 -46.43 58.06 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 127.039 2.136 . . . . 20.0 115.139 -173.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -75.34 153.48 37.8 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.291 1.437 . . . . 20.0 113.71 -177.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -136.87 -56.4 0.73 Allowed 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 126.583 1.953 . . . . 20.0 111.554 177.507 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 32.1 mt -134.54 94.39 17.28 Favored Pre-proline 0 CA--C 1.542 0.667 0 C-N-CA 126.083 1.753 . . . . 20.0 108.81 -177.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -72.84 28.03 0.29 Allowed 'Trans proline' 0 CA--C 1.541 0.847 0 C-N-CA 124.409 3.406 . . . . 20.0 115.663 -177.494 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' TRP . . . . . . . . . . . . . 21.1 m95 -119.44 -10.13 9.73 Favored 'General case' 0 CA--C 1.541 0.635 0 C-N-CA 127.324 2.25 . . . . 20.0 111.965 178.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 99.8 t -95.43 -30.44 4.06 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.98 0 C-N-CA 125.385 1.474 . . . . 20.0 112.193 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 60.5 t -79.61 118.06 26.44 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 N-CA-C 109.136 -0.691 . . . . 20.0 109.136 177.08 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 24.6 mmt180 -137.97 155.25 49.07 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 125.893 1.677 . . . . 20.0 111.298 -177.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 64.2 tttm . . . . . 0 C--O 1.253 1.266 0 C-N-CA 126.168 1.787 . . . . 20.0 111.256 178.636 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.501 ' N ' ' HH ' ' A' ' 93' ' ' TYR . 56.3 mtm-85 . . . . . 0 N--CA 1.49 1.536 0 CA-C-O 120.869 0.366 . . . . 20.0 111.205 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 79.0 mm-40 -135.71 163.59 29.83 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 126.271 1.828 . . . . 20.0 110.891 178.632 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 60.0 tp -65.59 126.25 27.75 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.544 1.138 . . . . 20.0 110.334 178.773 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 37.4 ttpt -57.77 125.91 74.55 Favored Pre-proline 0 CA--C 1.548 0.888 0 C-N-CA 124.041 0.937 . . . . 20.0 112.207 -178.416 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_endo -78.67 175.77 10.64 Favored 'Trans proline' 0 CA--C 1.544 0.991 0 C-N-CA 123.891 3.061 . . . . 20.0 112.977 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 30.6 tt0 -61.82 153.79 27.72 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.38 1.472 . . . . 20.0 112.603 177.598 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -52.21 145.76 10.22 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 127.203 2.201 . . . . 20.0 112.562 174.368 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 38.7 t -63.94 125.88 25.85 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 108.204 -1.036 . . . . 20.0 108.204 173.484 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 2.2 p -78.75 5.85 10.31 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 126.239 1.816 . . . . 20.0 113.739 -177.718 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.456 ' HB ' ' HB3' ' A' ' 56' ' ' CYS . 1.2 mt -124.49 -51.22 2.23 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 C-N-CA 124.456 1.103 . . . . 20.0 112.395 -171.881 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 12.2 p -106.75 -6.97 17.45 Favored 'General case' 0 N--CA 1.481 1.106 0 N-CA-C 114.303 1.223 . . . . 20.0 114.303 176.869 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . 0.281 3.3 tt0 60.06 6.47 0.97 Allowed 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 126.983 2.113 . . . . 20.0 116.506 -175.706 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 92.3 m -76.15 105.54 7.25 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 124.407 1.083 . . . . 20.0 109.066 173.883 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 4.9 m -54.42 112.9 4.41 Favored Pre-proline 0 N--CA 1.473 0.704 0 C-N-CA 124.786 1.234 . . . . 20.0 113.35 -176.313 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -71.53 147.12 51.21 Favored 'Trans proline' 0 CA--C 1.535 0.561 0 C-N-CA 123.005 2.47 . . . . 20.0 110.829 177.086 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.488 ' HB ' HD22 ' A' ' 45' ' ' ASN . 99.6 t -78.64 -43.71 25.78 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 C-N-CA 124.229 1.012 . . . . 20.0 112.043 -177.585 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ASN . . . . . 0.488 HD22 ' HB ' ' A' ' 44' ' ' VAL . 8.9 p30 -136.97 170.31 16.32 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 127.269 2.228 . . . . 20.0 114.002 -172.589 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.42 -37.45 87.32 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 114.643 1.349 . . . . 20.0 114.643 -176.211 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 52.5 mt -64.63 -51.35 68.67 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 C-N-CA 123.809 0.844 . . . . 20.0 109.135 178.092 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 19.8 t0 -58.92 -43.53 91.14 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.712 1.605 . . . . 20.0 110.754 176.83 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -66.03 -40.5 91.09 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.746 1.218 . . . . 20.0 113.68 179.421 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -72.13 -44.89 62.45 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 121.459 -0.776 . . . . 20.0 110.66 177.219 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 63.4 ttp -51.64 -49.79 61.59 Favored 'General case' 0 CA--C 1.51 -0.583 0 C-N-CA 124.833 1.253 . . . . 20.0 107.959 177.634 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -54.96 -46.5 75.04 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 125.498 1.519 . . . . 20.0 113.042 174.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -64.73 -23.5 67.27 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 122.272 1.034 . . . . 20.0 110.944 -178.312 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -80.37 -54.34 5.8 Favored 'General case' 0 N--CA 1.426 -1.67 0 C-N-CA 126.353 1.861 . . . . 20.0 114.954 178.151 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.543 HD22 ' HG3' ' A' ' 62' ' ' PRO . 2.3 p-10 -79.31 -24.33 42.91 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-O 117.969 -1.015 . . . . 20.0 112.635 -179.644 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.456 ' HB3' ' HB ' ' A' ' 38' ' ' ILE . 98.1 m -76.04 -29.47 58.07 Favored 'General case' 0 N--CA 1.44 -0.963 0 C-N-CA 118.699 -1.2 . . . . 20.0 109.335 -179.164 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.8 t -61.33 -19.26 61.61 Favored 'General case' 0 CA--C 1.548 0.891 0 CA-C-O 121.371 0.605 . . . . 20.0 112.182 175.536 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 16.3 m-85 -113.92 4.49 15.82 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 128.504 2.722 . . . . 20.0 111.838 178.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . 0.291 0.0 OUTLIER 45.78 58.55 4.24 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 129.649 3.18 . . . . 20.0 112.19 -175.496 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.427 HG23 ' HA ' ' A' ' 65' ' ' ALA . 23.8 mt -125.0 137.99 55.77 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 N-CA-C 105.804 -1.925 . . . . 20.0 105.804 179.114 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 38.0 t -60.41 134.18 91.18 Favored Pre-proline 0 CA--C 1.547 0.841 0 CA-C-N 121.13 1.786 . . . . 20.0 111.612 178.836 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.543 ' HG3' HD22 ' A' ' 55' ' ' ASN . 10.8 Cg_exo -59.89 -19.41 54.76 Favored 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 122.548 2.165 . . . . 20.0 114.013 176.586 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' TYR . . . . . 0.533 ' CD2' ' HB2' ' A' ' 83' ' ' ARG . 17.4 m-85 -117.11 -33.67 4.62 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 116.014 1.857 . . . . 20.0 116.014 -169.231 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 13.4 p -120.9 -2.97 9.69 Favored 'General case' 0 CA--C 1.55 0.959 0 N-CA-C 114.412 1.264 . . . . 20.0 114.412 178.733 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.427 ' HA ' HG23 ' A' ' 60' ' ' ILE . . . 53.03 47.13 25.31 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.271 1.828 . . . . 20.0 113.36 177.634 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 14.8 p -71.38 -7.65 48.59 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 117.506 2.41 . . . . 20.0 117.506 -174.532 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . 0.371 0.0 OUTLIER 48.71 56.94 6.9 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-O 124.235 1.969 . . . . 20.0 115.24 178.13 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.47 ' H ' ' HG ' ' A' ' 68' ' ' LEU . 17.5 mt -57.43 177.0 0.11 Allowed 'General case' 0 CA--C 1.548 0.867 1 C-N-CA 131.817 4.047 . . . . 20.0 111.923 174.576 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 70.9 p -107.6 167.29 10.06 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 124.71 1.204 . . . . 20.0 108.768 170.578 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 89.5 p -62.8 -10.81 14.37 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 115.813 1.782 . . . . 20.0 115.813 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -118.26 -5.29 10.88 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.817 1.647 . . . . 20.0 112.074 175.132 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -90.88 -32.9 8.66 Favored Glycine 0 N--CA 1.47 0.943 0 N-CA-C 108.849 -1.7 . . . . 20.0 108.849 175.053 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 4.7 tp -42.26 -59.88 1.66 Allowed 'General case' 0 N--CA 1.446 -0.642 1 C-N-CA 131.704 4.002 . . . . 20.0 114.533 174.1 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.59 -44.24 87.23 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 119.362 -0.935 . . . . 20.0 111.478 -176.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 82.0 mtt85 -64.43 -38.83 92.41 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 118.527 -0.749 . . . . 20.0 112.014 178.751 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 55.0 t60 -80.14 -46.26 16.73 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-O 117.865 -1.064 . . . . 20.0 111.836 -179.455 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 4.8 t -62.53 -28.23 44.35 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.781 0 C-N-CA 118.314 -1.355 . . . . 20.0 110.366 179.015 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 98.3 m -70.88 -19.75 62.59 Favored 'General case' 0 N--CA 1.48 1.055 0 O-C-N 120.994 -1.066 . . . . 20.0 113.568 173.673 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 75.7 mt-30 -120.6 -15.51 8.45 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 117.22 2.304 . . . . 20.0 117.22 -171.709 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 41.3 t -50.49 135.48 24.91 Favored Pre-proline 0 CA--C 1.54 0.585 0 C-N-CA 125.648 1.579 . . . . 20.0 112.396 179.056 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -88.36 -20.35 1.73 Allowed 'Trans proline' 0 N--CA 1.454 -0.812 0 C-N-CA 122.022 1.814 . . . . 20.0 113.853 176.402 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 29.8 mmtm -72.62 -20.41 61.28 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.894 0.877 . . . . 20.0 110.141 177.637 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.533 ' HB2' ' CD2' ' A' ' 63' ' ' TYR . 5.3 ttt-85 -53.99 -55.57 26.01 Favored 'General case' 0 C--O 1.219 -0.515 0 C-N-CA 126.57 1.948 . . . . 20.0 109.566 175.02 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 40.3 ttpt -56.9 -43.43 81.33 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 127.087 2.155 . . . . 20.0 111.563 175.75 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -67.7 -48.8 65.51 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 119.144 0.884 . . . . 20.0 112.811 -178.579 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -67.58 -33.62 75.39 Favored 'General case' 0 CA--C 1.509 -0.623 0 O-C-N 121.403 -0.81 . . . . 20.0 109.951 179.284 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . 0.343 40.5 t -80.97 -27.35 10.95 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.627 0 C-N-CA 120.3 -0.56 . . . . 20.0 112.082 -176.557 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 64.3 mt-10 -70.07 -24.59 63.26 Favored 'General case' 0 CA--C 1.543 0.703 0 N-CA-C 107.741 -1.207 . . . . 20.0 107.741 168.141 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -71.21 -36.68 71.98 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 120.928 -1.107 . . . . 20.0 110.756 170.011 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 66.5 p -68.72 -20.37 64.4 Favored 'General case' 0 N--CA 1.482 1.144 0 O-C-N 121.434 -0.791 . . . . 20.0 112.651 177.896 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 -66.64 -19.03 65.68 Favored 'General case' 0 CA--C 1.547 0.848 0 O-C-N 121.334 -0.853 . . . . 20.0 110.02 169.702 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 7.2 mp -118.21 46.36 1.81 Allowed 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.906 2.082 . . . . 20.0 109.969 176.405 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' TYR . . . . . 0.501 ' HH ' ' N ' ' A' ' 29' ' ' ARG . 16.6 p90 -54.27 -13.01 0.75 Allowed 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 128.403 2.681 . . . . 20.0 114.267 176.979 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.414 ' H ' HD22 ' A' ' 94' ' ' LEU . 2.8 mm? -60.58 -20.95 61.98 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 125.835 1.654 . . . . 20.0 111.662 174.662 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -66.12 174.25 2.66 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 123.686 1.708 . . . . 20.0 112.959 174.869 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -71.84 -46.43 58.06 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 127.039 2.136 . . . . 20.0 115.139 -173.759 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -75.34 153.48 37.8 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.291 1.437 . . . . 20.0 113.71 -177.715 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -136.87 -56.4 0.73 Allowed 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 126.583 1.953 . . . . 20.0 111.554 177.507 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 32.1 mt -134.54 94.39 17.28 Favored Pre-proline 0 CA--C 1.542 0.667 0 C-N-CA 126.083 1.753 . . . . 20.0 108.81 -177.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -72.84 28.03 0.29 Allowed 'Trans proline' 0 CA--C 1.541 0.847 0 C-N-CA 124.409 3.406 . . . . 20.0 115.663 -177.494 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' TRP . . . . . . . . . . . . . 21.1 m95 -119.44 -10.13 9.73 Favored 'General case' 0 CA--C 1.541 0.635 0 C-N-CA 127.324 2.25 . . . . 20.0 111.965 178.637 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 99.8 t -95.43 -30.44 4.06 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.98 0 C-N-CA 125.385 1.474 . . . . 20.0 112.193 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 60.5 t -79.61 118.06 26.44 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 N-CA-C 109.136 -0.691 . . . . 20.0 109.136 177.08 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 24.6 mmt180 -137.97 155.25 49.07 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 125.893 1.677 . . . . 20.0 111.298 -177.865 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 64.2 tttm . . . . . 0 C--O 1.253 1.266 0 C-N-CA 126.168 1.787 . . . . 20.0 111.256 178.636 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 107' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.501 ' N ' ' HH ' ' A' ' 93' ' ' TYR . 56.3 mtm-85 . . . . . 0 N--CA 1.49 1.536 0 CA-C-O 120.869 0.366 . . . . 20.0 111.205 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 79.0 mm-40 -135.71 163.59 29.83 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 126.271 1.828 . . . . 20.0 110.891 178.632 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 60.0 tp -65.59 126.25 27.75 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.544 1.138 . . . . 20.0 110.334 178.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 37.4 ttpt -57.77 125.91 74.55 Favored Pre-proline 0 CA--C 1.548 0.888 0 C-N-CA 124.041 0.937 . . . . 20.0 112.207 -178.416 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_endo -78.67 175.77 10.64 Favored 'Trans proline' 0 CA--C 1.544 0.991 0 C-N-CA 123.891 3.061 . . . . 20.0 112.977 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 30.6 tt0 -61.82 153.79 27.72 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 125.38 1.472 . . . . 20.0 112.603 177.598 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -52.21 145.76 10.22 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 127.203 2.201 . . . . 20.0 112.562 174.368 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 38.7 t -63.94 125.88 25.85 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 108.204 -1.036 . . . . 20.0 108.204 173.484 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 2.2 p -78.75 5.85 10.31 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 126.239 1.816 . . . . 20.0 113.739 -177.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.456 ' HB ' ' HB3' ' A' ' 56' ' ' CYS . 1.2 mt -124.49 -51.22 2.23 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 C-N-CA 124.456 1.103 . . . . 20.0 112.395 -171.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 12.2 p -106.75 -6.97 17.45 Favored 'General case' 0 N--CA 1.481 1.106 0 N-CA-C 114.303 1.223 . . . . 20.0 114.303 176.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . 0.281 3.3 tt0 60.06 6.47 0.97 Allowed 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 126.983 2.113 . . . . 20.0 116.506 -175.706 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 92.3 m -76.15 105.54 7.25 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 124.407 1.083 . . . . 20.0 109.066 173.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 4.9 m -54.42 112.9 4.41 Favored Pre-proline 0 N--CA 1.473 0.704 0 C-N-CA 124.786 1.234 . . . . 20.0 113.35 -176.313 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -71.53 147.12 51.21 Favored 'Trans proline' 0 CA--C 1.535 0.561 0 C-N-CA 123.005 2.47 . . . . 20.0 110.829 177.086 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.488 ' HB ' HD22 ' A' ' 45' ' ' ASN . 99.6 t -78.64 -43.71 25.78 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 C-N-CA 124.229 1.012 . . . . 20.0 112.043 -177.585 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . 0.488 HD22 ' HB ' ' A' ' 44' ' ' VAL . 8.9 p30 -136.97 170.31 16.32 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 127.269 2.228 . . . . 20.0 114.002 -172.589 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.42 -37.45 87.32 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 114.643 1.349 . . . . 20.0 114.643 -176.211 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 52.5 mt -64.63 -51.35 68.67 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 C-N-CA 123.809 0.844 . . . . 20.0 109.135 178.092 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 19.8 t0 -58.92 -43.53 91.14 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.712 1.605 . . . . 20.0 110.754 176.83 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -66.03 -40.5 91.09 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.746 1.218 . . . . 20.0 113.68 179.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -72.13 -44.89 62.45 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 121.459 -0.776 . . . . 20.0 110.66 177.219 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 63.4 ttp -51.64 -49.79 61.59 Favored 'General case' 0 CA--C 1.51 -0.583 0 C-N-CA 124.833 1.253 . . . . 20.0 107.959 177.634 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.428 ' HA ' HD21 ' A' ' 55' ' ' ASN . 0.3 OUTLIER -54.96 -46.5 75.04 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 125.498 1.519 . . . . 20.0 113.042 174.98 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -64.73 -23.5 67.27 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 122.272 1.034 . . . . 20.0 110.944 -178.312 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -80.37 -54.34 5.8 Favored 'General case' 0 N--CA 1.426 -1.67 0 C-N-CA 126.353 1.861 . . . . 20.0 114.954 178.151 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.428 HD21 ' HA ' ' A' ' 52' ' ' HIS . 12.0 p30 -79.31 -24.33 42.91 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-O 117.969 -1.015 . . . . 20.0 112.635 -179.644 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.456 ' HB3' ' HB ' ' A' ' 38' ' ' ILE . 98.1 m -76.04 -29.47 58.07 Favored 'General case' 0 N--CA 1.44 -0.963 0 C-N-CA 118.699 -1.2 . . . . 20.0 109.335 -179.164 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.8 t -61.33 -19.26 61.61 Favored 'General case' 0 CA--C 1.548 0.891 0 CA-C-O 121.371 0.605 . . . . 20.0 112.182 175.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 16.3 m-85 -113.92 4.49 15.82 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 128.504 2.722 . . . . 20.0 111.838 178.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . 0.291 0.0 OUTLIER 45.78 58.55 4.24 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 129.649 3.18 . . . . 20.0 112.19 -175.496 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.427 HG23 ' HA ' ' A' ' 65' ' ' ALA . 23.8 mt -125.0 137.99 55.77 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 N-CA-C 105.804 -1.925 . . . . 20.0 105.804 179.114 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 38.0 t -60.41 134.18 91.18 Favored Pre-proline 0 CA--C 1.547 0.841 0 CA-C-N 121.13 1.786 . . . . 20.0 111.612 178.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_exo -59.89 -19.41 54.76 Favored 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 122.548 2.165 . . . . 20.0 114.013 176.586 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . 0.533 ' CD2' ' HB2' ' A' ' 83' ' ' ARG . 17.4 m-85 -117.11 -33.67 4.62 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 116.014 1.857 . . . . 20.0 116.014 -169.231 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 13.4 p -120.9 -2.97 9.69 Favored 'General case' 0 CA--C 1.55 0.959 0 N-CA-C 114.412 1.264 . . . . 20.0 114.412 178.733 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.427 ' HA ' HG23 ' A' ' 60' ' ' ILE . . . 53.03 47.13 25.31 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.271 1.828 . . . . 20.0 113.36 177.634 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 14.8 p -71.38 -7.65 48.59 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 117.506 2.41 . . . . 20.0 117.506 -174.532 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . 0.371 0.0 OUTLIER 48.71 56.94 6.9 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-O 124.235 1.969 . . . . 20.0 115.24 178.13 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.47 ' H ' ' HG ' ' A' ' 68' ' ' LEU . 17.5 mt -57.43 177.0 0.11 Allowed 'General case' 0 CA--C 1.548 0.867 1 C-N-CA 131.817 4.047 . . . . 20.0 111.923 174.576 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 70.9 p -107.6 167.29 10.06 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 124.71 1.204 . . . . 20.0 108.768 170.578 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 89.5 p -62.8 -10.81 14.37 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 115.813 1.782 . . . . 20.0 115.813 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -118.26 -5.29 10.88 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.817 1.647 . . . . 20.0 112.074 175.132 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -90.88 -32.9 8.66 Favored Glycine 0 N--CA 1.47 0.943 0 N-CA-C 108.849 -1.7 . . . . 20.0 108.849 175.053 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 4.7 tp -42.26 -59.88 1.66 Allowed 'General case' 0 N--CA 1.446 -0.642 1 C-N-CA 131.704 4.002 . . . . 20.0 114.533 174.1 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.59 -44.24 87.23 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 119.362 -0.935 . . . . 20.0 111.478 -176.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 82.0 mtt85 -64.43 -38.83 92.41 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 118.527 -0.749 . . . . 20.0 112.014 178.751 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 55.0 t60 -80.14 -46.26 16.73 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-O 117.865 -1.064 . . . . 20.0 111.836 -179.455 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 4.8 t -62.53 -28.23 44.35 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.781 0 C-N-CA 118.314 -1.355 . . . . 20.0 110.366 179.015 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 98.3 m -70.88 -19.75 62.59 Favored 'General case' 0 N--CA 1.48 1.055 0 O-C-N 120.994 -1.066 . . . . 20.0 113.568 173.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 75.7 mt-30 -120.6 -15.51 8.45 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 117.22 2.304 . . . . 20.0 117.22 -171.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 41.3 t -50.49 135.48 24.91 Favored Pre-proline 0 CA--C 1.54 0.585 0 C-N-CA 125.648 1.579 . . . . 20.0 112.396 179.056 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -88.36 -20.35 1.73 Allowed 'Trans proline' 0 N--CA 1.454 -0.812 0 C-N-CA 122.022 1.814 . . . . 20.0 113.853 176.402 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 29.8 mmtm -72.62 -20.41 61.28 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.894 0.877 . . . . 20.0 110.141 177.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.533 ' HB2' ' CD2' ' A' ' 63' ' ' TYR . 5.3 ttt-85 -53.99 -55.57 26.01 Favored 'General case' 0 C--O 1.219 -0.515 0 C-N-CA 126.57 1.948 . . . . 20.0 109.566 175.02 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 40.3 ttpt -56.9 -43.43 81.33 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 127.087 2.155 . . . . 20.0 111.563 175.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -67.7 -48.8 65.51 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 119.144 0.884 . . . . 20.0 112.811 -178.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -67.58 -33.62 75.39 Favored 'General case' 0 CA--C 1.509 -0.623 0 O-C-N 121.403 -0.81 . . . . 20.0 109.951 179.284 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . 0.343 40.5 t -80.97 -27.35 10.95 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.627 0 C-N-CA 120.3 -0.56 . . . . 20.0 112.082 -176.557 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 64.3 mt-10 -70.07 -24.59 63.26 Favored 'General case' 0 CA--C 1.543 0.703 0 N-CA-C 107.741 -1.207 . . . . 20.0 107.741 168.141 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -71.21 -36.68 71.98 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 120.928 -1.107 . . . . 20.0 110.756 170.011 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 66.5 p -68.72 -20.37 64.4 Favored 'General case' 0 N--CA 1.482 1.144 0 O-C-N 121.434 -0.791 . . . . 20.0 112.651 177.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 -66.64 -19.03 65.68 Favored 'General case' 0 CA--C 1.547 0.848 0 O-C-N 121.334 -0.853 . . . . 20.0 110.02 169.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 7.2 mp -118.21 46.36 1.81 Allowed 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.906 2.082 . . . . 20.0 109.969 176.405 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . 0.501 ' HH ' ' N ' ' A' ' 29' ' ' ARG . 16.6 p90 -54.27 -13.01 0.75 Allowed 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 128.403 2.681 . . . . 20.0 114.267 176.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.414 ' H ' HD22 ' A' ' 94' ' ' LEU . 2.8 mm? -60.58 -20.95 61.98 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 125.835 1.654 . . . . 20.0 111.662 174.662 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -66.12 174.25 2.66 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 123.686 1.708 . . . . 20.0 112.959 174.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -71.84 -46.43 58.06 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 127.039 2.136 . . . . 20.0 115.139 -173.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -75.34 153.48 37.8 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.291 1.437 . . . . 20.0 113.71 -177.715 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -136.87 -56.4 0.73 Allowed 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 126.583 1.953 . . . . 20.0 111.554 177.507 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 32.1 mt -134.54 94.39 17.28 Favored Pre-proline 0 CA--C 1.542 0.667 0 C-N-CA 126.083 1.753 . . . . 20.0 108.81 -177.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -72.84 28.03 0.29 Allowed 'Trans proline' 0 CA--C 1.541 0.847 0 C-N-CA 124.409 3.406 . . . . 20.0 115.663 -177.494 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' TRP . . . . . . . . . . . . . 21.1 m95 -119.44 -10.13 9.73 Favored 'General case' 0 CA--C 1.541 0.635 0 C-N-CA 127.324 2.25 . . . . 20.0 111.965 178.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 99.8 t -95.43 -30.44 4.06 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.98 0 C-N-CA 125.385 1.474 . . . . 20.0 112.193 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 60.5 t -79.61 118.06 26.44 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 N-CA-C 109.136 -0.691 . . . . 20.0 109.136 177.08 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 24.6 mmt180 -137.97 155.25 49.07 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 125.893 1.677 . . . . 20.0 111.298 -177.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 64.2 tttm . . . . . 0 C--O 1.253 1.266 0 C-N-CA 126.168 1.787 . . . . 20.0 111.256 178.636 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_