data_1jxx_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 1jxx _Structure_validation_residue.Date_analyzed 2016-10-12 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 ecloud orig full ' A' A ' 1' ' ' THR . . . . . 0.828 ' C ' ' CA ' ' A' ' 2' ' ' THR . 97.8 m . . . . . 0 N--CA 1.491 1.58 0 N-CA-C 106.286 -1.746 . . . . 31.54 106.286 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' THR . . . . . 0.828 ' CA ' ' C ' ' A' ' 1' ' ' THR . 72.7 p -93.27 133.47 36.46 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 124.894 1.371 . . . . 15.02 109.389 176.368 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' CYS . . . . . 0.816 ' N ' ' CA ' ' A' ' 2' ' ' THR . 21.3 m -133.53 136.32 44.93 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 113.596 -1.638 . . . . 5.15 106.926 -179.092 -48.199 -75.212 -80.884 101.834 2.036 103.458 -69.061 -66.408 2 2 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 94.4 m -123.86 148.19 55.99 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 122.298 1.047 . . . . 5.36 110.369 -175.724 -68.764 -79.089 104.98 104.199 2.05 105.021 -114.65 -58.075 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_endo -76.36 -21.27 13.55 Favored 'Trans proline' 0 C--O 1.243 0.758 0 N-CA-C 115.026 1.125 . . . . 8.12 115.026 -173.071 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 82.1 p -155.84 167.99 28.63 Favored 'General case' 0 C--O 1.24 0.565 0 N-CA-C 108.065 -1.087 . . . . 4.2 108.065 -177.884 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 60.2 mt -57.45 -49.86 78.89 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 CA-C-N 113.761 -1.563 . . . . 15.82 112.52 178.534 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . 0.8 4.0 t -54.67 -44.61 70.73 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.399 0 CA-C-O 123.836 1.779 . . . . 12.76 110.157 175.795 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.8 -45.1 95.74 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 112.745 -2.025 . . . . 7.61 110.747 -177.063 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 23.2 tpp180 -59.93 -45.59 92.12 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 113.089 0.774 . . . . 14.34 113.089 175.251 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 48.8 m -60.19 -43.64 95.75 Favored 'General case' 0 C--O 1.25 1.117 0 C-N-CA 119.422 -0.911 . . . . 5.22 110.295 -179.793 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ASN . . . . . 0.78 ' CB ' ' C ' ' A' ' 12' ' ' ASN 0.466 75.0 m-20 -72.82 -28.58 62.64 Favored 'General case' 0 C--O 1.248 0.995 0 CA-C-N 115.488 -0.778 . . . . 6.46 112.08 176.557 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -60.68 -45.0 95.81 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 113.994 -1.457 . . . . 15.59 110.306 179.441 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 96.4 m-20 -66.51 -34.69 78.49 Favored 'General case' 0 C--O 1.241 0.646 0 C-N-CA 119.257 -0.977 . . . . 12.3 111.881 -176.909 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 45.4 t -67.86 -43.91 85.72 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.063 0 C-N-CA 119.695 -0.802 . . . . 7.14 110.875 174.544 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 40.4 t -53.76 -36.62 62.55 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 115.344 -0.844 . . . . 6.97 112.537 177.032 177.481 -91.393 -87.264 104.182 2.04 104.058 -57.408 -65.634 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 23.3 mmm180 -75.73 -18.46 59.56 Favored 'General case' 0 C--O 1.233 0.191 0 N-CA-C 114.891 1.441 . . . . 10.73 114.891 -177.741 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 77.1 mt -54.1 -43.69 97.38 Favored Pre-proline 0 C--O 1.252 1.222 0 CA-C-O 117.462 -1.256 . . . . 8.15 113.691 -175.712 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_endo -77.01 -7.6 17.38 Favored 'Trans proline' 0 C--N 1.318 -1.056 0 CA-C-N 122.013 1.755 . . . . 9.71 114.233 177.915 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 104.26 11.14 32.37 Favored Glycine 0 CA--C 1.54 1.609 0 O-C-N 124.274 0.984 . . . . 4.3 114.08 178.322 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 8.8 m -51.86 135.85 29.28 Favored 'General case' 0 N--CA 1.448 -0.545 0 O-C-N 124.207 0.593 . . . . 4.84 111.087 178.859 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . 0.298 28.8 t . . . . . 0 C--O 1.251 1.14 0 CA-C-O 121.496 0.665 . . . . 5.8 112.346 175.993 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_exo . . . . . 0 C--O 1.251 1.133 0 CA-C-O 121.496 0.54 . . . . 15.4 112.346 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 77.4 mt-10 -53.15 -38.14 62.47 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 115.328 -0.851 . . . . 9.34 112.843 175.806 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.63 -38.88 92.53 Favored 'General case' 0 N--CA 1.465 0.313 0 C-N-CA 118.915 -1.114 . . . . 7.76 111.047 -174.052 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ILE . . . . . 1.576 ' CD1' ' CG1' ' A' ' 25' ' ' ILE . 7.0 mm . . . . . 0 CA--C 1.54 0.582 0 C-N-CA 120.1 -0.64 . . . . 7.5 112.083 176.55 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 37.5 mt . . . . . 0 CA--C 1.54 0.582 0 N-CA-C 112.083 0.401 . . . . 8.51 112.083 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' CYS . . . . . 0.445 ' O ' HG22 ' A' ' 30' ' ' THR . 98.9 m -63.88 -29.75 70.91 Favored 'General case' 0 C--O 1.241 0.657 0 C-N-CA 116.632 -2.027 . . . . 3.58 112.503 176.152 -65.634 -57.408 -87.264 104.058 2.04 104.182 -91.393 177.481 2 2 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -64.56 -52.45 57.61 Favored 'General case' 0 C--O 1.238 0.495 0 O-C-N 124.039 0.837 . . . . 6.72 112.535 176.33 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 34.1 p -67.58 -26.73 66.42 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 117.304 -1.758 . . . . 13.76 112.443 179.361 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 25.4 t80 -67.86 -34.95 77.68 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.524 0.564 . . . . 8.76 112.524 178.534 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' THR . . . . . 0.445 HG22 ' O ' ' A' ' 26' ' ' CYS 0.775 72.1 p -99.73 -30.17 12.23 Favored 'General case' 0 N--CA 1.442 -0.83 0 N-CA-C 118.215 2.672 . . . . 21.3 118.215 -172.578 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 91.85 -3.54 77.75 Favored Glycine 0 N--CA 1.464 0.51 0 N-CA-C 115.322 0.889 . . . . 11.9 115.322 -169.382 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 67.9 m -67.87 166.25 15.95 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 108.404 -0.961 . . . . 4.06 108.404 170.014 -58.075 -114.65 104.98 105.021 2.05 104.199 -79.089 -68.764 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 44.5 pt -132.71 157.89 43.14 Favored 'Isoleucine or valine' 0 C--O 1.239 0.522 0 CA-C-N 114.607 -1.179 . . . . 8.96 108.237 -176.712 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 67.5 mt -113.6 128.07 70.64 Favored 'Isoleucine or valine' 0 C--O 1.247 0.943 0 CA-C-N 114.161 -1.381 . . . . 18.17 107.352 173.5 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 44.2 pt -124.67 156.3 68.32 Favored Pre-proline 0 CA--C 1.51 -0.564 0 O-C-N 124.92 1.387 . . . . 12.87 108.314 176.964 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -77.4 -26.78 7.01 Favored 'Trans proline' 0 C--O 1.247 0.93 0 C-N-CA 121.135 1.223 . . . . 23.15 112.767 -179.936 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -81.26 -170.23 43.25 Favored Glycine 0 CA--C 1.534 1.278 0 O-C-N 124.49 1.118 . . . . 8.6 111.356 178.697 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -117.03 -0.34 12.18 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 114.288 1.218 . . . . 16.43 114.288 -179.364 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' THR . . . . . 1.399 ' CA ' ' C ' ' A' ' 39' ' ' THR 0.982 22.6 m -137.36 129.03 28.6 Favored 'General case' 0 N--CA 1.48 1.04 0 O-C-N 125.496 1.747 . . . . 11.43 109.666 -172.434 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' CYS . . . . . 0.804 ' N ' ' CA ' ' A' ' 39' ' ' THR . 92.7 m -73.02 141.92 82.13 Favored Pre-proline 0 C--O 1.247 0.933 0 O-C-N 125.628 1.83 . . . . 7.52 110.345 177.949 -66.408 -69.061 -80.884 103.458 2.036 101.834 -75.212 -48.199 2 2 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 68.3 Cg_endo -75.88 165.42 30.03 Favored 'Trans proline' 0 C--N 1.317 -1.081 0 C-N-CA 121.912 1.741 . . . . 20.78 112.282 179.703 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -59.97 -25.54 61.97 Favored Glycine 0 CA--C 1.526 0.723 0 N-CA-C 117.229 1.651 . . . . 11.21 117.229 -176.017 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ASP . . . . . 1.531 ' CA ' ' CB ' ' A' ' 43' ' ' ASP 0.406 27.3 p-10 -91.85 1.07 57.42 Favored 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 118.124 -1.43 . . . . 8.28 113.307 178.378 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 82.6 m-85 -133.46 59.41 1.74 Allowed 'General case' 0 N--CA 1.474 0.743 0 O-C-N 125.578 1.799 . . . . 7.54 107.457 170.208 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -87.38 -7.2 58.01 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 115.916 1.821 . . . . 7.42 115.916 -167.33 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 35.4 m120 . . . . . 0 C--O 1.257 1.46 0 O-C-N 125.904 2.003 . . . . 11.93 111.66 -174.188 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' EOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' THR . . . . . 0.828 ' C ' ' CA ' ' A' ' 2' ' ' THR . 97.8 m . . . . . 0 N--CA 1.491 1.58 0 N-CA-C 106.286 -1.746 . . . . 10.130000000000001 106.286 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 2' ' ' THR . . . . . 0.828 ' CA ' ' C ' ' A' ' 1' ' ' THR . 72.7 p -93.27 133.47 36.46 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 124.894 1.371 . . . . 9.5600000000000005 109.389 176.368 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 3' ' ' CYS . . . . . 0.816 ' N ' ' CA ' ' A' ' 2' ' ' THR . 21.3 m -133.53 136.32 44.93 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 113.596 -1.638 . . . . 5.1500000000000004 106.926 -179.092 -48.199 -75.212 -80.884 101.834 2.036 103.458 -69.061 -66.408 2 2 . 1 . 001 ecloud build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 94.4 m -123.86 148.19 55.99 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 122.298 1.047 . . . . 3.5499999999999998 110.369 -175.724 -68.764 -79.089 104.98 104.199 2.05 105.021 -114.65 -58.075 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_endo -76.36 -21.27 13.55 Favored 'Trans proline' 0 C--O 1.243 0.758 0 N-CA-C 115.026 1.125 . . . . 4.7000000000000002 115.026 -173.071 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 82.1 p -155.84 167.99 28.63 Favored 'General case' 0 C--O 1.24 0.565 0 N-CA-C 108.065 -1.087 . . . . 3.7200000000000002 108.065 -177.884 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 60.2 mt -57.45 -49.86 78.89 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 CA-C-N 113.761 -1.563 . . . . 11.33 112.52 178.534 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . 0.8 4.0 t -54.67 -44.61 70.73 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.399 0 CA-C-O 123.836 1.779 . . . . 10.890000000000001 110.157 175.795 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.8 -45.1 95.74 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 112.745 -2.025 . . . . 3.7999999999999998 110.747 -177.063 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 23.2 tpp180 -59.93 -45.59 92.12 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 113.089 0.774 . . . . 5.8099999999999996 113.089 175.251 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 48.8 m -60.19 -43.64 95.75 Favored 'General case' 0 C--O 1.25 1.117 0 C-N-CA 119.422 -0.911 . . . . 5.1200000000000001 110.295 -179.793 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ASN . . . . . 0.78 ' CB ' ' C ' ' A' ' 12' ' ' ASN 0.466 75.0 m-20 -72.82 -28.58 62.64 Favored 'General case' 0 C--O 1.248 0.995 0 CA-C-N 115.488 -0.778 . . . . 4.5700000000000003 112.08 176.557 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -60.68 -45.0 95.81 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 113.994 -1.457 . . . . 4.4800000000000004 110.306 179.441 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 96.4 m-20 -66.51 -34.69 78.49 Favored 'General case' 0 C--O 1.241 0.646 0 C-N-CA 119.257 -0.977 . . . . 4.7400000000000002 111.881 -176.909 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 45.4 t -67.86 -43.91 85.72 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.063 0 C-N-CA 119.695 -0.802 . . . . 4.2599999999999998 110.875 174.544 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 40.4 t -53.76 -36.62 62.55 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 115.344 -0.844 . . . . 3.8999999999999999 112.537 177.032 177.481 -91.393 -87.264 104.182 2.04 104.058 -57.408 -65.634 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 23.3 mmm180 -75.73 -18.46 59.56 Favored 'General case' 0 C--O 1.233 0.191 0 N-CA-C 114.891 1.441 . . . . 4.2699999999999996 114.891 -177.741 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 77.1 mt -54.1 -43.69 97.38 Favored Pre-proline 0 C--O 1.252 1.222 0 CA-C-O 117.462 -1.256 . . . . 5.5899999999999999 113.691 -175.712 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_endo -77.01 -7.6 17.38 Favored 'Trans proline' 0 C--N 1.318 -1.056 0 CA-C-N 122.013 1.755 . . . . 5.1399999999999997 114.233 177.915 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 104.26 11.14 32.37 Favored Glycine 0 CA--C 1.54 1.609 0 O-C-N 124.274 0.984 . . . . 4.2999999999999998 114.08 178.322 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 8.8 m -51.86 135.85 29.28 Favored 'General case' 0 N--CA 1.448 -0.545 0 O-C-N 124.207 0.593 . . . . 4.0899999999999999 111.087 178.859 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . 0.298 28.8 t . . . . . 0 C--O 1.251 1.14 0 CA-C-O 121.496 0.665 . . . . 5.7199999999999998 112.346 175.993 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_exo . . . . . 0 C--O 1.251 1.133 0 CA-C-O 121.496 0.54 . . . . 4.3399999999999999 112.346 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 77.4 mt-10 -53.15 -38.14 62.47 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 115.328 -0.851 . . . . 9.3399999999999999 112.843 175.806 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.63 -38.88 92.53 Favored 'General case' 0 N--CA 1.465 0.313 0 C-N-CA 118.915 -1.114 . . . . 3.6099999999999999 111.047 -174.052 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ILE . . . . . 1.576 ' CG1' ' CD1' ' A' ' 25' ' ' ILE . 7.0 mm . . . . . 0 CA--C 1.54 0.582 0 C-N-CA 120.1 -0.64 . . . . 6.9900000000000002 112.083 176.55 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 37.5 mt . . . . . 0 CA--C 1.54 0.582 0 N-CA-C 112.083 0.401 . . . . 6.9900000000000002 112.083 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 26' ' ' CYS . . . . . 0.494 ' O ' HG23 ' A' ' 30' ' ' THR . 98.9 m -63.88 -29.75 70.91 Favored 'General case' 0 C--O 1.241 0.657 0 C-N-CA 116.632 -2.027 . . . . 3.5800000000000001 112.503 176.152 -65.634 -57.408 -87.264 104.058 2.04 104.182 -91.393 177.481 2 2 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -64.56 -52.45 57.61 Favored 'General case' 0 C--O 1.238 0.495 0 O-C-N 124.039 0.837 . . . . 3.6400000000000001 112.535 176.33 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 34.1 p -67.58 -26.73 66.42 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 117.304 -1.758 . . . . 4.4900000000000002 112.443 179.361 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 25.4 t80 -67.86 -34.95 77.68 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.524 0.564 . . . . 7.9299999999999997 112.524 178.534 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' THR . . . . . 0.494 HG23 ' O ' ' A' ' 26' ' ' CYS 0.775 72.1 p -99.73 -30.17 12.23 Favored 'General case' 0 N--CA 1.442 -0.83 0 N-CA-C 118.215 2.672 . . . . 6.75 118.215 -172.578 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 91.85 -3.54 77.75 Favored Glycine 0 N--CA 1.464 0.51 0 N-CA-C 115.322 0.889 . . . . 4.5499999999999998 115.322 -169.382 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 67.9 m -67.87 166.25 15.95 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 108.404 -0.961 . . . . 4.0599999999999996 108.404 170.014 -58.075 -114.65 104.98 105.021 2.05 104.199 -79.089 -68.764 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 44.5 pt -132.71 157.89 43.14 Favored 'Isoleucine or valine' 0 C--O 1.239 0.522 0 CA-C-N 114.607 -1.179 . . . . 6.7199999999999998 108.237 -176.712 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 67.5 mt -113.6 128.07 70.64 Favored 'Isoleucine or valine' 0 C--O 1.247 0.943 0 CA-C-N 114.161 -1.381 . . . . 9.4000000000000004 107.352 173.5 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 44.2 pt -124.67 156.3 68.32 Favored Pre-proline 0 CA--C 1.51 -0.564 0 O-C-N 124.92 1.387 . . . . 9.8100000000000005 108.314 176.964 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -77.4 -26.78 7.01 Favored 'Trans proline' 0 C--O 1.247 0.93 0 C-N-CA 121.135 1.223 . . . . 8.8399999999999999 112.767 -179.936 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -81.26 -170.23 43.25 Favored Glycine 0 CA--C 1.534 1.278 0 O-C-N 124.49 1.118 . . . . 8.4399999999999995 111.356 178.697 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -117.03 -0.34 12.18 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 114.288 1.218 . . . . 11.199999999999999 114.288 -179.364 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' THR . . . . . 1.399 ' CA ' ' C ' ' A' ' 39' ' ' THR 0.982 22.6 m -137.36 129.03 28.6 Favored 'General case' 0 N--CA 1.48 1.04 0 O-C-N 125.496 1.747 . . . . 11.43 109.666 -172.434 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 40' ' ' CYS . . . . . 0.804 ' N ' ' CA ' ' A' ' 39' ' ' THR . 92.7 m -73.02 141.92 82.13 Favored Pre-proline 0 C--O 1.247 0.933 0 O-C-N 125.628 1.83 . . . . 7.5199999999999996 110.345 177.949 -66.408 -69.061 -80.884 103.458 2.036 101.834 -75.212 -48.199 2 2 . 1 . 001 ecloud build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 68.3 Cg_endo -75.88 165.42 30.03 Favored 'Trans proline' 0 C--N 1.317 -1.081 0 C-N-CA 121.912 1.741 . . . . 9.25 112.282 179.703 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -59.97 -25.54 61.97 Favored Glycine 0 CA--C 1.526 0.723 0 N-CA-C 117.229 1.651 . . . . 7.3799999999999999 117.229 -176.017 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ASP . . . . . 1.531 ' CA ' ' CB ' ' A' ' 43' ' ' ASP 0.406 27.3 p-10 -91.85 1.07 57.42 Favored 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 118.124 -1.43 . . . . 5.4199999999999999 113.307 178.378 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 82.6 m-85 -133.46 59.41 1.74 Allowed 'General case' 0 N--CA 1.474 0.743 0 O-C-N 125.578 1.799 . . . . 4.6900000000000004 107.457 170.208 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -87.38 -7.2 58.01 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 115.916 1.821 . . . . 5.5700000000000003 115.916 -167.33 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 35.4 m120 . . . . . 0 C--O 1.257 1.46 0 O-C-N 125.904 2.003 . . . . 8.2100000000000009 111.66 -174.188 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 66' ' ' EOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' THR . . . . . 0.828 ' C ' ' CA ' ' A' ' 2' ' ' THR . 97.8 m . . . . . 0 N--CA 1.491 1.58 0 N-CA-C 106.286 -1.746 . . . . 10.130000000000001 106.286 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' THR . . . . . 0.828 ' CA ' ' C ' ' A' ' 1' ' ' THR . 72.7 p -93.27 133.47 36.46 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 124.894 1.371 . . . . 9.5600000000000005 109.389 176.368 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.816 ' N ' ' CA ' ' A' ' 2' ' ' THR . 21.3 m -133.53 136.32 44.93 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 113.596 -1.638 . . . . 5.1500000000000004 106.926 -179.092 -48.199 -75.212 -80.884 101.834 2.036 103.458 -69.061 -66.408 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 94.4 m -123.86 148.19 55.99 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 122.298 1.047 . . . . 3.5499999999999998 110.369 -175.724 -68.764 -79.089 104.98 104.199 2.05 105.021 -114.65 -58.075 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_endo -76.36 -21.27 13.55 Favored 'Trans proline' 0 C--O 1.243 0.758 0 N-CA-C 115.026 1.125 . . . . 4.7000000000000002 115.026 -173.071 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 82.1 p -155.84 167.99 28.63 Favored 'General case' 0 C--O 1.24 0.565 0 N-CA-C 108.065 -1.087 . . . . 3.7200000000000002 108.065 -177.884 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 60.2 mt -57.45 -49.86 78.89 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 CA-C-N 113.761 -1.563 . . . . 11.33 112.52 178.534 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . 0.8 4.0 t -54.67 -44.61 70.73 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.399 0 CA-C-O 123.836 1.779 . . . . 10.890000000000001 110.157 175.795 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.8 -45.1 95.74 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 112.745 -2.025 . . . . 3.7999999999999998 110.747 -177.063 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 23.2 tpp180 -59.93 -45.59 92.12 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 113.089 0.774 . . . . 5.8099999999999996 113.089 175.251 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 48.8 m -60.19 -43.64 95.75 Favored 'General case' 0 C--O 1.25 1.117 0 C-N-CA 119.422 -0.911 . . . . 5.1200000000000001 110.295 -179.793 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.78 ' CB ' ' C ' ' A' ' 12' ' ' ASN 0.466 75.0 m-20 -72.82 -28.58 62.64 Favored 'General case' 0 C--O 1.248 0.995 0 CA-C-N 115.488 -0.778 . . . . 4.5700000000000003 112.08 176.557 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -60.68 -45.0 95.81 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 113.994 -1.457 . . . . 4.4800000000000004 110.306 179.441 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 96.4 m-20 -66.51 -34.69 78.49 Favored 'General case' 0 C--O 1.241 0.646 0 C-N-CA 119.257 -0.977 . . . . 4.7400000000000002 111.881 -176.909 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 45.4 t -67.86 -43.91 85.72 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.063 0 C-N-CA 119.695 -0.802 . . . . 4.2599999999999998 110.875 174.544 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 40.4 t -53.76 -36.62 62.55 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 115.344 -0.844 . . . . 3.8999999999999999 112.537 177.032 177.481 -91.393 -87.264 104.182 2.04 104.058 -57.408 -65.634 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 23.3 mmm180 -75.73 -18.46 59.56 Favored 'General case' 0 C--O 1.233 0.191 0 N-CA-C 114.891 1.441 . . . . 4.2699999999999996 114.891 -177.741 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 77.1 mt -54.1 -43.69 97.38 Favored Pre-proline 0 C--O 1.252 1.222 0 CA-C-O 117.462 -1.256 . . . . 5.5899999999999999 113.691 -175.712 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_endo -77.01 -7.6 17.38 Favored 'Trans proline' 0 C--N 1.318 -1.056 0 CA-C-N 122.013 1.755 . . . . 5.1399999999999997 114.233 177.915 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 104.26 11.14 32.37 Favored Glycine 0 CA--C 1.54 1.609 0 O-C-N 124.274 0.984 . . . . 4.2999999999999998 114.08 178.322 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 8.8 m -51.86 135.85 29.28 Favored 'General case' 0 N--CA 1.448 -0.545 0 O-C-N 124.207 0.593 . . . . 4.0899999999999999 111.087 178.859 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . 0.298 28.8 t . . . . . 0 C--O 1.251 1.14 0 CA-C-O 121.496 0.665 . . . . 5.7199999999999998 112.346 175.993 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_exo . . . . . 0 C--O 1.251 1.133 0 CA-C-O 121.496 0.54 . . . . 4.3399999999999999 112.346 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 77.4 mt-10 -53.15 -38.14 62.47 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 115.328 -0.851 . . . . 9.3399999999999999 112.843 175.806 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.63 -38.88 92.53 Favored 'General case' 0 N--CA 1.465 0.313 0 C-N-CA 118.915 -1.114 . . . . 3.6099999999999999 111.047 -174.052 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ILE . . . . . 1.576 ' CG1' ' CD1' ' A' ' 25' ' ' ILE . 7.0 mm . . . . . 0 CA--C 1.54 0.582 0 C-N-CA 120.1 -0.64 . . . . 6.9900000000000002 112.083 176.55 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 37.5 mt . . . . . 0 CA--C 1.54 0.582 0 N-CA-C 112.083 0.401 . . . . 6.9900000000000002 112.083 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.494 ' O ' HG23 ' A' ' 30' ' ' THR . 98.9 m -63.88 -29.75 70.91 Favored 'General case' 0 C--O 1.241 0.657 0 C-N-CA 116.632 -2.027 . . . . 3.5800000000000001 112.503 176.152 -65.634 -57.408 -87.264 104.058 2.04 104.182 -91.393 177.481 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -64.56 -52.45 57.61 Favored 'General case' 0 C--O 1.238 0.495 0 O-C-N 124.039 0.837 . . . . 3.6400000000000001 112.535 176.33 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 34.1 p -67.58 -26.73 66.42 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 117.304 -1.758 . . . . 4.4900000000000002 112.443 179.361 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 25.4 t80 -67.86 -34.95 77.68 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.524 0.564 . . . . 7.9299999999999997 112.524 178.534 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' THR . . . . . 0.494 HG23 ' O ' ' A' ' 26' ' ' CYS 0.775 72.1 p -99.73 -30.17 12.23 Favored 'General case' 0 N--CA 1.442 -0.83 0 N-CA-C 118.215 2.672 . . . . 6.75 118.215 -172.578 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 91.85 -3.54 77.75 Favored Glycine 0 N--CA 1.464 0.51 0 N-CA-C 115.322 0.889 . . . . 4.5499999999999998 115.322 -169.382 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 67.9 m -67.87 166.25 15.95 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 108.404 -0.961 . . . . 4.0599999999999996 108.404 170.014 -58.075 -114.65 104.98 105.021 2.05 104.199 -79.089 -68.764 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 44.5 pt -132.71 157.89 43.14 Favored 'Isoleucine or valine' 0 C--O 1.239 0.522 0 CA-C-N 114.607 -1.179 . . . . 6.7199999999999998 108.237 -176.712 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 67.5 mt -113.6 128.07 70.64 Favored 'Isoleucine or valine' 0 C--O 1.247 0.943 0 CA-C-N 114.161 -1.381 . . . . 9.4000000000000004 107.352 173.5 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 44.2 pt -124.67 156.3 68.32 Favored Pre-proline 0 CA--C 1.51 -0.564 0 O-C-N 124.92 1.387 . . . . 9.8100000000000005 108.314 176.964 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -77.4 -26.78 7.01 Favored 'Trans proline' 0 C--O 1.247 0.93 0 C-N-CA 121.135 1.223 . . . . 8.8399999999999999 112.767 -179.936 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -81.26 -170.23 43.25 Favored Glycine 0 CA--C 1.534 1.278 0 O-C-N 124.49 1.118 . . . . 8.4399999999999995 111.356 178.697 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -117.03 -0.34 12.18 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 114.288 1.218 . . . . 11.199999999999999 114.288 -179.364 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' THR . . . . . 1.399 ' CA ' ' C ' ' A' ' 39' ' ' THR 0.982 22.6 m -137.36 129.03 28.6 Favored 'General case' 0 N--CA 1.48 1.04 0 O-C-N 125.496 1.747 . . . . 11.43 109.666 -172.434 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.804 ' N ' ' CA ' ' A' ' 39' ' ' THR . 92.7 m -73.02 141.92 82.13 Favored Pre-proline 0 C--O 1.247 0.933 0 O-C-N 125.628 1.83 . . . . 7.5199999999999996 110.345 177.949 -66.408 -69.061 -80.884 103.458 2.036 101.834 -75.212 -48.199 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 68.3 Cg_endo -75.88 165.42 30.03 Favored 'Trans proline' 0 C--N 1.317 -1.081 0 C-N-CA 121.912 1.741 . . . . 9.25 112.282 179.703 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -59.97 -25.54 61.97 Favored Glycine 0 CA--C 1.526 0.723 0 N-CA-C 117.229 1.651 . . . . 7.3799999999999999 117.229 -176.017 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ASP . . . . . 1.531 ' CA ' ' CB ' ' A' ' 43' ' ' ASP 0.406 27.3 p-10 -91.85 1.07 57.42 Favored 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 118.124 -1.43 . . . . 5.4199999999999999 113.307 178.378 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 82.6 m-85 -133.46 59.41 1.74 Allowed 'General case' 0 N--CA 1.474 0.743 0 O-C-N 125.578 1.799 . . . . 4.6900000000000004 107.457 170.208 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -87.38 -7.2 58.01 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 115.916 1.821 . . . . 5.5700000000000003 115.916 -167.33 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 35.4 m120 . . . . . 0 C--O 1.257 1.46 0 O-C-N 125.904 2.003 . . . . 8.2100000000000009 111.66 -174.188 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' EOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_