data_2y3k_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 2y3k _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' ' ' MET . . . . . . . . . . . . . 1.7 ttp . . . . . 0 CA--C 1.507 -0.697 0 N-CA-C 102.69 -3.078 . . . . 38.780000000000001 102.69 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' VAL . . . . . 0.429 ' CG1' ' CG1' ' C' ' 5' ' ' VAL . 11.2 t -134.9 105.9 6.52 Favored 'Isoleucine or valine' 0 C--O 1.247 0.935 0 N-CA-C 107.186 -1.413 . . . . 31.579999999999998 107.186 -172.553 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -118.34 138.74 14.04 Favored Glycine 0 C--O 1.203 -1.789 0 CA-C-O 118.418 -1.212 . . . . 25.190000000000001 114.296 -176.696 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -134.03 125.67 3.97 Favored Glycine 0 N--CA 1.493 2.496 0 N-CA-C 116.968 1.547 . . . . 21.640000000000001 116.968 176.794 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' VAL . . . . . 0.851 ' CG2' ' CG1' ' B' ' 5' ' ' VAL . 27.0 m -129.41 120.57 51.24 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.494 0 N-CA-C 116.661 2.097 . . . . 21.829999999999998 116.661 -170.183 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 13.1 p -121.05 120.68 62.94 Favored 'Isoleucine or valine' 0 C--O 1.249 1.054 0 CA-C-O 124.063 1.887 . . . . 18.699999999999999 114.753 -179.906 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.0 mt -106.52 122.0 59.85 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.972 0 CA-C-N 113.119 -1.855 . . . . 26.079999999999998 109.338 165.513 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.426 -1.633 0 C-N-CA 118.562 -1.255 . . . . 26.920000000000002 112.102 -174.013 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 14.2 ttt . . . . . 0 N--CA 1.507 2.398 0 CA-C-O 120.378 0.133 . . . . 45.240000000000002 110.672 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 2' ' ' VAL . . . . . 0.539 ' CG1' ' CG1' ' D' ' 5' ' ' VAL . 64.8 t -145.31 108.46 0.91 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.895 0 N-CA-C 109.413 -0.588 . . . . 37.670000000000002 109.413 -179.569 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . -123.44 128.57 7.02 Favored Glycine 0 N--CA 1.446 -0.685 0 C-N-CA 118.75 -1.691 . . . . 24.5 116.876 -171.808 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' GLY . . . . . . . . . . . . . . . -132.91 125.95 4.27 Favored Glycine 0 C--N 1.334 0.443 0 N-CA-C 117.457 1.743 . . . . 21.129999999999999 117.457 177.858 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' VAL . . . . . 0.851 ' CG1' ' CG2' ' A' ' 5' ' ' VAL . 35.7 m -124.73 120.67 59.4 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.381 0 N-CA-C 114.48 1.289 . . . . 22.719999999999999 114.48 173.978 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' VAL . . . . . 0.625 ' CG1' ' CG2' ' C' ' 7' ' ' ILE 0.293 8.1 p -110.82 128.27 67.33 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.223 0 N-CA-C 115.994 1.85 . . . . 21.07 115.994 168.056 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 1.7 mt -117.15 110.27 30.63 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.534 0 N-CA-C 105.928 -1.879 . . . . 21.690000000000001 105.928 160.034 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.206 -1.208 0 CA-C-O 122.353 1.073 . . . . 23.75 108.691 176.486 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 2.8 ttt . . . . . 0 N--CA 1.497 1.884 0 N-CA-C 105.662 -1.977 . . . . 42.460000000000001 105.662 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 2' ' ' VAL . . . . . . . . . . . . . 46.9 t -158.65 110.64 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.569 1.691 0 N-CA-C 108.356 -0.979 . . . . 36.159999999999997 108.356 -165.395 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 3' ' ' GLY . . . . . . . . . . . . . . . -144.26 140.22 9.2 Favored Glycine 0 N--CA 1.479 1.545 0 N-CA-C 116.791 1.476 . . . . 34.670000000000002 116.791 -174.071 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 4' ' ' GLY . . . . . . . . . . . . . . . -140.16 131.94 5.29 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 116.335 1.294 . . . . 26.399999999999999 116.335 -177.374 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 5' ' ' VAL . . . . . 0.429 ' CG1' ' CG1' ' A' ' 2' ' ' VAL . 32.8 m -125.96 128.4 71.89 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.497 0 N-CA-C 113.437 0.903 . . . . 28.620000000000001 113.437 -179.409 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 6' ' ' VAL . . . . . . . . . . . . . 7.3 p -120.13 119.65 60.68 Favored 'Isoleucine or valine' 0 C--O 1.257 1.471 0 CA-C-O 123.272 1.511 . . . . 16.620000000000001 114.557 172.957 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 7' ' ' ILE . . . . . 0.625 ' CG2' ' CG1' ' B' ' 6' ' ' VAL . 1.4 mt -103.87 115.66 46.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 106.859 -1.534 . . . . 23.690000000000001 106.859 159.256 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.243 0.725 0 CA-C-O 116.418 -1.753 . . . . 26.969999999999999 110.834 175.977 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 28.4 ttt . . . . . 0 CA--C 1.496 -1.131 0 N-CA-C 106.272 -1.751 . . . . 33.579999999999998 106.272 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 2' ' ' VAL . . . . . . . . . . . . . 95.7 t -119.82 106.64 19.42 Favored 'Isoleucine or valine' 0 C--O 1.244 0.804 0 N-CA-C 107.139 -1.43 . . . . 29.289999999999999 107.139 173.79 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 3' ' ' GLY . . . . . . . . . . . . . . . -118.61 131.81 9.37 Favored Glycine 0 C--O 1.218 -0.905 0 N-CA-C 116.955 1.542 . . . . 20.600000000000001 116.955 -171.12 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 4' ' ' GLY . . . . . . . . . . . . . . . -134.39 123.65 3.28 Favored Glycine 0 C--O 1.216 -0.992 0 N-CA-C 115.765 1.066 . . . . 19.289999999999999 115.765 -178.046 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 5' ' ' VAL . . . . . 0.539 ' CG1' ' CG1' ' B' ' 2' ' ' VAL . 35.4 m -128.09 113.29 29.94 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.859 0 N-CA-C 117.458 2.392 . . . . 19.350000000000001 117.458 -178.517 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 6' ' ' VAL . . . . . . . . . . . . 0.31 1.8 p -107.95 131.68 57.66 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.796 0 N-CA-C 116.134 1.901 . . . . 22.379999999999999 116.134 171.027 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 7' ' ' ILE . . . . . . . . . . . . . 1.8 mt -120.0 122.16 67.77 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 N-CA-C 108.736 -0.839 . . . . 21.93 108.736 160.149 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.504 -0.803 0 CA-C-O 122.05 0.929 . . . . 27.030000000000001 108.74 179.263 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.507 2.399 0 CA-C-O 120.912 0.387 . . . . 33.740000000000002 110.546 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 2' ' ' VAL . . . . . 1.079 ' CG1' ' CG1' ' G' ' 5' ' ' VAL . 2.5 t -128.05 131.44 69.45 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.711 0 C-N-CA 125.126 1.37 . . . . 27.870000000000001 107.465 174.203 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' E' E ' 3' ' ' GLY . . . . . . . . . . . . . . . -133.97 152.45 20.55 Favored Glycine 0 N--CA 1.475 1.288 0 CA-C-O 122.679 1.155 . . . . 20.57 113.878 -174.94 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 4' ' ' GLY . . . . . . . . . . . . . . . -165.78 113.72 0.56 Allowed Glycine 0 N--CA 1.473 1.124 0 N-CA-C 109.576 -1.41 . . . . 18.760000000000002 109.576 -170.591 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 5' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -123.72 140.27 47.74 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.121 0 C-N-CA 124.021 0.929 . . . . 16.800000000000001 110.492 176.099 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' E' E ' 6' ' ' VAL . . . . . . . . . . . . . 2.3 p -141.98 140.53 29.91 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.882 0 O-C-N 121.455 -0.778 . . . . 16.719999999999999 110.588 172.414 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 7' ' ' ILE . . . . . . . . . . . . . 98.6 mt -133.36 136.13 55.24 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 N-CA-C 105.754 -1.943 . . . . 27.670000000000002 105.754 179.192 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.311 -1.068 0 N-CA-C 115.253 1.575 . . . . 30.390000000000001 115.253 -161.272 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.494 1.751 0 N-CA-C 107.102 -1.444 . . . . 40.100000000000001 107.102 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 2' ' ' VAL . . . . . 0.656 ' CG1' ' CG1' ' H' ' 5' ' ' VAL . 2.7 t -131.06 132.26 63.62 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.031 0 C-N-CA 118.038 -1.465 . . . . 35.469999999999999 107.676 168.949 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' F' F ' 3' ' ' GLY . . . . . . . . . . . . . . . -142.67 -176.52 16.84 Favored Glycine 0 CA--C 1.493 -1.291 0 C-N-CA 118.116 -1.992 . . . . 27.27 111.98 179.465 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 4' ' ' GLY . . . . . . . . . . . . . . . 179.61 151.68 10.05 Favored Glycine 0 N--CA 1.426 -2.001 0 C-N-CA 119.718 -1.23 . . . . 26.030000000000001 110.356 166.373 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 5' ' ' VAL . . . . . . . . . . . . . 11.8 m -133.28 150.78 32.78 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.911 0 N-CA-C 116.122 1.897 . . . . 26.16 116.122 178.074 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 6' ' ' VAL . . . . . 0.495 ' CG1' ' CG2' ' G' ' 7' ' ' ILE . 8.6 p -141.27 137.73 33.3 Favored 'Isoleucine or valine' 0 C--O 1.26 1.623 0 CA-C-O 122.649 1.214 . . . . 24.690000000000001 109.576 174.329 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' F' F ' 7' ' ' ILE . . . . . . . . . . . . . 53.2 mt -117.09 89.08 1.28 Allowed 'Isoleucine or valine' 0 C--O 1.261 1.68 0 N-CA-C 103.306 -2.85 . . . . 24.629999999999999 103.306 169.322 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.508 -0.667 0 N-CA-C 114.025 1.12 . . . . 26.210000000000001 114.025 -163.038 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' G' G ' 1' ' ' MET . . . . . . . . . . . . . 6.6 ttt . . . . . 0 N--CA 1.494 1.728 0 CA-C-O 121.6 0.714 . . . . 31.07 110.769 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' G' G ' 2' ' ' VAL . . . . . . . . . . . . . 16.8 t -113.19 130.11 67.7 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 N-CA-C 104.541 -2.392 . . . . 40.43 104.541 171.568 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 3' ' ' GLY . . . . . . . . . . . . . . . -125.56 165.16 18.84 Favored Glycine 0 N--CA 1.436 -1.315 0 N-CA-C 109.43 -1.468 . . . . 21.960000000000001 109.43 -176.19 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 4' ' ' GLY . . . . . . . . . . . . . . . -170.0 109.96 0.35 Allowed Glycine 0 N--CA 1.473 1.151 0 N-CA-C 110.5 -1.04 . . . . 23.52 110.5 -174.283 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 5' ' ' VAL . . . . . 1.079 ' CG1' ' CG1' ' E' ' 2' ' ' VAL . 1.1 m -127.6 134.42 65.61 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.372 0 N-CA-C 116.3 1.963 . . . . 20.300000000000001 116.3 177.881 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' G' G ' 6' ' ' VAL . . . . . 0.798 ' CG2' ' CG1' ' H' ' 6' ' ' VAL . 5.5 p -145.3 144.02 21.7 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.138 0 CA-C-O 123.055 1.407 . . . . 20.84 111.682 175.941 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' G' G ' 7' ' ' ILE . . . . . 0.495 ' CG2' ' CG1' ' F' ' 6' ' ' VAL . 45.2 mt -125.09 91.42 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 N-CA-C 103.294 -2.854 . . . . 26.890000000000001 103.294 -178.995 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' G' G ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.313 -0.996 0 CA-C-O 116.867 -1.539 . . . . 30.550000000000001 114.453 -163.223 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 1' ' ' MET . . . . . . . . . . . . . 2.6 ttt . . . . . 0 N--CA 1.488 1.447 0 N-CA-C 109.773 -0.454 . . . . 43.390000000000001 109.773 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 2' ' ' VAL . . . . . . . . . . . . . 1.8 t -142.16 132.68 24.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 N-CA-C 108.922 -0.77 . . . . 27.809999999999999 108.922 167.125 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 3' ' ' GLY . . . . . . . . . . . . . . . -142.59 172.99 24.14 Favored Glycine 0 N--CA 1.466 0.664 0 CA-C-O 122.264 0.924 . . . . 25.940000000000001 115.162 173.615 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 4' ' ' GLY . . . . . . . . . . . . . . . -173.05 147.46 9.69 Favored Glycine 0 N--CA 1.425 -2.087 0 N-CA-C 108.695 -1.762 . . . . 21.620000000000001 108.695 171.035 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 5' ' ' VAL . . . . . 0.656 ' CG1' ' CG1' ' F' ' 2' ' ' VAL . 3.2 m -126.24 156.4 36.61 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.706 0 O-C-N 124.44 0.729 . . . . 22.16 111.397 173.232 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 6' ' ' VAL . . . . . 0.798 ' CG1' ' CG2' ' G' ' 6' ' ' VAL . 11.4 p -140.49 135.13 35.17 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.391 0 CA-C-N 115.845 -0.616 . . . . 16.75 109.747 170.076 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 7' ' ' ILE . . . . . . . . . . . . . 46.8 mt -125.39 129.7 72.93 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 N-CA-C 106.406 -1.701 . . . . 21.98 106.406 166.493 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.483 -1.619 0 C-N-CA 119.87 -0.732 . . . . 24.760000000000002 110.184 -163.17 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' MET . . . . . 0.429 ' O ' ' HA ' ' B' ' 1' ' ' MET . 1.7 ttp . . . . . 0 CA--C 1.507 -0.697 0 N-CA-C 102.69 -3.078 . . . . 38.780000000000001 102.69 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 2' ' ' VAL . . . . . 0.556 HG13 ' HB ' ' B' ' 2' ' ' VAL . 11.2 t -134.9 105.9 6.52 Favored 'Isoleucine or valine' 0 C--O 1.247 0.935 0 N-CA-C 107.186 -1.413 . . . . 31.579999999999998 107.186 -172.553 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -118.34 138.74 14.04 Favored Glycine 0 C--O 1.203 -1.789 0 CA-C-O 118.418 -1.212 . . . . 25.190000000000001 114.296 -176.696 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -134.03 125.67 3.97 Favored Glycine 0 N--CA 1.493 2.496 0 N-CA-C 116.968 1.547 . . . . 21.640000000000001 116.968 176.794 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' VAL . . . . . 1.296 ' CG2' HG12 ' B' ' 5' ' ' VAL . 27.0 m -129.41 120.57 51.24 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.494 0 N-CA-C 116.661 2.097 . . . . 21.829999999999998 116.661 -170.183 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 6' ' ' VAL . . . . . 0.888 HG23 HG13 ' B' ' 6' ' ' VAL . 13.1 p -121.05 120.68 62.94 Favored 'Isoleucine or valine' 0 C--O 1.249 1.054 0 CA-C-O 124.063 1.887 . . . . 18.699999999999999 114.753 -179.906 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.0 mt -106.52 122.0 59.85 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.972 0 CA-C-N 113.119 -1.855 . . . . 26.079999999999998 109.338 165.513 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.426 -1.633 0 C-N-CA 118.562 -1.255 . . . . 26.920000000000002 112.102 -174.013 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 1' ' ' MET . . . . . 0.429 ' HA ' ' O ' ' A' ' 1' ' ' MET . 14.2 ttt . . . . . 0 N--CA 1.507 2.398 0 CA-C-O 120.378 0.133 . . . . 45.240000000000002 110.672 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 2' ' ' VAL . . . . . 0.719 HG13 ' CG1' ' D' ' 5' ' ' VAL . 64.8 t -145.31 108.46 0.91 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.895 0 N-CA-C 109.413 -0.588 . . . . 37.670000000000002 109.413 -179.569 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . -123.44 128.57 7.02 Favored Glycine 0 N--CA 1.446 -0.685 0 C-N-CA 118.75 -1.691 . . . . 24.5 116.876 -171.808 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 4' ' ' GLY . . . . . 0.474 ' O ' HD11 ' C' ' 7' ' ' ILE . . . -132.91 125.95 4.27 Favored Glycine 0 C--N 1.334 0.443 0 N-CA-C 117.457 1.743 . . . . 21.129999999999999 117.457 177.858 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 5' ' ' VAL . . . . . 1.296 HG12 ' CG2' ' A' ' 5' ' ' VAL . 35.7 m -124.73 120.67 59.4 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.381 0 N-CA-C 114.48 1.289 . . . . 22.719999999999999 114.48 173.978 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 6' ' ' VAL . . . . . 1.028 HG12 HG21 ' C' ' 7' ' ' ILE 0.293 8.1 p -110.82 128.27 67.33 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.223 0 N-CA-C 115.994 1.85 . . . . 21.07 115.994 168.056 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 1.7 mt -117.15 110.27 30.63 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.534 0 N-CA-C 105.928 -1.879 . . . . 21.690000000000001 105.928 160.034 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.206 -1.208 0 CA-C-O 122.353 1.073 . . . . 23.75 108.691 176.486 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 2.8 ttt . . . . . 0 N--CA 1.497 1.884 0 N-CA-C 105.662 -1.977 . . . . 42.460000000000001 105.662 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 2' ' ' VAL . . . . . . . . . . . . . 46.9 t -158.65 110.64 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.569 1.691 0 N-CA-C 108.356 -0.979 . . . . 36.159999999999997 108.356 -165.395 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 3' ' ' GLY . . . . . . . . . . . . . . . -144.26 140.22 9.2 Favored Glycine 0 N--CA 1.479 1.545 0 N-CA-C 116.791 1.476 . . . . 34.670000000000002 116.791 -174.071 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 4' ' ' GLY . . . . . . . . . . . . . . . -140.16 131.94 5.29 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 116.335 1.294 . . . . 26.399999999999999 116.335 -177.374 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 5' ' ' VAL . . . . . 0.924 HG22 HG12 ' D' ' 5' ' ' VAL . 32.8 m -125.96 128.4 71.89 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.497 0 N-CA-C 113.437 0.903 . . . . 28.620000000000001 113.437 -179.409 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 6' ' ' VAL . . . . . 0.63 HG23 ' CG1' ' D' ' 6' ' ' VAL . 7.3 p -120.13 119.65 60.68 Favored 'Isoleucine or valine' 0 C--O 1.257 1.471 0 CA-C-O 123.272 1.511 . . . . 16.620000000000001 114.557 172.957 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 7' ' ' ILE . . . . . 1.028 HG21 HG12 ' B' ' 6' ' ' VAL . 1.4 mt -103.87 115.66 46.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 106.859 -1.534 . . . . 23.690000000000001 106.859 159.256 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.243 0.725 0 CA-C-O 116.418 -1.753 . . . . 26.969999999999999 110.834 175.977 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 28.4 ttt . . . . . 0 CA--C 1.496 -1.131 0 N-CA-C 106.272 -1.751 . . . . 33.579999999999998 106.272 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 2' ' ' VAL . . . . . . . . . . . . . 95.7 t -119.82 106.64 19.42 Favored 'Isoleucine or valine' 0 C--O 1.244 0.804 0 N-CA-C 107.139 -1.43 . . . . 29.289999999999999 107.139 173.79 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 3' ' ' GLY . . . . . . . . . . . . . . . -118.61 131.81 9.37 Favored Glycine 0 C--O 1.218 -0.905 0 N-CA-C 116.955 1.542 . . . . 20.600000000000001 116.955 -171.12 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 4' ' ' GLY . . . . . . . . . . . . . . . -134.39 123.65 3.28 Favored Glycine 0 C--O 1.216 -0.992 0 N-CA-C 115.765 1.066 . . . . 19.289999999999999 115.765 -178.046 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 5' ' ' VAL . . . . . 0.924 HG12 HG22 ' C' ' 5' ' ' VAL . 35.4 m -128.09 113.29 29.94 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.859 0 N-CA-C 117.458 2.392 . . . . 19.350000000000001 117.458 -178.517 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 6' ' ' VAL . . . . . 0.63 ' CG1' HG23 ' C' ' 6' ' ' VAL 0.31 1.8 p -107.95 131.68 57.66 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.796 0 N-CA-C 116.134 1.901 . . . . 22.379999999999999 116.134 171.027 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' D' D ' 7' ' ' ILE . . . . . . . . . . . . . 1.8 mt -120.0 122.16 67.77 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 N-CA-C 108.736 -0.839 . . . . 21.93 108.736 160.149 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.504 -0.803 0 CA-C-O 122.05 0.929 . . . . 27.030000000000001 108.74 179.263 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.507 2.399 0 CA-C-O 120.912 0.387 . . . . 33.740000000000002 110.546 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 2' ' ' VAL . . . . . 1.079 ' CG1' ' CG1' ' G' ' 5' ' ' VAL . 2.5 t -128.05 131.44 69.45 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.711 0 C-N-CA 125.126 1.37 . . . . 27.870000000000001 107.465 174.203 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 3' ' ' GLY . . . . . . . . . . . . . . . -133.97 152.45 20.55 Favored Glycine 0 N--CA 1.475 1.288 0 CA-C-O 122.679 1.155 . . . . 20.57 113.878 -174.94 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 4' ' ' GLY . . . . . . . . . . . . . . . -165.78 113.72 0.56 Allowed Glycine 0 N--CA 1.473 1.124 0 N-CA-C 109.576 -1.41 . . . . 18.760000000000002 109.576 -170.591 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 5' ' ' VAL . . . . . 0.68 HG22 HG12 ' F' ' 5' ' ' VAL . 1.0 OUTLIER -123.72 140.27 47.74 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.121 0 C-N-CA 124.021 0.929 . . . . 16.800000000000001 110.492 176.099 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' E' E ' 6' ' ' VAL . . . . . 0.741 HG23 HG13 ' F' ' 6' ' ' VAL . 2.3 p -141.98 140.53 29.91 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.882 0 O-C-N 121.455 -0.778 . . . . 16.719999999999999 110.588 172.414 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 7' ' ' ILE . . . . . . . . . . . . . 98.6 mt -133.36 136.13 55.24 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 N-CA-C 105.754 -1.943 . . . . 27.670000000000002 105.754 179.192 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 8' ' ' ALA . . . . . 0.503 ' HA ' ' OXT' ' F' ' 8' ' ' ALA . . . . . . . . 0 C--N 1.311 -1.068 0 N-CA-C 115.253 1.575 . . . . 30.390000000000001 115.253 -161.272 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.494 1.751 0 N-CA-C 107.102 -1.444 . . . . 40.100000000000001 107.102 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 2' ' ' VAL . . . . . 0.694 HG12 ' CG1' ' H' ' 5' ' ' VAL . 2.7 t -131.06 132.26 63.62 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.031 0 C-N-CA 118.038 -1.465 . . . . 35.469999999999999 107.676 168.949 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 3' ' ' GLY . . . . . . . . . . . . . . . -142.67 -176.52 16.84 Favored Glycine 0 CA--C 1.493 -1.291 0 C-N-CA 118.116 -1.992 . . . . 27.27 111.98 179.465 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 4' ' ' GLY . . . . . . . . . . . . . . . 179.61 151.68 10.05 Favored Glycine 0 N--CA 1.426 -2.001 0 C-N-CA 119.718 -1.23 . . . . 26.030000000000001 110.356 166.373 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 5' ' ' VAL . . . . . 0.68 HG12 HG22 ' E' ' 5' ' ' VAL . 11.8 m -133.28 150.78 32.78 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.911 0 N-CA-C 116.122 1.897 . . . . 26.16 116.122 178.074 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 6' ' ' VAL . . . . . 0.774 HG12 HG21 ' G' ' 7' ' ' ILE . 8.6 p -141.27 137.73 33.3 Favored 'Isoleucine or valine' 0 C--O 1.26 1.623 0 CA-C-O 122.649 1.214 . . . . 24.690000000000001 109.576 174.329 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 7' ' ' ILE . . . . . . . . . . . . . 53.2 mt -117.09 89.08 1.28 Allowed 'Isoleucine or valine' 0 C--O 1.261 1.68 0 N-CA-C 103.306 -2.85 . . . . 24.629999999999999 103.306 169.322 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 8' ' ' ALA . . . . . 0.64 ' HB2' HG22 ' F' ' 6' ' ' VAL . . . . . . . . 0 CA--C 1.508 -0.667 0 N-CA-C 114.025 1.12 . . . . 26.210000000000001 114.025 -163.038 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 1' ' ' MET . . . . . . . . . . . . . 6.6 ttt . . . . . 0 N--CA 1.494 1.728 0 CA-C-O 121.6 0.714 . . . . 31.07 110.769 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' G' G ' 2' ' ' VAL . . . . . . . . . . . . . 16.8 t -113.19 130.11 67.7 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 N-CA-C 104.541 -2.392 . . . . 40.43 104.541 171.568 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 3' ' ' GLY . . . . . . . . . . . . . . . -125.56 165.16 18.84 Favored Glycine 0 N--CA 1.436 -1.315 0 N-CA-C 109.43 -1.468 . . . . 21.960000000000001 109.43 -176.19 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 4' ' ' GLY . . . . . . . . . . . . . . . -170.0 109.96 0.35 Allowed Glycine 0 N--CA 1.473 1.151 0 N-CA-C 110.5 -1.04 . . . . 23.52 110.5 -174.283 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 5' ' ' VAL . . . . . 1.079 ' CG1' ' CG1' ' E' ' 2' ' ' VAL . 1.1 m -127.6 134.42 65.61 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.372 0 N-CA-C 116.3 1.963 . . . . 20.300000000000001 116.3 177.881 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' G' G ' 6' ' ' VAL . . . . . 1.137 HG23 HG13 ' H' ' 6' ' ' VAL . 5.5 p -145.3 144.02 21.7 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.138 0 CA-C-O 123.055 1.407 . . . . 20.84 111.682 175.941 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' G' G ' 7' ' ' ILE . . . . . 0.774 HG21 HG12 ' F' ' 6' ' ' VAL . 45.2 mt -125.09 91.42 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 N-CA-C 103.294 -2.854 . . . . 26.890000000000001 103.294 -178.995 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' G' G ' 8' ' ' ALA . . . . . 0.416 ' HB2' HG22 ' G' ' 6' ' ' VAL . . . . . . . . 0 C--N 1.313 -0.996 0 CA-C-O 116.867 -1.539 . . . . 30.550000000000001 114.453 -163.223 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 1' ' ' MET . . . . . . . . . . . . . 2.6 ttt . . . . . 0 N--CA 1.488 1.447 0 N-CA-C 109.773 -0.454 . . . . 43.390000000000001 109.773 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 2' ' ' VAL . . . . . . . . . . . . . 1.8 t -142.16 132.68 24.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 N-CA-C 108.922 -0.77 . . . . 27.809999999999999 108.922 167.125 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 3' ' ' GLY . . . . . . . . . . . . . . . -142.59 172.99 24.14 Favored Glycine 0 N--CA 1.466 0.664 0 CA-C-O 122.264 0.924 . . . . 25.940000000000001 115.162 173.615 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 4' ' ' GLY . . . . . . . . . . . . . . . -173.05 147.46 9.69 Favored Glycine 0 N--CA 1.425 -2.087 0 N-CA-C 108.695 -1.762 . . . . 21.620000000000001 108.695 171.035 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 5' ' ' VAL . . . . . 0.694 ' CG1' HG12 ' F' ' 2' ' ' VAL . 3.2 m -126.24 156.4 36.61 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.706 0 O-C-N 124.44 0.729 . . . . 22.16 111.397 173.232 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 6' ' ' VAL . . . . . 1.137 HG13 HG23 ' G' ' 6' ' ' VAL . 11.4 p -140.49 135.13 35.17 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.391 0 CA-C-N 115.845 -0.616 . . . . 16.75 109.747 170.076 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 7' ' ' ILE . . . . . 0.434 HG12 HD12 ' G' ' 7' ' ' ILE . 46.8 mt -125.39 129.7 72.93 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 N-CA-C 106.406 -1.701 . . . . 21.98 106.406 166.493 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.483 -1.619 0 C-N-CA 119.87 -0.732 . . . . 24.760000000000002 110.184 -163.17 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' MET . . . . . 0.429 ' O ' ' HA ' ' B' ' 1' ' ' MET . 1.7 ttp . . . . . 0 CA--C 1.507 -0.697 0 N-CA-C 102.69 -3.078 . . . . 38.780000000000001 102.69 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.556 HG13 ' HB ' ' B' ' 2' ' ' VAL . 11.2 t -134.9 105.9 6.52 Favored 'Isoleucine or valine' 0 C--O 1.247 0.935 0 N-CA-C 107.186 -1.413 . . . . 31.579999999999998 107.186 -172.553 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -118.34 138.74 14.04 Favored Glycine 0 C--O 1.203 -1.789 0 CA-C-O 118.418 -1.212 . . . . 25.190000000000001 114.296 -176.696 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -134.03 125.67 3.97 Favored Glycine 0 N--CA 1.493 2.496 0 N-CA-C 116.968 1.547 . . . . 21.640000000000001 116.968 176.794 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' VAL . . . . . 1.296 ' CG2' HG12 ' B' ' 5' ' ' VAL . 27.0 m -129.41 120.57 51.24 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.494 0 N-CA-C 116.661 2.097 . . . . 21.829999999999998 116.661 -170.183 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.888 HG23 HG13 ' B' ' 6' ' ' VAL . 13.1 p -121.05 120.68 62.94 Favored 'Isoleucine or valine' 0 C--O 1.249 1.054 0 CA-C-O 124.063 1.887 . . . . 18.699999999999999 114.753 -179.906 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.0 mt -106.52 122.0 59.85 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.972 0 CA-C-N 113.119 -1.855 . . . . 26.079999999999998 109.338 165.513 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.426 -1.633 0 C-N-CA 118.562 -1.255 . . . . 26.920000000000002 112.102 -174.013 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 1' ' ' MET . . . . . 0.429 ' HA ' ' O ' ' A' ' 1' ' ' MET . 14.2 ttt . . . . . 0 N--CA 1.507 2.398 0 CA-C-O 120.378 0.133 . . . . 45.240000000000002 110.672 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 2' ' ' VAL . . . . . 0.719 HG13 ' CG1' ' D' ' 5' ' ' VAL . 64.8 t -145.31 108.46 0.91 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.895 0 N-CA-C 109.413 -0.588 . . . . 37.670000000000002 109.413 -179.569 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . -123.44 128.57 7.02 Favored Glycine 0 N--CA 1.446 -0.685 0 C-N-CA 118.75 -1.691 . . . . 24.5 116.876 -171.808 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' GLY . . . . . 0.474 ' O ' HD11 ' C' ' 7' ' ' ILE . . . -132.91 125.95 4.27 Favored Glycine 0 C--N 1.334 0.443 0 N-CA-C 117.457 1.743 . . . . 21.129999999999999 117.457 177.858 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' VAL . . . . . 1.296 HG12 ' CG2' ' A' ' 5' ' ' VAL . 35.7 m -124.73 120.67 59.4 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.381 0 N-CA-C 114.48 1.289 . . . . 22.719999999999999 114.48 173.978 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' VAL . . . . . 1.028 HG12 HG21 ' C' ' 7' ' ' ILE 0.293 8.1 p -110.82 128.27 67.33 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.223 0 N-CA-C 115.994 1.85 . . . . 21.07 115.994 168.056 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 1.7 mt -117.15 110.27 30.63 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.534 0 N-CA-C 105.928 -1.879 . . . . 21.690000000000001 105.928 160.034 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.206 -1.208 0 CA-C-O 122.353 1.073 . . . . 23.75 108.691 176.486 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 1' ' ' MET . . . . . . . . . . . . . 2.8 ttt . . . . . 0 N--CA 1.497 1.884 0 N-CA-C 105.662 -1.977 . . . . 42.460000000000001 105.662 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 2' ' ' VAL . . . . . . . . . . . . . 46.9 t -158.65 110.64 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.569 1.691 0 N-CA-C 108.356 -0.979 . . . . 36.159999999999997 108.356 -165.395 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 3' ' ' GLY . . . . . . . . . . . . . . . -144.26 140.22 9.2 Favored Glycine 0 N--CA 1.479 1.545 0 N-CA-C 116.791 1.476 . . . . 34.670000000000002 116.791 -174.071 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 4' ' ' GLY . . . . . . . . . . . . . . . -140.16 131.94 5.29 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 116.335 1.294 . . . . 26.399999999999999 116.335 -177.374 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 5' ' ' VAL . . . . . 0.924 HG22 HG12 ' D' ' 5' ' ' VAL . 32.8 m -125.96 128.4 71.89 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.497 0 N-CA-C 113.437 0.903 . . . . 28.620000000000001 113.437 -179.409 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 6' ' ' VAL . . . . . 0.63 HG23 ' CG1' ' D' ' 6' ' ' VAL . 7.3 p -120.13 119.65 60.68 Favored 'Isoleucine or valine' 0 C--O 1.257 1.471 0 CA-C-O 123.272 1.511 . . . . 16.620000000000001 114.557 172.957 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 7' ' ' ILE . . . . . 1.028 HG21 HG12 ' B' ' 6' ' ' VAL . 1.4 mt -103.87 115.66 46.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 106.859 -1.534 . . . . 23.690000000000001 106.859 159.256 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.243 0.725 0 CA-C-O 116.418 -1.753 . . . . 26.969999999999999 110.834 175.977 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 1' ' ' MET . . . . . . . . . . . . . 28.4 ttt . . . . . 0 CA--C 1.496 -1.131 0 N-CA-C 106.272 -1.751 . . . . 33.579999999999998 106.272 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 2' ' ' VAL . . . . . . . . . . . . . 95.7 t -119.82 106.64 19.42 Favored 'Isoleucine or valine' 0 C--O 1.244 0.804 0 N-CA-C 107.139 -1.43 . . . . 29.289999999999999 107.139 173.79 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 3' ' ' GLY . . . . . . . . . . . . . . . -118.61 131.81 9.37 Favored Glycine 0 C--O 1.218 -0.905 0 N-CA-C 116.955 1.542 . . . . 20.600000000000001 116.955 -171.12 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 4' ' ' GLY . . . . . . . . . . . . . . . -134.39 123.65 3.28 Favored Glycine 0 C--O 1.216 -0.992 0 N-CA-C 115.765 1.066 . . . . 19.289999999999999 115.765 -178.046 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 5' ' ' VAL . . . . . 0.924 HG12 HG22 ' C' ' 5' ' ' VAL . 35.4 m -128.09 113.29 29.94 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.859 0 N-CA-C 117.458 2.392 . . . . 19.350000000000001 117.458 -178.517 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 6' ' ' VAL . . . . . 0.63 ' CG1' HG23 ' C' ' 6' ' ' VAL 0.31 1.8 p -107.95 131.68 57.66 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.796 0 N-CA-C 116.134 1.901 . . . . 22.379999999999999 116.134 171.027 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' D' D ' 7' ' ' ILE . . . . . . . . . . . . . 1.8 mt -120.0 122.16 67.77 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 N-CA-C 108.736 -0.839 . . . . 21.93 108.736 160.149 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.504 -0.803 0 CA-C-O 122.05 0.929 . . . . 27.030000000000001 108.74 179.263 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.507 2.399 0 CA-C-O 120.912 0.387 . . . . 33.740000000000002 110.546 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 2' ' ' VAL . . . . . 1.079 ' CG1' ' CG1' ' G' ' 5' ' ' VAL . 2.5 t -128.05 131.44 69.45 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.711 0 C-N-CA 125.126 1.37 . . . . 27.870000000000001 107.465 174.203 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 3' ' ' GLY . . . . . . . . . . . . . . . -133.97 152.45 20.55 Favored Glycine 0 N--CA 1.475 1.288 0 CA-C-O 122.679 1.155 . . . . 20.57 113.878 -174.94 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 4' ' ' GLY . . . . . . . . . . . . . . . -165.78 113.72 0.56 Allowed Glycine 0 N--CA 1.473 1.124 0 N-CA-C 109.576 -1.41 . . . . 18.760000000000002 109.576 -170.591 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 5' ' ' VAL . . . . . 0.68 HG22 HG12 ' F' ' 5' ' ' VAL . 1.0 OUTLIER -123.72 140.27 47.74 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.121 0 C-N-CA 124.021 0.929 . . . . 16.800000000000001 110.492 176.099 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' E' E ' 6' ' ' VAL . . . . . 0.741 HG23 HG13 ' F' ' 6' ' ' VAL . 2.3 p -141.98 140.53 29.91 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.882 0 O-C-N 121.455 -0.778 . . . . 16.719999999999999 110.588 172.414 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 7' ' ' ILE . . . . . . . . . . . . . 98.6 mt -133.36 136.13 55.24 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 N-CA-C 105.754 -1.943 . . . . 27.670000000000002 105.754 179.192 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 8' ' ' ALA . . . . . 0.503 ' HA ' ' OXT' ' F' ' 8' ' ' ALA . . . . . . . . 0 C--N 1.311 -1.068 0 N-CA-C 115.253 1.575 . . . . 30.390000000000001 115.253 -161.272 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.494 1.751 0 N-CA-C 107.102 -1.444 . . . . 40.100000000000001 107.102 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 2' ' ' VAL . . . . . 0.694 HG12 ' CG1' ' H' ' 5' ' ' VAL . 2.7 t -131.06 132.26 63.62 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.031 0 C-N-CA 118.038 -1.465 . . . . 35.469999999999999 107.676 168.949 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 3' ' ' GLY . . . . . . . . . . . . . . . -142.67 -176.52 16.84 Favored Glycine 0 CA--C 1.493 -1.291 0 C-N-CA 118.116 -1.992 . . . . 27.27 111.98 179.465 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 4' ' ' GLY . . . . . . . . . . . . . . . 179.61 151.68 10.05 Favored Glycine 0 N--CA 1.426 -2.001 0 C-N-CA 119.718 -1.23 . . . . 26.030000000000001 110.356 166.373 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 5' ' ' VAL . . . . . 0.68 HG12 HG22 ' E' ' 5' ' ' VAL . 11.8 m -133.28 150.78 32.78 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.911 0 N-CA-C 116.122 1.897 . . . . 26.16 116.122 178.074 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 6' ' ' VAL . . . . . 0.774 HG12 HG21 ' G' ' 7' ' ' ILE . 8.6 p -141.27 137.73 33.3 Favored 'Isoleucine or valine' 0 C--O 1.26 1.623 0 CA-C-O 122.649 1.214 . . . . 24.690000000000001 109.576 174.329 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 7' ' ' ILE . . . . . . . . . . . . . 53.2 mt -117.09 89.08 1.28 Allowed 'Isoleucine or valine' 0 C--O 1.261 1.68 0 N-CA-C 103.306 -2.85 . . . . 24.629999999999999 103.306 169.322 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 8' ' ' ALA . . . . . 0.64 ' HB2' HG22 ' F' ' 6' ' ' VAL . . . . . . . . 0 CA--C 1.508 -0.667 0 N-CA-C 114.025 1.12 . . . . 26.210000000000001 114.025 -163.038 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 1' ' ' MET . . . . . . . . . . . . . 6.6 ttt . . . . . 0 N--CA 1.494 1.728 0 CA-C-O 121.6 0.714 . . . . 31.07 110.769 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' G' G ' 2' ' ' VAL . . . . . . . . . . . . . 16.8 t -113.19 130.11 67.7 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 N-CA-C 104.541 -2.392 . . . . 40.43 104.541 171.568 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 3' ' ' GLY . . . . . . . . . . . . . . . -125.56 165.16 18.84 Favored Glycine 0 N--CA 1.436 -1.315 0 N-CA-C 109.43 -1.468 . . . . 21.960000000000001 109.43 -176.19 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 4' ' ' GLY . . . . . . . . . . . . . . . -170.0 109.96 0.35 Allowed Glycine 0 N--CA 1.473 1.151 0 N-CA-C 110.5 -1.04 . . . . 23.52 110.5 -174.283 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 5' ' ' VAL . . . . . 1.079 ' CG1' ' CG1' ' E' ' 2' ' ' VAL . 1.1 m -127.6 134.42 65.61 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.372 0 N-CA-C 116.3 1.963 . . . . 20.300000000000001 116.3 177.881 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' G' G ' 6' ' ' VAL . . . . . 1.137 HG23 HG13 ' H' ' 6' ' ' VAL . 5.5 p -145.3 144.02 21.7 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.138 0 CA-C-O 123.055 1.407 . . . . 20.84 111.682 175.941 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' G' G ' 7' ' ' ILE . . . . . 0.774 HG21 HG12 ' F' ' 6' ' ' VAL . 45.2 mt -125.09 91.42 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 N-CA-C 103.294 -2.854 . . . . 26.890000000000001 103.294 -178.995 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' G' G ' 8' ' ' ALA . . . . . 0.416 ' HB2' HG22 ' G' ' 6' ' ' VAL . . . . . . . . 0 C--N 1.313 -0.996 0 CA-C-O 116.867 -1.539 . . . . 30.550000000000001 114.453 -163.223 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 1' ' ' MET . . . . . . . . . . . . . 2.6 ttt . . . . . 0 N--CA 1.488 1.447 0 N-CA-C 109.773 -0.454 . . . . 43.390000000000001 109.773 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 2' ' ' VAL . . . . . . . . . . . . . 1.8 t -142.16 132.68 24.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 N-CA-C 108.922 -0.77 . . . . 27.809999999999999 108.922 167.125 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 3' ' ' GLY . . . . . . . . . . . . . . . -142.59 172.99 24.14 Favored Glycine 0 N--CA 1.466 0.664 0 CA-C-O 122.264 0.924 . . . . 25.940000000000001 115.162 173.615 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 4' ' ' GLY . . . . . . . . . . . . . . . -173.05 147.46 9.69 Favored Glycine 0 N--CA 1.425 -2.087 0 N-CA-C 108.695 -1.762 . . . . 21.620000000000001 108.695 171.035 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 5' ' ' VAL . . . . . 0.694 ' CG1' HG12 ' F' ' 2' ' ' VAL . 3.2 m -126.24 156.4 36.61 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.706 0 O-C-N 124.44 0.729 . . . . 22.16 111.397 173.232 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 6' ' ' VAL . . . . . 1.137 HG13 HG23 ' G' ' 6' ' ' VAL . 11.4 p -140.49 135.13 35.17 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.391 0 CA-C-N 115.845 -0.616 . . . . 16.75 109.747 170.076 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 7' ' ' ILE . . . . . 0.434 HG12 HD12 ' G' ' 7' ' ' ILE . 46.8 mt -125.39 129.7 72.93 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 N-CA-C 106.406 -1.701 . . . . 21.98 106.406 166.493 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.483 -1.619 0 C-N-CA 119.87 -0.732 . . . . 24.760000000000002 110.184 -163.17 . . . . . . . . 0 0 . 1 stop_ save_