data_4i5y_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 4i5y _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' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.528 4.804 0 N-CA-C 109.108 -1.597 . . . . 20.579999999999998 109.108 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 16.9 tt -63.13 -33.83 63.18 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.428 0 C-N-CA 118.739 -1.185 . . . . 14.949999999999999 113.191 -168.091 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 53.7 t -68.14 -43.12 85.25 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.849 0 C-N-CA 117.645 -1.622 . . . . 20.0 111.889 -178.879 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 23.0 mp0 -61.78 -41.85 98.25 Favored 'General case' 0 N--CA 1.483 1.204 0 N-CA-C 108.631 -0.877 . . . . 41.189999999999998 108.631 179.053 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 63.9 mm-40 -81.79 -28.72 33.04 Favored 'General case' 0 N--CA 1.485 1.321 0 N-CA-C 114.035 1.124 . . . . 16.140000000000001 114.035 -173.241 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 15.7 m -120.65 -20.49 7.05 Favored 'General case' 0 C--O 1.212 -0.884 0 N-CA-C 113.798 1.036 . . . . 13.960000000000001 113.798 -168.543 -81.876 -100.077 60.827 103.801 2.092 106.527 62.037 -160.485 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 23.5 t -104.83 -53.41 2.68 Favored 'General case' 0 C--O 1.262 1.733 0 C-N-CA 123.774 0.83 . . . . 19.149999999999999 111.467 178.477 171.883 54.286 96.851 106.543 2.04 104.637 -81.17 -64.413 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -74.26 -19.31 60.54 Favored 'General case' 0 CA--C 1.55 0.978 0 O-C-N 125.026 1.454 . . . . 15.91 110.593 178.711 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . 0.274 47.2 m -137.14 173.19 11.95 Favored 'General case' 0 C--O 1.252 1.185 0 N-CA-C 106.184 -1.784 . . . . 23.699999999999999 106.184 178.839 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 76.2 t -75.73 128.01 37.23 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 N-CA-C 108.746 -0.835 . . . . 13.890000000000001 108.746 -174.733 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 6.8 t -71.63 174.94 6.07 Favored 'General case' 0 CA--C 1.572 1.79 0 CA-C-O 121.759 0.79 . . . . 12.67 111.889 -178.421 -160.485 62.037 60.827 106.527 2.092 103.801 -100.077 -81.876 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 69.7 p -149.6 158.93 44.63 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 106.981 -1.489 . . . . 11.449999999999999 106.981 173.644 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.9 tp -65.16 -38.32 90.19 Favored 'General case' 0 C--O 1.246 0.883 0 C-N-CA 117.47 -1.692 . . . . 10.58 113.83 176.428 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 22.7 t80 -52.06 -48.32 64.69 Favored 'General case' 0 C--N 1.36 1.046 0 C-N-CA 120.487 -0.485 . . . . 30.140000000000001 111.137 176.373 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 56.1 mt-30 -72.58 -40.22 66.77 Favored 'General case' 0 N--CA 1.438 -1.051 0 N-CA-C 113.432 0.901 . . . . 21.120000000000001 113.432 -177.448 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -62.2 -42.62 99.46 Favored 'General case' 0 N--CA 1.44 -0.943 0 C-N-CA 117.288 -1.765 . . . . 20.719999999999999 113.636 175.375 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -62.71 -21.86 66.09 Favored 'General case' 0 N--CA 1.432 -1.358 0 O-C-N 120.337 -1.477 . . . . 16.829999999999998 114.903 -179.578 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 79.7 m-20 -64.67 -20.45 66.31 Favored 'General case' 0 C--N 1.311 -1.076 0 C-N-CA 119.25 -0.98 . . . . 22.0 111.798 175.814 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 94.1 m-85 -94.72 1.15 55.47 Favored 'General case' 0 C--O 1.258 1.527 0 N-CA-C 113.282 0.845 . . . . 22.43 113.282 177.455 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 64.0 m -77.38 147.25 36.18 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 108.244 -1.021 . . . . 17.809999999999999 108.244 174.644 -57.261 -47.424 -79.321 106.672 2.048 101.648 -62.286 -63.625 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 24.3 m120 . . . . . 0 N--CA 1.495 1.785 0 CA-C-O 122.587 1.184 . . . . 29.239999999999998 110.397 177.868 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 10.4 p90 . . . . . 0 N--CA 1.505 2.316 0 N-CA-C 107.526 -1.287 . . . . 23.02 107.526 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 22.8 t -83.53 -21.97 8.58 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 CA-C-O 122.224 1.011 . . . . 22.440000000000001 113.238 -174.944 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 70.3 m-80 -91.45 59.75 3.93 Favored 'General case' 0 C--N 1.313 -0.978 0 CA-C-O 122.61 1.195 . . . . 17.460000000000001 111.806 -169.259 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -155.19 177.04 11.79 Favored 'General case' 0 C--N 1.313 -1.013 0 N-CA-C 106.508 -1.664 . . . . 34.520000000000003 106.508 -177.306 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 79.4 m80 -74.93 131.95 41.07 Favored 'General case' 0 C--O 1.273 2.292 0 N-CA-C 107.437 -1.32 . . . . 19.460000000000001 107.437 171.524 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 44.6 mt -131.68 111.72 11.93 Favored 'General case' 0 C--O 1.244 0.769 0 N-CA-C 105.106 -2.183 . . . . 16.399999999999999 105.106 -174.105 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 84.7 m -123.6 149.27 45.54 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 117.982 -1.487 . . . . 20.890000000000001 111.015 -177.461 -64.413 -81.17 96.851 104.637 2.04 106.543 54.286 171.883 1 1 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 53.2 -125.74 31.93 Favored Glycine 0 N--CA 1.494 2.541 0 O-C-N 125.23 1.581 . . . . 13.09 111.989 172.372 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 95.9 p -66.09 -24.84 66.78 Favored 'General case' 0 C--N 1.36 1.028 0 CA-C-N 119.419 1.609 . . . . 13.84 110.294 -171.876 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 11.1 m170 -67.83 -34.49 76.82 Favored 'General case' 0 C--O 1.259 1.593 0 N-CA-C 113.395 0.887 . . . . 22.149999999999999 113.395 178.283 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 30.7 tp -70.93 -44.43 66.16 Favored 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 110.12 -0.326 . . . . 13.300000000000001 110.12 175.76 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 15.4 t -63.71 -38.26 81.83 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.314 0 C-N-CA 118.71 -1.196 . . . . 17.399999999999999 109.18 -179.714 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -62.69 -42.12 99.47 Favored 'General case' 0 C--O 1.251 1.168 0 C-N-CA 119.59 -0.844 . . . . 19.16 109.993 -179.616 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.38 -43.06 98.67 Favored 'General case' 0 N--CA 1.506 2.364 0 C-N-CA 119.035 -1.066 . . . . 9.0199999999999996 108.99 -179.704 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 25.0 mt -59.92 -44.04 94.53 Favored 'General case' 0 N--CA 1.519 2.98 0 CA-C-O 121.297 0.57 . . . . 11.18 110.698 177.005 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 75.3 t80 -58.17 -44.68 88.11 Favored 'General case' 0 N--CA 1.442 -0.841 0 C-N-CA 119.264 -0.974 . . . . 10.51 112.872 177.299 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 79.4 mt -73.77 -39.08 64.43 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 119.433 -0.907 . . . . 14.33 108.87 -173.82 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 2.7 t -75.82 -38.65 37.21 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.38 0 CA-C-O 118.327 -0.844 . . . . 17.350000000000001 110.024 -173.547 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 76.5 m -85.14 -24.21 28.09 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 117.82 -1.086 . . . . 16.850000000000001 112.036 -170.116 -63.625 -62.286 -79.321 101.648 2.048 106.672 -47.424 -57.261 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 55.86 -134.22 49.93 Favored Glycine 0 N--CA 1.505 3.27 0 O-C-N 124.516 1.135 . . . . 20.079999999999998 111.546 175.659 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -71.51 -10.84 60.39 Favored 'General case' 0 C--O 1.2 -1.511 0 N-CA-C 115.143 1.534 . . . . 50.380000000000003 115.143 -173.08 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 53.6 mtm180 -60.62 -34.23 73.95 Favored 'General case' 0 C--O 1.27 2.153 0 CA-C-O 122.12 0.962 . . . . 38.020000000000003 111.333 169.628 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 67.15 -170.99 32.94 Favored Glycine 0 C--O 1.276 2.729 0 C-N-CA 117.842 -2.123 . . . . 16.710000000000001 111.249 -163.604 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 47.4 p90 -163.12 170.69 17.48 Favored 'General case' 0 N--CA 1.426 -1.665 0 O-C-N 121.539 -0.977 . . . . 13.140000000000001 110.084 -169.909 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 37.1 p90 -121.16 137.29 54.74 Favored 'General case' 0 C--N 1.31 -1.13 0 C-N-CA 118.39 -1.324 . . . . 31.989999999999998 111.731 169.35 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 36.5 t80 -115.06 111.42 21.05 Favored 'General case' 0 C--O 1.268 2.036 0 N-CA-C 106.986 -1.487 . . . . 22.23 106.986 -177.464 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 70.6 p -127.92 85.11 61.46 Favored Pre-proline 0 N--CA 1.446 -0.655 0 C-N-CA 118.492 -1.283 . . . . 31.350000000000001 107.8 -174.245 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -77.3 -23.03 10.55 Favored 'Trans proline' 0 C--O 1.255 1.363 0 N-CA-C 116.997 1.884 . . . . 32.079999999999998 116.997 -171.193 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.63 -53.97 9.23 Favored 'General case' 0 N--CA 1.496 1.843 0 N-CA-C 112.957 0.725 . . . . 51.93 112.957 176.309 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.557 1.235 0 O-C-N 125.33 1.644 . . . . 55.579999999999998 112.875 171.57 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.528 4.804 0 N-CA-C 109.108 -1.597 . . . . 20.579999999999998 109.108 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 16.9 tt -63.13 -33.83 63.18 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.428 0 C-N-CA 118.739 -1.185 . . . . 14.949999999999999 113.191 -168.091 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 53.7 t -68.14 -43.12 85.25 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.849 0 C-N-CA 117.645 -1.622 . . . . 20.0 111.889 -178.879 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 23.0 mp0 -61.78 -41.85 98.25 Favored 'General case' 0 N--CA 1.483 1.204 0 N-CA-C 108.631 -0.877 . . . . 41.189999999999998 108.631 179.053 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 63.9 mm-40 -81.79 -28.72 33.04 Favored 'General case' 0 N--CA 1.485 1.321 0 N-CA-C 114.035 1.124 . . . . 16.140000000000001 114.035 -173.241 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 15.7 m -120.65 -20.49 7.05 Favored 'General case' 0 C--O 1.212 -0.884 0 N-CA-C 113.798 1.036 . . . . 13.960000000000001 113.798 -168.543 -81.876 -100.077 60.827 103.801 2.092 106.527 62.037 -160.485 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 23.5 t -104.83 -53.41 2.68 Favored 'General case' 0 C--O 1.262 1.733 0 C-N-CA 123.774 0.83 . . . . 19.149999999999999 111.467 178.477 171.883 54.286 96.851 106.543 2.04 104.637 -81.17 -64.413 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -74.26 -19.31 60.54 Favored 'General case' 0 CA--C 1.55 0.978 0 O-C-N 125.026 1.454 . . . . 15.91 110.593 178.711 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . 0.274 47.2 m -137.14 173.19 11.95 Favored 'General case' 0 C--O 1.252 1.185 0 N-CA-C 106.184 -1.784 . . . . 23.699999999999999 106.184 178.839 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 76.2 t -75.73 128.01 37.23 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 N-CA-C 108.746 -0.835 . . . . 13.890000000000001 108.746 -174.733 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 6.8 t -71.63 174.94 6.07 Favored 'General case' 0 CA--C 1.572 1.79 0 CA-C-O 121.759 0.79 . . . . 12.67 111.889 -178.421 -160.485 62.037 60.827 106.527 2.092 103.801 -100.077 -81.876 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 69.7 p -149.6 158.93 44.63 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 106.981 -1.489 . . . . 11.449999999999999 106.981 173.644 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.9 tp -65.16 -38.32 90.19 Favored 'General case' 0 C--O 1.246 0.883 0 C-N-CA 117.47 -1.692 . . . . 10.58 113.83 176.428 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 22.7 t80 -52.06 -48.32 64.69 Favored 'General case' 0 C--N 1.36 1.046 0 C-N-CA 120.487 -0.485 . . . . 30.140000000000001 111.137 176.373 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 56.1 mt-30 -72.58 -40.22 66.77 Favored 'General case' 0 N--CA 1.438 -1.051 0 N-CA-C 113.432 0.901 . . . . 21.120000000000001 113.432 -177.448 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' LEU . . . . . 0.427 HD22 HG13 ' B' ' 2' ' ' VAL . 0.7 OUTLIER -62.2 -42.62 99.46 Favored 'General case' 0 N--CA 1.44 -0.943 0 C-N-CA 117.288 -1.765 . . . . 20.719999999999999 113.636 175.375 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -62.71 -21.86 66.09 Favored 'General case' 0 N--CA 1.432 -1.358 0 O-C-N 120.337 -1.477 . . . . 16.829999999999998 114.903 -179.578 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 79.7 m-20 -64.67 -20.45 66.31 Favored 'General case' 0 C--N 1.311 -1.076 0 C-N-CA 119.25 -0.98 . . . . 22.0 111.798 175.814 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 94.1 m-85 -94.72 1.15 55.47 Favored 'General case' 0 C--O 1.258 1.527 0 N-CA-C 113.282 0.845 . . . . 22.43 113.282 177.455 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 64.0 m -77.38 147.25 36.18 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 108.244 -1.021 . . . . 17.809999999999999 108.244 174.644 -57.261 -47.424 -79.321 106.672 2.048 101.648 -62.286 -63.625 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 . . . . . 0 N--CA 1.495 1.785 0 CA-C-O 122.587 1.184 . . . . 29.239999999999998 110.397 177.868 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 10.4 p90 . . . . . 0 N--CA 1.505 2.316 0 N-CA-C 107.526 -1.287 . . . . 23.02 107.526 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 2' ' ' VAL . . . . . 0.427 HG13 HD22 ' A' ' 16' ' ' LEU . 22.8 t -83.53 -21.97 8.58 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 CA-C-O 122.224 1.011 . . . . 22.440000000000001 113.238 -174.944 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 70.3 m-80 -91.45 59.75 3.93 Favored 'General case' 0 C--N 1.313 -0.978 0 CA-C-O 122.61 1.195 . . . . 17.460000000000001 111.806 -169.259 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 29.2 pt20 -155.19 177.04 11.79 Favored 'General case' 0 C--N 1.313 -1.013 0 N-CA-C 106.508 -1.664 . . . . 34.520000000000003 106.508 -177.306 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 79.4 m80 -74.93 131.95 41.07 Favored 'General case' 0 C--O 1.273 2.292 0 N-CA-C 107.437 -1.32 . . . . 19.460000000000001 107.437 171.524 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 44.6 mt -131.68 111.72 11.93 Favored 'General case' 0 C--O 1.244 0.769 0 N-CA-C 105.106 -2.183 . . . . 16.399999999999999 105.106 -174.105 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 84.7 m -123.6 149.27 45.54 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 117.982 -1.487 . . . . 20.890000000000001 111.015 -177.461 -64.413 -81.17 96.851 104.637 2.04 106.543 54.286 171.883 1 1 . 1 . 001 ecloud build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 53.2 -125.74 31.93 Favored Glycine 0 N--CA 1.494 2.541 0 O-C-N 125.23 1.581 . . . . 13.09 111.989 172.372 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 95.9 p -66.09 -24.84 66.78 Favored 'General case' 0 C--N 1.36 1.028 0 CA-C-N 119.419 1.609 . . . . 13.84 110.294 -171.876 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 11.1 m170 -67.83 -34.49 76.82 Favored 'General case' 0 C--O 1.259 1.593 0 N-CA-C 113.395 0.887 . . . . 22.149999999999999 113.395 178.283 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 30.7 tp -70.93 -44.43 66.16 Favored 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 110.12 -0.326 . . . . 13.300000000000001 110.12 175.76 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 15.4 t -63.71 -38.26 81.83 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.314 0 C-N-CA 118.71 -1.196 . . . . 17.399999999999999 109.18 -179.714 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -62.69 -42.12 99.47 Favored 'General case' 0 C--O 1.251 1.168 0 C-N-CA 119.59 -0.844 . . . . 19.16 109.993 -179.616 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.38 -43.06 98.67 Favored 'General case' 0 N--CA 1.506 2.364 0 C-N-CA 119.035 -1.066 . . . . 9.0199999999999996 108.99 -179.704 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 25.0 mt -59.92 -44.04 94.53 Favored 'General case' 0 N--CA 1.519 2.98 0 CA-C-O 121.297 0.57 . . . . 11.18 110.698 177.005 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 75.3 t80 -58.17 -44.68 88.11 Favored 'General case' 0 N--CA 1.442 -0.841 0 C-N-CA 119.264 -0.974 . . . . 10.51 112.872 177.299 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 79.4 mt -73.77 -39.08 64.43 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 119.433 -0.907 . . . . 14.33 108.87 -173.82 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 2.7 t -75.82 -38.65 37.21 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.38 0 CA-C-O 118.327 -0.844 . . . . 17.350000000000001 110.024 -173.547 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 76.5 m -85.14 -24.21 28.09 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 117.82 -1.086 . . . . 16.850000000000001 112.036 -170.116 -63.625 -62.286 -79.321 101.648 2.048 106.672 -47.424 -57.261 1 1 . 1 . 001 ecloud build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 55.86 -134.22 49.93 Favored Glycine 0 N--CA 1.505 3.27 0 O-C-N 124.516 1.135 . . . . 20.079999999999998 111.546 175.659 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -71.51 -10.84 60.39 Favored 'General case' 0 C--O 1.2 -1.511 0 N-CA-C 115.143 1.534 . . . . 50.380000000000003 115.143 -173.08 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 53.6 mtm180 -60.62 -34.23 73.95 Favored 'General case' 0 C--O 1.27 2.153 0 CA-C-O 122.12 0.962 . . . . 38.020000000000003 111.333 169.628 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 67.15 -170.99 32.94 Favored Glycine 0 C--O 1.276 2.729 0 C-N-CA 117.842 -2.123 . . . . 16.710000000000001 111.249 -163.604 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 47.4 p90 -163.12 170.69 17.48 Favored 'General case' 0 N--CA 1.426 -1.665 0 O-C-N 121.539 -0.977 . . . . 13.140000000000001 110.084 -169.909 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 37.1 p90 -121.16 137.29 54.74 Favored 'General case' 0 C--N 1.31 -1.13 0 C-N-CA 118.39 -1.324 . . . . 31.989999999999998 111.731 169.35 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 36.5 t80 -115.06 111.42 21.05 Favored 'General case' 0 C--O 1.268 2.036 0 N-CA-C 106.986 -1.487 . . . . 22.23 106.986 -177.464 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 70.6 p -127.92 85.11 61.46 Favored Pre-proline 0 N--CA 1.446 -0.655 0 C-N-CA 118.492 -1.283 . . . . 31.350000000000001 107.8 -174.245 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -77.3 -23.03 10.55 Favored 'Trans proline' 0 C--O 1.255 1.363 0 N-CA-C 116.997 1.884 . . . . 32.079999999999998 116.997 -171.193 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 29' ' ' LYS . . . . . 0.402 ' HA ' ' HE3' ' B' ' 29' ' ' LYS . 0.0 OUTLIER -73.63 -53.97 9.23 Favored 'General case' 0 N--CA 1.496 1.843 0 N-CA-C 112.957 0.725 . . . . 51.93 112.957 176.309 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.557 1.235 0 O-C-N 125.33 1.644 . . . . 55.579999999999998 112.875 171.57 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 1 N--CA 1.528 4.804 0 N-CA-C 109.108 -1.597 . . . . 20.579999999999998 109.108 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 16.9 tt -63.13 -33.83 63.18 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.428 0 C-N-CA 118.739 -1.185 . . . . 14.949999999999999 113.191 -168.091 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 53.7 t -68.14 -43.12 85.25 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.849 0 C-N-CA 117.645 -1.622 . . . . 20.0 111.889 -178.879 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 23.0 mp0 -61.78 -41.85 98.25 Favored 'General case' 0 N--CA 1.483 1.204 0 N-CA-C 108.631 -0.877 . . . . 41.189999999999998 108.631 179.053 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 63.9 mm-40 -81.79 -28.72 33.04 Favored 'General case' 0 N--CA 1.485 1.321 0 N-CA-C 114.035 1.124 . . . . 16.140000000000001 114.035 -173.241 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 15.7 m -120.65 -20.49 7.05 Favored 'General case' 0 C--O 1.212 -0.884 0 N-CA-C 113.798 1.036 . . . . 13.960000000000001 113.798 -168.543 -81.876 -100.077 60.827 103.801 2.092 106.527 62.037 -160.485 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 23.5 t -104.83 -53.41 2.68 Favored 'General case' 0 C--O 1.262 1.733 0 C-N-CA 123.774 0.83 . . . . 19.149999999999999 111.467 178.477 171.883 54.286 96.851 106.543 2.04 104.637 -81.17 -64.413 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -74.26 -19.31 60.54 Favored 'General case' 0 CA--C 1.55 0.978 0 O-C-N 125.026 1.454 . . . . 15.91 110.593 178.711 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . 0.274 47.2 m -137.14 173.19 11.95 Favored 'General case' 0 C--O 1.252 1.185 0 N-CA-C 106.184 -1.784 . . . . 23.699999999999999 106.184 178.839 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 76.2 t -75.73 128.01 37.23 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 N-CA-C 108.746 -0.835 . . . . 13.890000000000001 108.746 -174.733 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 6.8 t -71.63 174.94 6.07 Favored 'General case' 0 CA--C 1.572 1.79 0 CA-C-O 121.759 0.79 . . . . 12.67 111.889 -178.421 -160.485 62.037 60.827 106.527 2.092 103.801 -100.077 -81.876 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 69.7 p -149.6 158.93 44.63 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 106.981 -1.489 . . . . 11.449999999999999 106.981 173.644 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.9 tp -65.16 -38.32 90.19 Favored 'General case' 0 C--O 1.246 0.883 0 C-N-CA 117.47 -1.692 . . . . 10.58 113.83 176.428 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 22.7 t80 -52.06 -48.32 64.69 Favored 'General case' 0 C--N 1.36 1.046 0 C-N-CA 120.487 -0.485 . . . . 30.140000000000001 111.137 176.373 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 56.1 mt-30 -72.58 -40.22 66.77 Favored 'General case' 0 N--CA 1.438 -1.051 0 N-CA-C 113.432 0.901 . . . . 21.120000000000001 113.432 -177.448 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.427 HD22 HG13 ' B' ' 2' ' ' VAL . 0.7 OUTLIER -62.2 -42.62 99.46 Favored 'General case' 0 N--CA 1.44 -0.943 0 C-N-CA 117.288 -1.765 . . . . 20.719999999999999 113.636 175.375 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -62.71 -21.86 66.09 Favored 'General case' 0 N--CA 1.432 -1.358 0 O-C-N 120.337 -1.477 . . . . 16.829999999999998 114.903 -179.578 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 79.7 m-20 -64.67 -20.45 66.31 Favored 'General case' 0 C--N 1.311 -1.076 0 C-N-CA 119.25 -0.98 . . . . 22.0 111.798 175.814 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 94.1 m-85 -94.72 1.15 55.47 Favored 'General case' 0 C--O 1.258 1.527 0 N-CA-C 113.282 0.845 . . . . 22.43 113.282 177.455 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 64.0 m -77.38 147.25 36.18 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 108.244 -1.021 . . . . 17.809999999999999 108.244 174.644 -57.261 -47.424 -79.321 106.672 2.048 101.648 -62.286 -63.625 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 24.3 m120 . . . . . 0 N--CA 1.495 1.785 0 CA-C-O 122.587 1.184 . . . . 29.239999999999998 110.397 177.868 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 10.4 p90 . . . . . 0 N--CA 1.505 2.316 0 N-CA-C 107.526 -1.287 . . . . 23.02 107.526 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 2' ' ' VAL . . . . . 0.427 HG13 HD22 ' A' ' 16' ' ' LEU . 22.8 t -83.53 -21.97 8.58 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 CA-C-O 122.224 1.011 . . . . 22.440000000000001 113.238 -174.944 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 70.3 m-80 -91.45 59.75 3.93 Favored 'General case' 0 C--N 1.313 -0.978 0 CA-C-O 122.61 1.195 . . . . 17.460000000000001 111.806 -169.259 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -155.19 177.04 11.79 Favored 'General case' 0 C--N 1.313 -1.013 0 N-CA-C 106.508 -1.664 . . . . 34.520000000000003 106.508 -177.306 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 79.4 m80 -74.93 131.95 41.07 Favored 'General case' 0 C--O 1.273 2.292 0 N-CA-C 107.437 -1.32 . . . . 19.460000000000001 107.437 171.524 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 44.6 mt -131.68 111.72 11.93 Favored 'General case' 0 C--O 1.244 0.769 0 N-CA-C 105.106 -2.183 . . . . 16.399999999999999 105.106 -174.105 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 84.7 m -123.6 149.27 45.54 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 117.982 -1.487 . . . . 20.890000000000001 111.015 -177.461 -64.413 -81.17 96.851 104.637 2.04 106.543 54.286 171.883 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 53.2 -125.74 31.93 Favored Glycine 0 N--CA 1.494 2.541 0 O-C-N 125.23 1.581 . . . . 13.09 111.989 172.372 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 95.9 p -66.09 -24.84 66.78 Favored 'General case' 0 C--N 1.36 1.028 0 CA-C-N 119.419 1.609 . . . . 13.84 110.294 -171.876 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 11.1 m170 -67.83 -34.49 76.82 Favored 'General case' 0 C--O 1.259 1.593 0 N-CA-C 113.395 0.887 . . . . 22.149999999999999 113.395 178.283 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 30.7 tp -70.93 -44.43 66.16 Favored 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 110.12 -0.326 . . . . 13.300000000000001 110.12 175.76 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 15.4 t -63.71 -38.26 81.83 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.314 0 C-N-CA 118.71 -1.196 . . . . 17.399999999999999 109.18 -179.714 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -62.69 -42.12 99.47 Favored 'General case' 0 C--O 1.251 1.168 0 C-N-CA 119.59 -0.844 . . . . 19.16 109.993 -179.616 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.38 -43.06 98.67 Favored 'General case' 0 N--CA 1.506 2.364 0 C-N-CA 119.035 -1.066 . . . . 9.0199999999999996 108.99 -179.704 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 25.0 mt -59.92 -44.04 94.53 Favored 'General case' 0 N--CA 1.519 2.98 0 CA-C-O 121.297 0.57 . . . . 11.18 110.698 177.005 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 75.3 t80 -58.17 -44.68 88.11 Favored 'General case' 0 N--CA 1.442 -0.841 0 C-N-CA 119.264 -0.974 . . . . 10.51 112.872 177.299 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 79.4 mt -73.77 -39.08 64.43 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 119.433 -0.907 . . . . 14.33 108.87 -173.82 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 2.7 t -75.82 -38.65 37.21 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.38 0 CA-C-O 118.327 -0.844 . . . . 17.350000000000001 110.024 -173.547 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 76.5 m -85.14 -24.21 28.09 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 117.82 -1.086 . . . . 16.850000000000001 112.036 -170.116 -63.625 -62.286 -79.321 101.648 2.048 106.672 -47.424 -57.261 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 55.86 -134.22 49.93 Favored Glycine 0 N--CA 1.505 3.27 0 O-C-N 124.516 1.135 . . . . 20.079999999999998 111.546 175.659 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -71.51 -10.84 60.39 Favored 'General case' 0 C--O 1.2 -1.511 0 N-CA-C 115.143 1.534 . . . . 50.380000000000003 115.143 -173.08 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 53.6 mtm180 -60.62 -34.23 73.95 Favored 'General case' 0 C--O 1.27 2.153 0 CA-C-O 122.12 0.962 . . . . 38.020000000000003 111.333 169.628 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 67.15 -170.99 32.94 Favored Glycine 0 C--O 1.276 2.729 0 C-N-CA 117.842 -2.123 . . . . 16.710000000000001 111.249 -163.604 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 47.4 p90 -163.12 170.69 17.48 Favored 'General case' 0 N--CA 1.426 -1.665 0 O-C-N 121.539 -0.977 . . . . 13.140000000000001 110.084 -169.909 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 37.1 p90 -121.16 137.29 54.74 Favored 'General case' 0 C--N 1.31 -1.13 0 C-N-CA 118.39 -1.324 . . . . 31.989999999999998 111.731 169.35 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 36.5 t80 -115.06 111.42 21.05 Favored 'General case' 0 C--O 1.268 2.036 0 N-CA-C 106.986 -1.487 . . . . 22.23 106.986 -177.464 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 70.6 p -127.92 85.11 61.46 Favored Pre-proline 0 N--CA 1.446 -0.655 0 C-N-CA 118.492 -1.283 . . . . 31.350000000000001 107.8 -174.245 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -77.3 -23.03 10.55 Favored 'Trans proline' 0 C--O 1.255 1.363 0 N-CA-C 116.997 1.884 . . . . 32.079999999999998 116.997 -171.193 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' LYS . . . . . 0.402 ' HA ' ' HE3' ' B' ' 29' ' ' LYS . 0.0 OUTLIER -73.63 -53.97 9.23 Favored 'General case' 0 N--CA 1.496 1.843 0 N-CA-C 112.957 0.725 . . . . 51.93 112.957 176.309 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.557 1.235 0 O-C-N 125.33 1.644 . . . . 55.579999999999998 112.875 171.57 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_