data_1sdb_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 1sdb _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 . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 1.584 0 N-CA-C 109.925 -1.27 . . . . 17.0 109.925 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 14.2 tt -61.94 -35.3 67.44 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.183 0 O-C-N 126.946 2.204 . . . . 16.15 113.986 -174.054 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 91.6 t -71.08 -44.64 74.7 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.105 0 C-N-CA 118.056 -1.458 . . . . 18.58 109.72 -178.153 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 49.6 mp0 -60.22 -41.05 92.27 Favored 'General case' 0 C--O 1.265 1.894 0 O-C-N 123.632 0.583 . . . . 22.53 111.137 177.91 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 10.3 mt-30 -85.7 -28.86 24.39 Favored 'General case' 0 C--O 1.249 1.03 0 C-N-CA 115.395 -2.522 . . . . 28.42 116.58 -175.395 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 82.3 m -107.72 -25.69 11.17 Favored 'General case' 0 C--O 1.244 0.803 0 O-C-N 126.654 2.471 . . . . 14.85 115.399 -173.223 -70.774 -69.306 105.039 106.85 2.138 106.348 -152.439 70.518 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 41.1 t -100.17 -55.27 2.66 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 124.36 1.037 . . . . 13.98 109.489 -177.59 175.712 58.657 96.33 108.79 2.059 113.555 -79.536 -64.228 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 77.3 m -66.35 -49.5 66.73 Favored 'General case' 0 C--O 1.248 1.019 0 C-N-CA 122.97 0.508 . . . . 17.65 111.739 176.136 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.7 t -98.07 -162.88 0.99 Allowed 'General case' 0 C--O 1.263 1.786 0 C-N-CA 126.626 1.97 . . . . 17.58 106.763 174.633 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 94.6 mt -128.2 139.27 52.35 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.583 0 N-CA-C 104.909 -2.256 . . . . 18.79 104.909 179.457 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 19.5 p -127.93 148.55 50.51 Favored 'General case' 0 N--CA 1.505 2.293 1 O-C-N 129.107 4.005 . . . . 21.75 109.949 178.273 70.518 -152.439 105.039 106.348 2.138 106.85 -69.306 -70.774 2 2 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 51.7 p -75.41 173.32 11.08 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 117.393 -1.723 . . . . 13.49 108.831 177.417 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -70.36 -22.6 62.76 Favored 'General case' 0 C--N 1.357 0.9 0 C-N-CA 117.07 -1.852 . . . . 22.68 109.638 177.366 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 31.5 m-85 -70.93 -37.02 72.86 Favored 'General case' 0 C--O 1.248 0.997 0 O-C-N 125.922 2.014 . . . . 31.96 111.206 177.047 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 53.1 mt-30 -75.17 -30.01 60.58 Favored 'General case' 0 CA--C 1.549 0.919 0 CA-C-O 117.407 -1.282 . . . . 24.36 109.677 175.731 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -70.39 -34.54 72.67 Favored 'General case' 0 N--CA 1.479 1.004 0 O-C-N 125.663 1.852 . . . . 19.4 109.504 -178.982 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 68.3 tt0 -66.25 -15.75 63.45 Favored 'General case' 0 C--O 1.277 2.521 0 CA-C-O 117.885 -1.055 . . . . 27.09 111.409 -179.972 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -61.15 -24.43 66.28 Favored 'General case' 0 C--O 1.251 1.15 0 N-CA-C 112.963 0.727 . . . . 19.28 112.963 172.683 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 98.9 m-85 -90.69 5.83 46.52 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 115.673 1.731 . . . . 19.58 115.673 -178.645 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 99.9 m -83.8 150.47 25.75 Favored 'General case' 0 C--O 1.253 1.267 0 N-CA-C 106.763 -1.569 . . . . 15.6 106.763 178.389 -65.511 -49.77 -86.216 106.129 2.103 113.476 -40.19 -67.398 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 . . . . . 0 N--CA 1.498 1.931 0 O-C-N 126.829 2.581 . . . . 26.33 109.128 174.753 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 48.0 p-10 . . . . . 0 N--CA 1.48 1.03 0 N-CA-C 108.732 -0.84 . . . . 51.54 108.732 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -131.52 179.1 6.24 Favored 'General case' 0 N--CA 1.495 1.804 0 C-N-CA 124.343 1.057 . . . . 42.3 108.328 -178.806 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 76.1 m-70 -70.67 129.01 38.03 Favored 'General case' 0 N--CA 1.488 1.425 0 C-N-CA 117.492 -1.683 . . . . 22.36 109.351 176.846 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -118.88 112.44 19.67 Favored 'General case' 0 C--O 1.244 0.803 0 C-N-CA 126.962 2.105 . . . . 22.36 107.868 178.848 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 82.8 m -131.31 153.79 49.21 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 112.588 -2.096 . . . . 12.65 111.416 -174.941 -64.228 -79.536 96.33 113.555 2.059 108.79 58.657 175.712 1 1 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 50.54 -126.65 25.12 Favored Glycine 0 C--O 1.251 1.218 0 CA-C-N 112.247 -2.251 . . . . 13.53 112.922 176.216 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 33.3 t -55.39 -38.78 69.34 Favored 'General case' 0 C--N 1.299 -1.625 0 C-N-CA 126.899 2.08 . . . . 24.88 114.583 179.861 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 43.7 m80 -66.11 -36.7 83.87 Favored 'General case' 0 C--O 1.247 0.926 0 C-N-CA 126.104 1.761 . . . . 25.14 110.834 177.108 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.53 -49.49 73.29 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-O 121.616 0.722 . . . . 15.02 109.444 175.455 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . 0.491 1.0 OUTLIER -65.02 -39.3 85.2 Favored 'Isoleucine or valine' 0 C--O 1.246 0.901 0 O-C-N 118.298 -2.751 . . . . 15.61 109.264 -177.941 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -63.58 -39.06 93.43 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 116.408 -2.117 . . . . 31.82 111.119 178.197 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.79 -34.86 76.25 Favored 'General case' 0 C--O 1.256 1.447 0 O-C-N 119.337 -2.102 . . . . 13.33 110.142 -178.753 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 14.1 mt -67.96 -38.01 82.27 Favored 'General case' 0 CA--C 1.558 1.255 0 CA-C-O 111.848 -3.93 . . . . 16.02 108.434 176.914 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 5.2 m-30 -54.93 -50.68 68.24 Favored 'General case' 0 C--N 1.292 -1.905 0 O-C-N 127.626 3.079 . . . . 31.9 109.077 176.4 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 57.5 mt -75.32 -36.37 61.08 Favored 'General case' 0 C--O 1.253 1.237 0 CA-C-O 116.174 -1.869 . . . . 16.44 112.361 -177.601 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 49.9 t -70.51 -45.73 73.33 Favored 'Isoleucine or valine' 0 C--O 1.259 1.592 0 CA-C-N 121.085 1.766 . . . . 14.45 110.525 -176.257 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 84.7 m -77.17 -35.09 56.2 Favored 'General case' 0 C--N 1.306 -1.313 0 C-N-CA 129.778 3.231 . . . . 15.33 113.929 -175.687 -67.398 -40.19 -86.216 113.476 2.103 106.129 -49.77 -65.511 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 54.81 -134.93 46.96 Favored Glycine 0 CA--C 1.539 1.57 0 N-CA-C 108.795 -1.722 . . . . 21.48 108.795 -178.954 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -61.24 -20.5 62.89 Favored 'General case' 0 C--O 1.26 1.613 0 CA-C-N 112.028 -2.086 . . . . 37.46 114.283 -178.519 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 79.6 mtm180 -62.74 -37.2 85.64 Favored 'General case' 0 C--O 1.246 0.907 0 O-C-N 118.108 -2.87 . . . . 22.16 112.519 177.281 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.05 -171.25 53.55 Favored Glycine 0 N--CA 1.488 2.132 0 C-N-CA 115.375 -3.298 . . . . 19.76 107.367 -175.292 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 16.9 p90 -146.48 129.56 16.48 Favored 'General case' 0 N--CA 1.482 1.17 0 O-C-N 119.91 -1.935 . . . . 32.43 110.503 -176.776 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 30.3 p90 . . . . . 0 C--O 1.256 1.398 0 O-C-N 126.481 2.363 . . . . 38.34 113.613 -173.841 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 1.584 0 N-CA-C 109.925 -1.27 . . . . 17.0 109.925 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 14.2 tt -61.94 -35.3 67.44 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.183 0 O-C-N 126.946 2.204 . . . . 16.15 113.986 -174.054 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 91.6 t -71.08 -44.64 74.7 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.105 0 C-N-CA 118.056 -1.458 . . . . 18.58 109.72 -178.153 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 49.6 mp0 -60.22 -41.05 92.27 Favored 'General case' 0 C--O 1.265 1.894 0 O-C-N 123.632 0.583 . . . . 22.53 111.137 177.91 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 10.3 mt-30 -85.7 -28.86 24.39 Favored 'General case' 0 C--O 1.249 1.03 0 C-N-CA 115.395 -2.522 . . . . 28.42 116.58 -175.395 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 82.3 m -107.72 -25.69 11.17 Favored 'General case' 0 C--O 1.244 0.803 0 O-C-N 126.654 2.471 . . . . 14.85 115.399 -173.223 -70.774 -69.306 105.039 106.85 2.138 106.348 -152.439 70.518 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 41.1 t -100.17 -55.27 2.66 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 124.36 1.037 . . . . 13.98 109.489 -177.59 175.712 58.657 96.33 108.79 2.059 113.555 -79.536 -64.228 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 77.3 m -66.35 -49.5 66.73 Favored 'General case' 0 C--O 1.248 1.019 0 C-N-CA 122.97 0.508 . . . . 17.65 111.739 176.136 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.7 t -98.07 -162.88 0.99 Allowed 'General case' 0 C--O 1.263 1.786 0 C-N-CA 126.626 1.97 . . . . 17.58 106.763 174.633 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 94.6 mt -128.2 139.27 52.35 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.583 0 N-CA-C 104.909 -2.256 . . . . 18.79 104.909 179.457 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 19.5 p -127.93 148.55 50.51 Favored 'General case' 0 N--CA 1.505 2.293 1 O-C-N 129.107 4.005 . . . . 21.75 109.949 178.273 70.518 -152.439 105.039 106.348 2.138 106.85 -69.306 -70.774 2 2 . 1 . 001 ecloud build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 51.7 p -75.41 173.32 11.08 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 117.393 -1.723 . . . . 13.49 108.831 177.417 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -70.36 -22.6 62.76 Favored 'General case' 0 C--N 1.357 0.9 0 C-N-CA 117.07 -1.852 . . . . 22.68 109.638 177.366 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 31.5 m-85 -70.93 -37.02 72.86 Favored 'General case' 0 C--O 1.248 0.997 0 O-C-N 125.922 2.014 . . . . 31.96 111.206 177.047 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 53.1 mt-30 -75.17 -30.01 60.58 Favored 'General case' 0 CA--C 1.549 0.919 0 CA-C-O 117.407 -1.282 . . . . 24.36 109.677 175.731 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -70.39 -34.54 72.67 Favored 'General case' 0 N--CA 1.479 1.004 0 O-C-N 125.663 1.852 . . . . 19.4 109.504 -178.982 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 68.3 tt0 -66.25 -15.75 63.45 Favored 'General case' 0 C--O 1.277 2.521 0 CA-C-O 117.885 -1.055 . . . . 27.09 111.409 -179.972 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -61.15 -24.43 66.28 Favored 'General case' 0 C--O 1.251 1.15 0 N-CA-C 112.963 0.727 . . . . 19.28 112.963 172.683 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 98.9 m-85 -90.69 5.83 46.52 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 115.673 1.731 . . . . 19.58 115.673 -178.645 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 99.9 m -83.8 150.47 25.75 Favored 'General case' 0 C--O 1.253 1.267 0 N-CA-C 106.763 -1.569 . . . . 15.6 106.763 178.389 -65.511 -49.77 -86.216 106.129 2.103 113.476 -40.19 -67.398 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 . . . . . 0 N--CA 1.498 1.931 0 O-C-N 126.829 2.581 . . . . 26.33 109.128 174.753 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 48.0 p-10 . . . . . 0 N--CA 1.48 1.03 0 N-CA-C 108.732 -0.84 . . . . 51.54 108.732 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -131.52 179.1 6.24 Favored 'General case' 0 N--CA 1.495 1.804 0 C-N-CA 124.343 1.057 . . . . 42.3 108.328 -178.806 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 76.1 m-70 -70.67 129.01 38.03 Favored 'General case' 0 N--CA 1.488 1.425 0 C-N-CA 117.492 -1.683 . . . . 22.36 109.351 176.846 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -118.88 112.44 19.67 Favored 'General case' 0 C--O 1.244 0.803 0 C-N-CA 126.962 2.105 . . . . 22.36 107.868 178.848 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 82.8 m -131.31 153.79 49.21 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 112.588 -2.096 . . . . 12.65 111.416 -174.941 -64.228 -79.536 96.33 113.555 2.059 108.79 58.657 175.712 1 1 . 1 . 001 ecloud build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 50.54 -126.65 25.12 Favored Glycine 0 C--O 1.251 1.218 0 CA-C-N 112.247 -2.251 . . . . 13.53 112.922 176.216 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 33.3 t -55.39 -38.78 69.34 Favored 'General case' 0 C--N 1.299 -1.625 0 C-N-CA 126.899 2.08 . . . . 24.88 114.583 179.861 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 43.7 m80 -66.11 -36.7 83.87 Favored 'General case' 0 C--O 1.247 0.926 0 C-N-CA 126.104 1.761 . . . . 25.14 110.834 177.108 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.53 -49.49 73.29 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-O 121.616 0.722 . . . . 15.02 109.444 175.455 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . 0.491 1.0 OUTLIER -65.02 -39.3 85.2 Favored 'Isoleucine or valine' 0 C--O 1.246 0.901 0 O-C-N 118.298 -2.751 . . . . 15.61 109.264 -177.941 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -63.58 -39.06 93.43 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 116.408 -2.117 . . . . 31.82 111.119 178.197 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.79 -34.86 76.25 Favored 'General case' 0 C--O 1.256 1.447 0 O-C-N 119.337 -2.102 . . . . 13.33 110.142 -178.753 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 14.1 mt -67.96 -38.01 82.27 Favored 'General case' 0 CA--C 1.558 1.255 0 CA-C-O 111.848 -3.93 . . . . 16.02 108.434 176.914 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 5.2 m-30 -54.93 -50.68 68.24 Favored 'General case' 0 C--N 1.292 -1.905 0 O-C-N 127.626 3.079 . . . . 31.9 109.077 176.4 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 57.5 mt -75.32 -36.37 61.08 Favored 'General case' 0 C--O 1.253 1.237 0 CA-C-O 116.174 -1.869 . . . . 16.44 112.361 -177.601 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 49.9 t -70.51 -45.73 73.33 Favored 'Isoleucine or valine' 0 C--O 1.259 1.592 0 CA-C-N 121.085 1.766 . . . . 14.45 110.525 -176.257 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 84.7 m -77.17 -35.09 56.2 Favored 'General case' 0 C--N 1.306 -1.313 0 C-N-CA 129.778 3.231 . . . . 15.33 113.929 -175.687 -67.398 -40.19 -86.216 113.476 2.103 106.129 -49.77 -65.511 1 1 . 1 . 001 ecloud build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 54.81 -134.93 46.96 Favored Glycine 0 CA--C 1.539 1.57 0 N-CA-C 108.795 -1.722 . . . . 21.48 108.795 -178.954 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -61.24 -20.5 62.89 Favored 'General case' 0 C--O 1.26 1.613 0 CA-C-N 112.028 -2.086 . . . . 37.46 114.283 -178.519 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 79.6 mtm180 -62.74 -37.2 85.64 Favored 'General case' 0 C--O 1.246 0.907 0 O-C-N 118.108 -2.87 . . . . 22.16 112.519 177.281 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.05 -171.25 53.55 Favored Glycine 0 N--CA 1.488 2.132 0 C-N-CA 115.375 -3.298 . . . . 19.76 107.367 -175.292 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 16.9 p90 -146.48 129.56 16.48 Favored 'General case' 0 N--CA 1.482 1.17 0 O-C-N 119.91 -1.935 . . . . 32.43 110.503 -176.776 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 30.3 p90 . . . . . 0 C--O 1.256 1.398 0 O-C-N 126.481 2.363 . . . . 38.34 113.613 -173.841 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 22' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 23' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 24' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 25' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 26' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 27' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 28' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 29' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 30' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 31' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 32' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 33' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 34' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 35' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 36' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 37' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 38' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 39' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 40' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 41' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 26' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 27' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 28' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 29' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 30' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 31' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 32' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 33' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 34' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 35' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 36' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 37' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 38' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 1.584 0 N-CA-C 109.925 -1.27 . . . . 17.0 109.925 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 14.2 tt -61.94 -35.3 67.44 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.183 0 O-C-N 126.946 2.204 . . . . 16.15 113.986 -174.054 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 91.6 t -71.08 -44.64 74.7 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.105 0 C-N-CA 118.056 -1.458 . . . . 18.58 109.72 -178.153 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 49.6 mp0 -60.22 -41.05 92.27 Favored 'General case' 0 C--O 1.265 1.894 0 O-C-N 123.632 0.583 . . . . 22.53 111.137 177.91 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 10.3 mt-30 -85.7 -28.86 24.39 Favored 'General case' 0 C--O 1.249 1.03 0 C-N-CA 115.395 -2.522 . . . . 28.42 116.58 -175.395 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 82.3 m -107.72 -25.69 11.17 Favored 'General case' 0 C--O 1.244 0.803 0 O-C-N 126.654 2.471 . . . . 14.85 115.399 -173.223 -70.774 -69.306 105.039 106.85 2.138 106.348 -152.439 70.518 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 41.1 t -100.17 -55.27 2.66 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 124.36 1.037 . . . . 13.98 109.489 -177.59 175.712 58.657 96.33 108.79 2.059 113.555 -79.536 -64.228 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 77.3 m -66.35 -49.5 66.73 Favored 'General case' 0 C--O 1.248 1.019 0 C-N-CA 122.97 0.508 . . . . 17.65 111.739 176.136 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.7 t -98.07 -162.88 0.99 Allowed 'General case' 0 C--O 1.263 1.786 0 C-N-CA 126.626 1.97 . . . . 17.58 106.763 174.633 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 94.6 mt -128.2 139.27 52.35 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.583 0 N-CA-C 104.909 -2.256 . . . . 18.79 104.909 179.457 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 19.5 p -127.93 148.55 50.51 Favored 'General case' 0 N--CA 1.505 2.293 1 O-C-N 129.107 4.005 . . . . 21.75 109.949 178.273 70.518 -152.439 105.039 106.348 2.138 106.85 -69.306 -70.774 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 51.7 p -75.41 173.32 11.08 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 117.393 -1.723 . . . . 13.49 108.831 177.417 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -70.36 -22.6 62.76 Favored 'General case' 0 C--N 1.357 0.9 0 C-N-CA 117.07 -1.852 . . . . 22.68 109.638 177.366 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 31.5 m-85 -70.93 -37.02 72.86 Favored 'General case' 0 C--O 1.248 0.997 0 O-C-N 125.922 2.014 . . . . 31.96 111.206 177.047 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 53.1 mt-30 -75.17 -30.01 60.58 Favored 'General case' 0 CA--C 1.549 0.919 0 CA-C-O 117.407 -1.282 . . . . 24.36 109.677 175.731 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -70.39 -34.54 72.67 Favored 'General case' 0 N--CA 1.479 1.004 0 O-C-N 125.663 1.852 . . . . 19.4 109.504 -178.982 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 68.3 tt0 -66.25 -15.75 63.45 Favored 'General case' 0 C--O 1.277 2.521 0 CA-C-O 117.885 -1.055 . . . . 27.09 111.409 -179.972 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -61.15 -24.43 66.28 Favored 'General case' 0 C--O 1.251 1.15 0 N-CA-C 112.963 0.727 . . . . 19.28 112.963 172.683 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 98.9 m-85 -90.69 5.83 46.52 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 115.673 1.731 . . . . 19.58 115.673 -178.645 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 99.9 m -83.8 150.47 25.75 Favored 'General case' 0 C--O 1.253 1.267 0 N-CA-C 106.763 -1.569 . . . . 15.6 106.763 178.389 -65.511 -49.77 -86.216 106.129 2.103 113.476 -40.19 -67.398 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 . . . . . 0 N--CA 1.498 1.931 0 O-C-N 126.829 2.581 . . . . 26.33 109.128 174.753 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 48.0 p-10 . . . . . 0 N--CA 1.48 1.03 0 N-CA-C 108.732 -0.84 . . . . 51.54 108.732 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -131.52 179.1 6.24 Favored 'General case' 0 N--CA 1.495 1.804 0 C-N-CA 124.343 1.057 . . . . 42.3 108.328 -178.806 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 76.1 m-70 -70.67 129.01 38.03 Favored 'General case' 0 N--CA 1.488 1.425 0 C-N-CA 117.492 -1.683 . . . . 22.36 109.351 176.846 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -118.88 112.44 19.67 Favored 'General case' 0 C--O 1.244 0.803 0 C-N-CA 126.962 2.105 . . . . 22.36 107.868 178.848 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 82.8 m -131.31 153.79 49.21 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 112.588 -2.096 . . . . 12.65 111.416 -174.941 -64.228 -79.536 96.33 113.555 2.059 108.79 58.657 175.712 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 50.54 -126.65 25.12 Favored Glycine 0 C--O 1.251 1.218 0 CA-C-N 112.247 -2.251 . . . . 13.53 112.922 176.216 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 33.3 t -55.39 -38.78 69.34 Favored 'General case' 0 C--N 1.299 -1.625 0 C-N-CA 126.899 2.08 . . . . 24.88 114.583 179.861 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 43.7 m80 -66.11 -36.7 83.87 Favored 'General case' 0 C--O 1.247 0.926 0 C-N-CA 126.104 1.761 . . . . 25.14 110.834 177.108 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.53 -49.49 73.29 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-O 121.616 0.722 . . . . 15.02 109.444 175.455 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . 0.491 1.0 OUTLIER -65.02 -39.3 85.2 Favored 'Isoleucine or valine' 0 C--O 1.246 0.901 0 O-C-N 118.298 -2.751 . . . . 15.61 109.264 -177.941 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -63.58 -39.06 93.43 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 116.408 -2.117 . . . . 31.82 111.119 178.197 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.79 -34.86 76.25 Favored 'General case' 0 C--O 1.256 1.447 0 O-C-N 119.337 -2.102 . . . . 13.33 110.142 -178.753 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 14.1 mt -67.96 -38.01 82.27 Favored 'General case' 0 CA--C 1.558 1.255 0 CA-C-O 111.848 -3.93 . . . . 16.02 108.434 176.914 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 5.2 m-30 -54.93 -50.68 68.24 Favored 'General case' 0 C--N 1.292 -1.905 0 O-C-N 127.626 3.079 . . . . 31.9 109.077 176.4 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 57.5 mt -75.32 -36.37 61.08 Favored 'General case' 0 C--O 1.253 1.237 0 CA-C-O 116.174 -1.869 . . . . 16.44 112.361 -177.601 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 49.9 t -70.51 -45.73 73.33 Favored 'Isoleucine or valine' 0 C--O 1.259 1.592 0 CA-C-N 121.085 1.766 . . . . 14.45 110.525 -176.257 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 84.7 m -77.17 -35.09 56.2 Favored 'General case' 0 C--N 1.306 -1.313 0 C-N-CA 129.778 3.231 . . . . 15.33 113.929 -175.687 -67.398 -40.19 -86.216 113.476 2.103 106.129 -49.77 -65.511 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 54.81 -134.93 46.96 Favored Glycine 0 CA--C 1.539 1.57 0 N-CA-C 108.795 -1.722 . . . . 21.48 108.795 -178.954 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -61.24 -20.5 62.89 Favored 'General case' 0 C--O 1.26 1.613 0 CA-C-N 112.028 -2.086 . . . . 37.46 114.283 -178.519 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 79.6 mtm180 -62.74 -37.2 85.64 Favored 'General case' 0 C--O 1.246 0.907 0 O-C-N 118.108 -2.87 . . . . 22.16 112.519 177.281 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.05 -171.25 53.55 Favored Glycine 0 N--CA 1.488 2.132 0 C-N-CA 115.375 -3.298 . . . . 19.76 107.367 -175.292 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 16.9 p90 -146.48 129.56 16.48 Favored 'General case' 0 N--CA 1.482 1.17 0 O-C-N 119.91 -1.935 . . . . 32.43 110.503 -176.776 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 30.3 p90 . . . . . 0 C--O 1.256 1.398 0 O-C-N 126.481 2.363 . . . . 38.34 113.613 -173.841 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_