data_2o2w_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 2o2w _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 ' 818' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 1.501 0 N-CA-C 114.659 0.624 . . . . 26.210000000000001 114.659 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 819' ' ' ILE . . . . . . . . . . . . . 53.1 mt -60.55 -42.55 91.9 Favored 'Isoleucine or valine' 0 C--O 1.245 0.846 0 C-N-CA 125.421 1.488 . . . . 26.210000000000001 110.597 175.661 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 820' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -75.11 126.14 88.37 Favored Pre-proline 0 CA--C 1.536 0.442 0 CA-C-N 112.962 -1.926 . . . . 26.210000000000001 109.863 -179.624 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 821' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -64.13 -19.1 65.72 Favored 'Trans proline' 0 CA--C 1.55 1.28 0 C-N-CA 122.697 2.265 . . . . 26.210000000000001 117.325 -176.942 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 822' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -68.38 -21.58 64.7 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 120.359 -1.463 . . . . 26.210000000000001 113.95 -177.275 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 823' ' ' THR . . . . . . . . . . . . . 71.5 p -73.72 140.71 46.17 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 124.844 1.257 . . . . 26.210000000000001 114.197 178.117 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 824' ' ' GLY . . . . . . . . . . . . . . . -101.93 155.54 18.73 Favored Glycine 0 C--O 1.217 -0.95 0 N-CA-C 116.747 1.459 . . . . 26.210000000000001 116.747 171.418 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 825' ' ' GLU . . . . . . . . . . . . . 34.1 mm-40 -109.92 130.97 55.46 Favored 'General case' 0 C--O 1.24 0.56 0 CA-C-O 122.013 0.911 . . . . 26.210000000000001 111.274 -178.366 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 826' ' ' ALA . . . . . . . . . . . . . . . -134.34 150.76 50.96 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 113.95 -1.477 . . . . 26.210000000000001 111.978 -178.572 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 827' ' ' ILE . . . . . . . . . . . . . 32.0 mt -113.94 144.94 20.48 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 CA-C-O 124.376 2.036 . . . . 26.210000000000001 112.72 169.233 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 828' ' ' ALA . . . . . . . . . . . . . . . -70.19 130.98 43.5 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.165 -1.38 . . . . 26.210000000000001 110.813 175.486 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 829' ' ' LYS . . . . . . . . . . . . . 52.1 tttt -97.9 -41.59 7.95 Favored 'General case' 0 N--CA 1.439 -1.018 0 N-CA-C 106.364 -1.717 . . . . 26.210000000000001 106.364 -179.781 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 830' ' ' PHE . . . . . . . . . . . . . 36.3 m-85 -132.28 159.15 39.95 Favored 'General case' 0 C--O 1.242 0.692 0 C-N-CA 125.157 1.383 . . . . 26.210000000000001 111.557 -178.795 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 831' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -75.1 112.62 11.54 Favored 'General case' 0 C--N 1.354 0.771 0 C-N-CA 122.557 0.343 . . . . 26.210000000000001 110.702 177.296 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 832' ' ' PHE . . . . . . . . . . . . . 78.7 t80 -102.11 126.6 49.1 Favored 'General case' 0 C--O 1.238 0.495 0 N-CA-C 114.28 1.215 . . . . 26.210000000000001 114.28 -178.453 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 833' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -104.88 125.25 50.71 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-O 123.787 1.756 . . . . 26.210000000000001 107.078 170.412 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 834' ' ' GLY . . . . . . . . . . . . . . . -79.99 146.98 28.59 Favored Glycine 0 C--N 1.341 0.839 0 O-C-N 120.668 -1.27 . . . . 26.210000000000001 110.9 169.937 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 835' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -107.95 -12.71 15.11 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 113.748 1.018 . . . . 26.210000000000001 113.748 -177.913 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 836' ' ' THR . . . . . . . . . . . . . 33.9 p -114.27 164.76 13.46 Favored 'General case' 0 C--N 1.345 0.397 0 CA-C-O 122.19 0.995 . . . . 26.210000000000001 109.444 172.226 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 837' ' ' GLN . . . . . . . . . . . . . 39.4 tt0 -60.12 -30.87 69.57 Favored 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 125.034 1.334 . . . . 26.210000000000001 111.907 177.392 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 838' ' ' VAL . . . . . . . . . . . . . 21.5 t -74.01 -27.04 21.71 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.934 0 C-N-CA 125.586 1.554 . . . . 26.210000000000001 114.227 -178.117 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 839' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -84.14 137.88 33.3 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 114.935 1.457 . . . . 26.210000000000001 114.935 -179.193 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 65.9 ttp -93.0 125.76 37.76 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.321 -0.854 . . . . 26.210000000000001 111.643 -179.504 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 841' ' ' SER . . . . . . . . . . . . . 66.6 m -102.43 142.31 33.84 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.81 1.244 . . . . 26.210000000000001 113.055 -178.038 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 842' ' ' PHE . . . . . . . . . . . . . 10.9 p90 -152.12 173.31 15.08 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 117.044 2.238 . . . . 26.210000000000001 117.044 -176.705 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 843' ' ' ARG . . . . . . . . . . . . . 18.7 mmt180 -96.39 162.11 13.63 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 127.239 2.216 . . . . 26.210000000000001 113.153 167.694 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 844' ' ' LYS . . . . . . . . . . . . . 2.3 pttt -80.79 144.46 32.09 Favored 'General case' 0 C--N 1.355 0.848 0 O-C-N 121.307 -0.87 . . . . 26.210000000000001 111.717 -179.879 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . 91.97 14.02 56.92 Favored Glycine 0 C--O 1.223 -0.539 0 CA-C-N 115.439 -0.8 . . . . 26.210000000000001 111.577 -177.692 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 846' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -92.29 133.7 35.59 Favored 'General case' 0 C--O 1.22 -0.46 0 N-CA-C 114.863 1.431 . . . . 26.210000000000001 114.863 176.595 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 847' ' ' ARG . . . . . . . . . . . . . 61.3 ttt180 -84.45 108.52 17.3 Favored 'General case' 0 C--O 1.243 0.712 0 CA-C-O 123.06 1.409 . . . . 26.210000000000001 110.859 177.088 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 848' ' ' ILE . . . . . . . . . . . . . 89.2 mt -103.29 138.31 28.13 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 CA-C-N 113.126 -1.852 . . . . 26.210000000000001 108.429 175.94 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 849' ' ' THR . . . . . . . . . . . . . 88.7 m -91.86 138.15 31.78 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 107.224 -1.399 . . . . 26.210000000000001 107.224 168.343 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 850' ' ' LEU . . . . . . . . . . . . 0.298 88.7 mt -99.41 121.02 40.54 Favored 'General case' 0 N--CA 1.443 -0.818 0 CA-C-N 113.771 -1.559 . . . . 26.210000000000001 107.433 -177.227 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 851' ' ' LEU . . . . . . . . . . . . . 34.8 mt -76.54 -55.63 5.35 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 114.596 -2.621 . . . . 26.210000000000001 114.228 174.163 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 852' ' ' ARG . . . . . . . . . . . . . 18.9 ttt85 -157.35 157.24 33.73 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 128.017 3.323 . . . . 26.210000000000001 110.511 -177.133 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 853' ' ' GLN . . . . . . . . . . . . . 55.6 tt0 -93.05 120.09 32.99 Favored 'General case' 0 C--O 1.218 -0.602 0 CA-C-O 126.099 2.857 . . . . 26.210000000000001 105.274 169.02 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 854' ' ' VAL . . . . . . . . . . . . 0.272 3.0 m -82.23 -34.64 12.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 O-C-N 116.979 -3.575 . . . . 26.210000000000001 114.88 -177.846 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 855' ' ' ASP . . . . . . . . . . . . . 37.4 p-10 -154.49 -159.91 1.01 Allowed 'General case' 0 CA--C 1.576 1.946 0 N-CA-C 106.394 -1.706 . . . . 26.210000000000001 106.394 172.205 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 856' ' ' GLU . . . . . . . . . . . . . 18.3 pt-20 -59.24 -25.98 64.5 Favored 'General case' 0 N--CA 1.438 -1.044 0 N-CA-C 117.075 2.25 . . . . 26.210000000000001 117.075 170.386 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 857' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -111.86 -14.51 13.52 Favored 'General case' 0 C--O 1.223 -0.303 0 N-CA-C 119.384 3.105 . . . . 26.210000000000001 119.384 -177.108 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 858' ' ' TRP . . . . . . . . . . . . 0.357 86.0 m95 -137.75 160.81 38.21 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 118.448 -1.301 . . . . 26.210000000000001 111.464 -176.022 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 859' ' ' TYR . . . . . . . . . . . . . 17.2 m-85 -119.21 157.07 28.73 Favored 'General case' 0 N--CA 1.432 -1.368 0 N-CA-C 105.528 -2.027 . . . . 26.210000000000001 105.528 167.237 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 860' ' ' GLU . . . . . . . . . . . . . 53.1 tt0 -92.52 133.05 36.31 Favored 'General case' 0 N--CA 1.438 -1.029 0 N-CA-C 103.25 -2.87 . . . . 26.210000000000001 103.25 166.881 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 861' ' ' GLY . . . . . . . . . . . . . . . -147.96 174.68 27.6 Favored Glycine 0 C--O 1.239 0.465 0 O-C-N 119.026 -2.296 . . . . 26.210000000000001 113.4 178.503 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 862' ' ' ARG . . . . . . . . . . . . . 19.7 ptt85 -146.04 172.84 12.81 Favored 'General case' 0 CA--C 1.533 0.298 0 O-C-N 126.275 1.809 . . . . 26.210000000000001 110.328 170.142 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 863' ' ' ILE . . . . . . . . . . . . 0.296 61.1 mt -109.54 141.41 23.55 Favored Pre-proline 0 CA--C 1.542 0.64 0 N-CA-C 108.65 -0.87 . . . . 26.210000000000001 108.65 173.694 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 864' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_exo -66.02 119.28 6.29 Favored 'Trans proline' 0 C--N 1.364 1.346 0 C-N-CA 121.537 1.491 . . . . 26.210000000000001 114.092 -178.82 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 865' ' ' GLY . . . . . . . . . . . . . . . 72.26 18.29 78.01 Favored Glycine 0 CA--C 1.532 1.097 0 CA-C-O 125.253 2.585 . . . . 26.210000000000001 115.104 -178.668 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 866' ' ' THR . . . . . . . . . . . . . 44.2 p -112.79 164.67 13.11 Favored 'General case' 0 N--CA 1.472 0.634 0 O-C-N 117.868 -3.136 . . . . 26.210000000000001 108.543 169.952 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 867' ' ' SER . . . . . . . . . . . . . 75.8 m -80.45 -14.13 58.54 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 121.612 -0.68 . . . . 26.210000000000001 111.2 171.961 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 868' ' ' ARG . . . . . . . . . . . . . 47.5 mtm180 -69.29 112.98 6.21 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 118.813 2.894 . . . . 26.210000000000001 118.813 -176.937 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 869' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -137.7 150.37 47.26 Favored 'General case' 0 N--CA 1.435 -1.18 0 O-C-N 127.822 3.201 . . . . 26.210000000000001 110.539 -179.926 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 870' ' ' GLY . . . . . . . . . . . . . . . 171.72 -162.33 34.68 Favored Glycine 0 C--O 1.228 -0.246 0 CA-C-O 116.966 -2.019 . . . . 26.210000000000001 111.36 -178.294 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 871' ' ' ILE . . . . . . . . . . . . . 48.5 pt -113.19 147.86 16.52 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.286 0 O-C-N 128.388 3.052 . . . . 26.210000000000001 109.37 168.283 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 872' ' ' PHE . . . . . . . . . . . . . 51.4 p90 -141.3 161.18 54.32 Favored Pre-proline 0 C--O 1.218 -0.595 0 C-N-CA 124.201 1.0 . . . . 26.210000000000001 111.359 179.58 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 873' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -72.41 141.32 34.94 Favored 'Trans proline' 0 C--O 1.212 -0.814 0 O-C-N 118.736 -1.244 . . . . 26.210000000000001 110.575 -179.54 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 874' ' ' ILE . . . . . . . . . . . . . 13.3 tt -59.24 -38.69 75.94 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.336 0 N-CA-C 107.27 -1.382 . . . . 26.210000000000001 107.27 179.422 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 875' ' ' THR . . . . . . . . . . . . . 28.2 m -56.29 -41.44 75.91 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 126.962 2.105 . . . . 26.210000000000001 116.649 -177.238 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 876' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -71.37 -18.85 62.34 Favored 'General case' 0 C--N 1.306 -1.296 0 N-CA-C 115.746 1.758 . . . . 26.210000000000001 115.746 -176.845 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 877' ' ' VAL . . . . . . . . . . . . . 1.9 p -114.7 141.23 31.98 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.058 0 N-CA-C 117.514 2.413 . . . . 26.210000000000001 117.514 -177.405 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 878' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -88.15 112.07 22.31 Favored 'General case' 0 C--N 1.35 0.613 0 CA-C-O 123.036 1.398 . . . . 26.210000000000001 108.928 168.079 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 879' ' ' VAL . . . . . . . . . . . . . 44.4 t -87.35 113.56 24.96 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 O-C-N 119.171 -2.205 . . . . 26.210000000000001 113.267 172.988 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 880' ' ' ILE . . . . . . . . . . . . . 2.9 mp -74.0 -62.82 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.351 0.67 0 N-CA-C 115.338 1.607 . . . . 26.210000000000001 115.338 168.619 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 881' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -119.04 146.56 44.95 Favored 'General case' 0 CA--C 1.497 -1.06 0 N-CA-C 102.499 -3.149 . . . . 26.210000000000001 102.499 -179.201 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 882' ' ' ARG . . . . . 0.422 ' N ' ' O ' ' A' ' 910' ' ' HOH 0.39 5.7 ptt-85 -114.07 163.31 19.3 Favored Pre-proline 0 C--N 1.322 -0.621 0 N-CA-C 116.951 2.204 . . . . 26.210000000000001 116.951 -177.754 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 883' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_exo -65.6 138.5 54.54 Favored 'Trans proline' 0 CA--C 1.513 -0.57 0 C-N-CA 122.882 2.388 . . . . 26.210000000000001 111.828 174.131 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 884' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.251 1.155 0 O-C-N 126.397 2.311 . . . . 26.210000000000001 111.783 -178.026 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 885' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 886' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 887' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 888' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 889' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 890' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 891' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 892' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 893' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 894' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 895' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 896' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 897' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 898' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 899' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 900' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 901' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 902' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 903' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 904' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 905' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 906' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 907' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 908' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 909' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 910' ' ' HOH . . . . . 0.422 ' O ' ' N ' ' A' ' 882' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 911' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 912' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 913' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 914' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 915' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 916' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 917' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 918' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 919' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 920' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 818' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 1.501 0 N-CA-C 114.659 0.624 . . . . 26.210000000000001 114.659 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 819' ' ' ILE . . . . . . . . . . . . . 53.1 mt -60.55 -42.55 91.9 Favored 'Isoleucine or valine' 0 C--O 1.245 0.846 0 C-N-CA 125.421 1.488 . . . . 26.210000000000001 110.597 175.661 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 820' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -75.11 126.14 88.37 Favored Pre-proline 0 CA--C 1.536 0.442 0 CA-C-N 112.962 -1.926 . . . . 26.210000000000001 109.863 -179.624 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 821' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -64.13 -19.1 65.72 Favored 'Trans proline' 0 CA--C 1.55 1.28 0 C-N-CA 122.697 2.265 . . . . 26.210000000000001 117.325 -176.942 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 822' ' ' PHE . . . . . 0.564 ' O ' ' HA ' ' A' ' 883' ' ' PRO . 0.8 OUTLIER -68.38 -21.58 64.7 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 120.359 -1.463 . . . . 26.210000000000001 113.95 -177.275 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 823' ' ' THR . . . . . . . . . . . . . 71.5 p -73.72 140.71 46.17 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 124.844 1.257 . . . . 26.210000000000001 114.197 178.117 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 824' ' ' GLY . . . . . 0.47 ' HA2' ' HG3' ' A' ' 881' ' ' LYS . . . -101.93 155.54 18.73 Favored Glycine 0 C--O 1.217 -0.95 0 N-CA-C 116.747 1.459 . . . . 26.210000000000001 116.747 171.418 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 825' ' ' GLU . . . . . 0.418 ' HA ' ' OE2' ' A' ' 825' ' ' GLU . 34.1 mm-40 -109.92 130.97 55.46 Favored 'General case' 0 C--O 1.24 0.56 0 CA-C-O 122.013 0.911 . . . . 26.210000000000001 111.274 -178.366 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 826' ' ' ALA . . . . . 0.497 ' HB1' HG22 ' A' ' 877' ' ' VAL . . . -134.34 150.76 50.96 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 113.95 -1.477 . . . . 26.210000000000001 111.978 -178.572 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 827' ' ' ILE . . . . . . . . . . . . . 32.0 mt -113.94 144.94 20.48 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 CA-C-O 124.376 2.036 . . . . 26.210000000000001 112.72 169.233 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 828' ' ' ALA . . . . . . . . . . . . . . . -70.19 130.98 43.5 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.165 -1.38 . . . . 26.210000000000001 110.813 175.486 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 829' ' ' LYS . . . . . 0.453 ' HB3' ' O ' ' A' ' 876' ' ' TYR . 52.1 tttt -97.9 -41.59 7.95 Favored 'General case' 0 N--CA 1.439 -1.018 0 N-CA-C 106.364 -1.717 . . . . 26.210000000000001 106.364 -179.781 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 830' ' ' PHE . . . . . . . . . . . . . 36.3 m-85 -132.28 159.15 39.95 Favored 'General case' 0 C--O 1.242 0.692 0 C-N-CA 125.157 1.383 . . . . 26.210000000000001 111.557 -178.795 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 831' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -75.1 112.62 11.54 Favored 'General case' 0 C--N 1.354 0.771 0 C-N-CA 122.557 0.343 . . . . 26.210000000000001 110.702 177.296 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 832' ' ' PHE . . . . . 0.443 ' HB2' ' CD2' ' A' ' 876' ' ' TYR . 78.7 t80 -102.11 126.6 49.1 Favored 'General case' 0 C--O 1.238 0.495 0 N-CA-C 114.28 1.215 . . . . 26.210000000000001 114.28 -178.453 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 833' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -104.88 125.25 50.71 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-O 123.787 1.756 . . . . 26.210000000000001 107.078 170.412 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 834' ' ' GLY . . . . . . . . . . . . . . . -79.99 146.98 28.59 Favored Glycine 0 C--N 1.341 0.839 0 O-C-N 120.668 -1.27 . . . . 26.210000000000001 110.9 169.937 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 835' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -107.95 -12.71 15.11 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 113.748 1.018 . . . . 26.210000000000001 113.748 -177.913 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 836' ' ' THR . . . . . . . . . . . . . 33.9 p -114.27 164.76 13.46 Favored 'General case' 0 C--N 1.345 0.397 0 CA-C-O 122.19 0.995 . . . . 26.210000000000001 109.444 172.226 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 837' ' ' GLN . . . . . . . . . . . . . 39.4 tt0 -60.12 -30.87 69.57 Favored 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 125.034 1.334 . . . . 26.210000000000001 111.907 177.392 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 838' ' ' VAL . . . . . 0.576 ' HB ' ' O ' ' A' ' 909' ' ' HOH . 21.5 t -74.01 -27.04 21.71 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.934 0 C-N-CA 125.586 1.554 . . . . 26.210000000000001 114.227 -178.117 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 839' ' ' GLU . . . . . 0.668 ' HG3' ' O ' ' A' ' 909' ' ' HOH . 14.4 mt-10 -84.14 137.88 33.3 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 114.935 1.457 . . . . 26.210000000000001 114.935 -179.193 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 65.9 ttp -93.0 125.76 37.76 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.321 -0.854 . . . . 26.210000000000001 111.643 -179.504 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 841' ' ' SER . . . . . . . . . . . . . 66.6 m -102.43 142.31 33.84 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.81 1.244 . . . . 26.210000000000001 113.055 -178.038 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 842' ' ' PHE . . . . . . . . . . . . . 10.9 p90 -152.12 173.31 15.08 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 117.044 2.238 . . . . 26.210000000000001 117.044 -176.705 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 843' ' ' ARG . . . . . . . . . . . . . 18.7 mmt180 -96.39 162.11 13.63 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 127.239 2.216 . . . . 26.210000000000001 113.153 167.694 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 844' ' ' LYS . . . . . . . . . . . . . 2.3 pttt -80.79 144.46 32.09 Favored 'General case' 0 C--N 1.355 0.848 0 O-C-N 121.307 -0.87 . . . . 26.210000000000001 111.717 -179.879 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . 91.97 14.02 56.92 Favored Glycine 0 C--O 1.223 -0.539 0 CA-C-N 115.439 -0.8 . . . . 26.210000000000001 111.577 -177.692 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 846' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -92.29 133.7 35.59 Favored 'General case' 0 C--O 1.22 -0.46 0 N-CA-C 114.863 1.431 . . . . 26.210000000000001 114.863 176.595 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 847' ' ' ARG . . . . . . . . . . . . . 61.3 ttt180 -84.45 108.52 17.3 Favored 'General case' 0 C--O 1.243 0.712 0 CA-C-O 123.06 1.409 . . . . 26.210000000000001 110.859 177.088 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 848' ' ' ILE . . . . . . . . . . . . . 89.2 mt -103.29 138.31 28.13 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 CA-C-N 113.126 -1.852 . . . . 26.210000000000001 108.429 175.94 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 849' ' ' THR . . . . . 0.464 ' HB ' ' O ' ' A' ' 914' ' ' HOH . 88.7 m -91.86 138.15 31.78 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 107.224 -1.399 . . . . 26.210000000000001 107.224 168.343 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 850' ' ' LEU . . . . . 0.421 HD11 HG13 ' A' ' 879' ' ' VAL 0.298 88.7 mt -99.41 121.02 40.54 Favored 'General case' 0 N--CA 1.443 -0.818 0 CA-C-N 113.771 -1.559 . . . . 26.210000000000001 107.433 -177.227 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 851' ' ' LEU . . . . . . . . . . . . . 34.8 mt -76.54 -55.63 5.35 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 114.596 -2.621 . . . . 26.210000000000001 114.228 174.163 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 852' ' ' ARG . . . . . . . . . . . . . 18.9 ttt85 -157.35 157.24 33.73 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 128.017 3.323 . . . . 26.210000000000001 110.511 -177.133 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 853' ' ' GLN . . . . . . . . . . . . . 55.6 tt0 -93.05 120.09 32.99 Favored 'General case' 0 C--O 1.218 -0.602 0 CA-C-O 126.099 2.857 . . . . 26.210000000000001 105.274 169.02 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 854' ' ' VAL . . . . . . . . . . . . 0.272 3.0 m -82.23 -34.64 12.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 O-C-N 116.979 -3.575 . . . . 26.210000000000001 114.88 -177.846 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 855' ' ' ASP . . . . . . . . . . . . . 37.4 p-10 -154.49 -159.91 1.01 Allowed 'General case' 0 CA--C 1.576 1.946 0 N-CA-C 106.394 -1.706 . . . . 26.210000000000001 106.394 172.205 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 856' ' ' GLU . . . . . . . . . . . . . 18.3 pt-20 -59.24 -25.98 64.5 Favored 'General case' 0 N--CA 1.438 -1.044 0 N-CA-C 117.075 2.25 . . . . 26.210000000000001 117.075 170.386 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 857' ' ' ASN . . . . . 0.547 ' HB3' ' O ' ' A' ' 906' ' ' HOH . 89.6 m-20 -111.86 -14.51 13.52 Favored 'General case' 0 C--O 1.223 -0.303 0 N-CA-C 119.384 3.105 . . . . 26.210000000000001 119.384 -177.108 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 858' ' ' TRP . . . . . . . . . . . . 0.357 86.0 m95 -137.75 160.81 38.21 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 118.448 -1.301 . . . . 26.210000000000001 111.464 -176.022 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 859' ' ' TYR . . . . . . . . . . . . . 17.2 m-85 -119.21 157.07 28.73 Favored 'General case' 0 N--CA 1.432 -1.368 0 N-CA-C 105.528 -2.027 . . . . 26.210000000000001 105.528 167.237 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 860' ' ' GLU . . . . . . . . . . . . . 53.1 tt0 -92.52 133.05 36.31 Favored 'General case' 0 N--CA 1.438 -1.029 0 N-CA-C 103.25 -2.87 . . . . 26.210000000000001 103.25 166.881 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 861' ' ' GLY . . . . . 0.436 ' HA3' ' HE2' ' A' ' 872' ' ' PHE . . . -147.96 174.68 27.6 Favored Glycine 0 C--O 1.239 0.465 0 O-C-N 119.026 -2.296 . . . . 26.210000000000001 113.4 178.503 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 862' ' ' ARG . . . . . . . . . . . . . 19.7 ptt85 -146.04 172.84 12.81 Favored 'General case' 0 CA--C 1.533 0.298 0 O-C-N 126.275 1.809 . . . . 26.210000000000001 110.328 170.142 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 863' ' ' ILE . . . . . . . . . . . . 0.296 61.1 mt -109.54 141.41 23.55 Favored Pre-proline 0 CA--C 1.542 0.64 0 N-CA-C 108.65 -0.87 . . . . 26.210000000000001 108.65 173.694 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 864' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_exo -66.02 119.28 6.29 Favored 'Trans proline' 0 C--N 1.364 1.346 0 C-N-CA 121.537 1.491 . . . . 26.210000000000001 114.092 -178.82 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 865' ' ' GLY . . . . . . . . . . . . . . . 72.26 18.29 78.01 Favored Glycine 0 CA--C 1.532 1.097 0 CA-C-O 125.253 2.585 . . . . 26.210000000000001 115.104 -178.668 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 866' ' ' THR . . . . . . . . . . . . . 44.2 p -112.79 164.67 13.11 Favored 'General case' 0 N--CA 1.472 0.634 0 O-C-N 117.868 -3.136 . . . . 26.210000000000001 108.543 169.952 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 867' ' ' SER . . . . . 0.417 ' HB2' ' O ' ' A' ' 888' ' ' HOH . 75.8 m -80.45 -14.13 58.54 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 121.612 -0.68 . . . . 26.210000000000001 111.2 171.961 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 868' ' ' ARG . . . . . . . . . . . . . 47.5 mtm180 -69.29 112.98 6.21 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 118.813 2.894 . . . . 26.210000000000001 118.813 -176.937 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 869' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -137.7 150.37 47.26 Favored 'General case' 0 N--CA 1.435 -1.18 0 O-C-N 127.822 3.201 . . . . 26.210000000000001 110.539 -179.926 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 870' ' ' GLY . . . . . . . . . . . . . . . 171.72 -162.33 34.68 Favored Glycine 0 C--O 1.228 -0.246 0 CA-C-O 116.966 -2.019 . . . . 26.210000000000001 111.36 -178.294 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 871' ' ' ILE . . . . . . . . . . . . . 48.5 pt -113.19 147.86 16.52 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.286 0 O-C-N 128.388 3.052 . . . . 26.210000000000001 109.37 168.283 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 872' ' ' PHE . . . . . 0.553 ' HB2' ' HD2' ' A' ' 873' ' ' PRO . 51.4 p90 -141.3 161.18 54.32 Favored Pre-proline 0 C--O 1.218 -0.595 0 C-N-CA 124.201 1.0 . . . . 26.210000000000001 111.359 179.58 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 873' ' ' PRO . . . . . 0.553 ' HD2' ' HB2' ' A' ' 872' ' ' PHE . 41.1 Cg_endo -72.41 141.32 34.94 Favored 'Trans proline' 0 C--O 1.212 -0.814 0 O-C-N 118.736 -1.244 . . . . 26.210000000000001 110.575 -179.54 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 874' ' ' ILE . . . . . 0.654 HD13 ' O ' ' A' ' 897' ' ' HOH . 13.3 tt -59.24 -38.69 75.94 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.336 0 N-CA-C 107.27 -1.382 . . . . 26.210000000000001 107.27 179.422 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 875' ' ' THR . . . . . . . . . . . . . 28.2 m -56.29 -41.44 75.91 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 126.962 2.105 . . . . 26.210000000000001 116.649 -177.238 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 876' ' ' TYR . . . . . 0.453 ' O ' ' HB3' ' A' ' 829' ' ' LYS . 1.7 m-85 -71.37 -18.85 62.34 Favored 'General case' 0 C--N 1.306 -1.296 0 N-CA-C 115.746 1.758 . . . . 26.210000000000001 115.746 -176.845 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 877' ' ' VAL . . . . . 0.497 HG22 ' HB1' ' A' ' 826' ' ' ALA . 1.9 p -114.7 141.23 31.98 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.058 0 N-CA-C 117.514 2.413 . . . . 26.210000000000001 117.514 -177.405 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 878' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -88.15 112.07 22.31 Favored 'General case' 0 C--N 1.35 0.613 0 CA-C-O 123.036 1.398 . . . . 26.210000000000001 108.928 168.079 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 879' ' ' VAL . . . . . 0.421 HG13 HD11 ' A' ' 850' ' ' LEU . 44.4 t -87.35 113.56 24.96 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 O-C-N 119.171 -2.205 . . . . 26.210000000000001 113.267 172.988 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 880' ' ' ILE . . . . . 0.6 HD12 ' N ' ' A' ' 880' ' ' ILE . 2.9 mp -74.0 -62.82 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.351 0.67 0 N-CA-C 115.338 1.607 . . . . 26.210000000000001 115.338 168.619 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 881' ' ' LYS . . . . . 0.47 ' HG3' ' HA2' ' A' ' 824' ' ' GLY . 0.3 OUTLIER -119.04 146.56 44.95 Favored 'General case' 0 CA--C 1.497 -1.06 0 N-CA-C 102.499 -3.149 . . . . 26.210000000000001 102.499 -179.201 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 882' ' ' ARG . . . . . 0.412 ' HD2' ' O ' ' A' ' 912' ' ' HOH 0.39 5.7 ptt-85 -114.07 163.31 19.3 Favored Pre-proline 0 C--N 1.322 -0.621 0 N-CA-C 116.951 2.204 . . . . 26.210000000000001 116.951 -177.754 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 883' ' ' PRO . . . . . 0.564 ' HA ' ' O ' ' A' ' 822' ' ' PHE . 89.1 Cg_exo -65.6 138.5 54.54 Favored 'Trans proline' 0 CA--C 1.513 -0.57 0 C-N-CA 122.882 2.388 . . . . 26.210000000000001 111.828 174.131 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 884' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.251 1.155 0 O-C-N 126.397 2.311 . . . . 26.210000000000001 111.783 -178.026 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 885' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 886' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 887' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 888' ' ' HOH . . . . . 0.417 ' O ' ' HB2' ' A' ' 867' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 889' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 890' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 891' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 892' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 893' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 894' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 895' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 896' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 897' ' ' HOH . . . . . 0.654 ' O ' HD13 ' A' ' 874' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 898' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 899' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 900' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 901' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 902' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 903' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 904' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 905' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 906' ' ' HOH . . . . . 0.547 ' O ' ' HB3' ' A' ' 857' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 907' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 908' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 909' ' ' HOH . . . . . 0.668 ' O ' ' HG3' ' A' ' 839' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 910' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 911' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 912' ' ' HOH . . . . . 0.412 ' O ' ' HD2' ' A' ' 882' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 913' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 914' ' ' HOH . . . . . 0.464 ' O ' ' HB ' ' A' ' 849' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 915' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 916' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 917' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 918' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 919' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 920' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 818' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 1.501 0 N-CA-C 114.659 0.624 . . . . 26.21 114.659 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 819' ' ' ILE . . . . . . . . . . . . . 53.1 mt -60.55 -42.55 91.9 Favored 'Isoleucine or valine' 0 C--O 1.245 0.846 0 C-N-CA 125.421 1.488 . . . . 26.21 110.597 175.661 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 820' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -75.11 126.14 88.37 Favored Pre-proline 0 CA--C 1.536 0.442 0 CA-C-N 112.962 -1.926 . . . . 26.21 109.863 -179.624 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 821' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -64.13 -19.1 65.72 Favored 'Trans proline' 0 CA--C 1.55 1.28 0 C-N-CA 122.697 2.265 . . . . 26.21 117.325 -176.942 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 822' ' ' PHE . . . . . 0.564 ' O ' ' HA ' ' A' ' 883' ' ' PRO . 0.8 OUTLIER -68.38 -21.58 64.7 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 120.359 -1.463 . . . . 26.21 113.95 -177.275 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 823' ' ' THR . . . . . . . . . . . . . 71.5 p -73.72 140.71 46.17 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 124.844 1.257 . . . . 26.21 114.197 178.117 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 824' ' ' GLY . . . . . 0.47 ' HA2' ' HG3' ' A' ' 881' ' ' LYS . . . -101.93 155.54 18.73 Favored Glycine 0 C--O 1.217 -0.95 0 N-CA-C 116.747 1.459 . . . . 26.21 116.747 171.418 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 825' ' ' GLU . . . . . 0.418 ' OE2' ' HA ' ' A' ' 825' ' ' GLU . 34.1 mm-40 -109.92 130.97 55.46 Favored 'General case' 0 C--O 1.24 0.56 0 CA-C-O 122.013 0.911 . . . . 26.21 111.274 -178.366 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 826' ' ' ALA . . . . . 0.497 ' HB1' HG22 ' A' ' 877' ' ' VAL . . . -134.34 150.76 50.96 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 113.95 -1.477 . . . . 26.21 111.978 -178.572 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 827' ' ' ILE . . . . . . . . . . . . . 32.0 mt -113.94 144.94 20.48 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 CA-C-O 124.376 2.036 . . . . 26.21 112.72 169.233 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 828' ' ' ALA . . . . . . . . . . . . . . . -70.19 130.98 43.5 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.165 -1.38 . . . . 26.21 110.813 175.486 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 829' ' ' LYS . . . . . 0.453 ' HB3' ' O ' ' A' ' 876' ' ' TYR . 52.1 tttt -97.9 -41.59 7.95 Favored 'General case' 0 N--CA 1.439 -1.018 0 N-CA-C 106.364 -1.717 . . . . 26.21 106.364 -179.781 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 830' ' ' PHE . . . . . . . . . . . . . 36.3 m-85 -132.28 159.15 39.95 Favored 'General case' 0 C--O 1.242 0.692 0 C-N-CA 125.157 1.383 . . . . 26.21 111.557 -178.795 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 831' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -75.1 112.62 11.54 Favored 'General case' 0 C--N 1.354 0.771 0 C-N-CA 122.557 0.343 . . . . 26.21 110.702 177.296 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 832' ' ' PHE . . . . . 0.443 ' HB2' ' CD2' ' A' ' 876' ' ' TYR . 78.7 t80 -102.11 126.6 49.1 Favored 'General case' 0 C--O 1.238 0.495 0 N-CA-C 114.28 1.215 . . . . 26.21 114.28 -178.453 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 833' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -104.88 125.25 50.71 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-O 123.787 1.756 . . . . 26.21 107.078 170.412 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 834' ' ' GLY . . . . . . . . . . . . . . . -79.99 146.98 28.59 Favored Glycine 0 C--N 1.341 0.839 0 O-C-N 120.668 -1.27 . . . . 26.21 110.9 169.937 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 835' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -107.95 -12.71 15.11 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 113.748 1.018 . . . . 26.21 113.748 -177.913 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 836' ' ' THR . . . . . . . . . . . . . 33.9 p -114.27 164.76 13.46 Favored 'General case' 0 C--N 1.345 0.397 0 CA-C-O 122.19 0.995 . . . . 26.21 109.444 172.226 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 837' ' ' GLN . . . . . . . . . . . . . 39.4 tt0 -60.12 -30.87 69.57 Favored 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 125.034 1.334 . . . . 26.21 111.907 177.392 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 838' ' ' VAL . . . . . 0.576 ' HB ' ' O ' ' A' ' 909' ' ' HOH . 21.5 t -74.01 -27.04 21.71 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.934 0 C-N-CA 125.586 1.554 . . . . 26.21 114.227 -178.117 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 839' ' ' GLU . . . . . 0.668 ' HG3' ' O ' ' A' ' 909' ' ' HOH . 14.4 mt-10 -84.14 137.88 33.3 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 114.935 1.457 . . . . 26.21 114.935 -179.193 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 840' ' ' MET . . . . . . . . . . . . . 65.9 ttp -93.0 125.76 37.76 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.321 -0.854 . . . . 26.21 111.643 -179.504 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 841' ' ' SER . . . . . . . . . . . . . 66.6 m -102.43 142.31 33.84 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.81 1.244 . . . . 26.21 113.055 -178.038 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 842' ' ' PHE . . . . . . . . . . . . . 10.9 p90 -152.12 173.31 15.08 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 117.044 2.238 . . . . 26.21 117.044 -176.705 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 843' ' ' ARG . . . . . . . . . . . . . 18.7 mmt180 -96.39 162.11 13.63 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 127.239 2.216 . . . . 26.21 113.153 167.694 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 844' ' ' LYS . . . . . . . . . . . . . 2.3 pttt -80.79 144.46 32.09 Favored 'General case' 0 C--N 1.355 0.848 0 O-C-N 121.307 -0.87 . . . . 26.21 111.717 -179.879 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 845' ' ' GLY . . . . . . . . . . . . . . . 91.97 14.02 56.92 Favored Glycine 0 C--O 1.223 -0.539 0 CA-C-N 115.439 -0.8 . . . . 26.21 111.577 -177.692 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 846' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -92.29 133.7 35.59 Favored 'General case' 0 C--O 1.22 -0.46 0 N-CA-C 114.863 1.431 . . . . 26.21 114.863 176.595 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 847' ' ' ARG . . . . . . . . . . . . . 61.3 ttt180 -84.45 108.52 17.3 Favored 'General case' 0 C--O 1.243 0.712 0 CA-C-O 123.06 1.409 . . . . 26.21 110.859 177.088 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 848' ' ' ILE . . . . . . . . . . . . . 89.2 mt -103.29 138.31 28.13 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 CA-C-N 113.126 -1.852 . . . . 26.21 108.429 175.94 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 849' ' ' THR . . . . . 0.464 ' HB ' ' O ' ' A' ' 914' ' ' HOH . 88.7 m -91.86 138.15 31.78 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 107.224 -1.399 . . . . 26.21 107.224 168.343 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 850' ' ' LEU . . . . . 0.421 HD11 HG13 ' A' ' 879' ' ' VAL 0.298 88.7 mt -99.41 121.02 40.54 Favored 'General case' 0 N--CA 1.443 -0.818 0 CA-C-N 113.771 -1.559 . . . . 26.21 107.433 -177.227 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 851' ' ' LEU . . . . . . . . . . . . . 34.8 mt -76.54 -55.63 5.35 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 114.596 -2.621 . . . . 26.21 114.228 174.163 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 852' ' ' ARG . . . . . . . . . . . . . 18.9 ttt85 -157.35 157.24 33.73 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 128.017 3.323 . . . . 26.21 110.511 -177.133 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 853' ' ' GLN . . . . . . . . . . . . . 55.6 tt0 -93.05 120.09 32.99 Favored 'General case' 0 C--O 1.218 -0.602 0 CA-C-O 126.099 2.857 . . . . 26.21 105.274 169.02 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 854' ' ' VAL . . . . . . . . . . . . 0.272 3.0 m -82.23 -34.64 12.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 O-C-N 116.979 -3.575 . . . . 26.21 114.88 -177.846 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 855' ' ' ASP . . . . . . . . . . . . . 37.4 p-10 -154.49 -159.91 1.01 Allowed 'General case' 0 CA--C 1.576 1.946 0 N-CA-C 106.394 -1.706 . . . . 26.21 106.394 172.205 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 856' ' ' GLU . . . . . . . . . . . . . 18.3 pt-20 -59.24 -25.98 64.5 Favored 'General case' 0 N--CA 1.438 -1.044 0 N-CA-C 117.075 2.25 . . . . 26.21 117.075 170.386 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 857' ' ' ASN . . . . . 0.547 ' HB3' ' O ' ' A' ' 906' ' ' HOH . 89.6 m-20 -111.86 -14.51 13.52 Favored 'General case' 0 C--O 1.223 -0.303 0 N-CA-C 119.384 3.105 . . . . 26.21 119.384 -177.108 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 858' ' ' TRP . . . . . . . . . . . . 0.357 86.0 m95 -137.75 160.81 38.21 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 118.448 -1.301 . . . . 26.21 111.464 -176.022 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 859' ' ' TYR . . . . . . . . . . . . . 17.2 m-85 -119.21 157.07 28.73 Favored 'General case' 0 N--CA 1.432 -1.368 0 N-CA-C 105.528 -2.027 . . . . 26.21 105.528 167.237 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 860' ' ' GLU . . . . . . . . . . . . . 53.1 tt0 -92.52 133.05 36.31 Favored 'General case' 0 N--CA 1.438 -1.029 0 N-CA-C 103.25 -2.87 . . . . 26.21 103.25 166.881 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 861' ' ' GLY . . . . . 0.436 ' HA3' ' HE2' ' A' ' 872' ' ' PHE . . . -147.96 174.68 27.6 Favored Glycine 0 C--O 1.239 0.465 0 O-C-N 119.026 -2.296 . . . . 26.21 113.4 178.503 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 862' ' ' ARG . . . . . . . . . . . . . 19.7 ptt85 -146.04 172.84 12.81 Favored 'General case' 0 CA--C 1.533 0.298 0 O-C-N 126.275 1.809 . . . . 26.21 110.328 170.142 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 863' ' ' ILE . . . . . . . . . . . . 0.296 61.1 mt -109.54 141.41 23.55 Favored Pre-proline 0 CA--C 1.542 0.64 0 N-CA-C 108.65 -0.87 . . . . 26.21 108.65 173.694 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 864' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_exo -66.02 119.28 6.29 Favored 'Trans proline' 0 C--N 1.364 1.346 0 C-N-CA 121.537 1.491 . . . . 26.21 114.092 -178.82 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 865' ' ' GLY . . . . . . . . . . . . . . . 72.26 18.29 78.01 Favored Glycine 0 CA--C 1.532 1.097 0 CA-C-O 125.253 2.585 . . . . 26.21 115.104 -178.668 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 866' ' ' THR . . . . . . . . . . . . . 44.2 p -112.79 164.67 13.11 Favored 'General case' 0 N--CA 1.472 0.634 0 O-C-N 117.868 -3.136 . . . . 26.21 108.543 169.952 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 867' ' ' SER . . . . . 0.417 ' HB2' ' O ' ' A' ' 888' ' ' HOH . 75.8 m -80.45 -14.13 58.54 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 121.612 -0.68 . . . . 26.21 111.2 171.961 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 868' ' ' ARG . . . . . . . . . . . . . 47.5 mtm180 -69.29 112.98 6.21 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 118.813 2.894 . . . . 26.21 118.813 -176.937 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 869' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 -137.7 150.37 47.26 Favored 'General case' 0 N--CA 1.435 -1.18 0 O-C-N 127.822 3.201 . . . . 26.21 110.539 -179.926 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 870' ' ' GLY . . . . . . . . . . . . . . . 171.72 -162.33 34.68 Favored Glycine 0 C--O 1.228 -0.246 0 CA-C-O 116.966 -2.019 . . . . 26.21 111.36 -178.294 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 871' ' ' ILE . . . . . . . . . . . . . 48.5 pt -113.19 147.86 16.52 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.286 0 O-C-N 128.388 3.052 . . . . 26.21 109.37 168.283 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 872' ' ' PHE . . . . . 0.553 ' HB2' ' HD2' ' A' ' 873' ' ' PRO . 51.4 p90 -141.3 161.18 54.32 Favored Pre-proline 0 C--O 1.218 -0.595 0 C-N-CA 124.201 1.0 . . . . 26.21 111.359 179.58 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 873' ' ' PRO . . . . . 0.553 ' HD2' ' HB2' ' A' ' 872' ' ' PHE . 41.1 Cg_endo -72.41 141.32 34.94 Favored 'Trans proline' 0 C--O 1.212 -0.814 0 O-C-N 118.736 -1.244 . . . . 26.21 110.575 -179.54 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 874' ' ' ILE . . . . . 0.654 HD13 ' O ' ' A' ' 897' ' ' HOH . 13.3 tt -59.24 -38.69 75.94 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.336 0 N-CA-C 107.27 -1.382 . . . . 26.21 107.27 179.422 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 875' ' ' THR . . . . . . . . . . . . . 28.2 m -56.29 -41.44 75.91 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 126.962 2.105 . . . . 26.21 116.649 -177.238 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 876' ' ' TYR . . . . . 0.453 ' O ' ' HB3' ' A' ' 829' ' ' LYS . 1.7 m-85 -71.37 -18.85 62.34 Favored 'General case' 0 C--N 1.306 -1.296 0 N-CA-C 115.746 1.758 . . . . 26.21 115.746 -176.845 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 877' ' ' VAL . . . . . 0.497 HG22 ' HB1' ' A' ' 826' ' ' ALA . 1.9 p -114.7 141.23 31.98 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.058 0 N-CA-C 117.514 2.413 . . . . 26.21 117.514 -177.405 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 878' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -88.15 112.07 22.31 Favored 'General case' 0 C--N 1.35 0.613 0 CA-C-O 123.036 1.398 . . . . 26.21 108.928 168.079 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 879' ' ' VAL . . . . . 0.421 HG13 HD11 ' A' ' 850' ' ' LEU . 44.4 t -87.35 113.56 24.96 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 O-C-N 119.171 -2.205 . . . . 26.21 113.267 172.988 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 880' ' ' ILE . . . . . 0.6 ' N ' HD12 ' A' ' 880' ' ' ILE . 2.9 mp -74.0 -62.82 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.351 0.67 0 N-CA-C 115.338 1.607 . . . . 26.21 115.338 168.619 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 881' ' ' LYS . . . . . 0.47 ' HG3' ' HA2' ' A' ' 824' ' ' GLY . 0.3 OUTLIER -119.04 146.56 44.95 Favored 'General case' 0 CA--C 1.497 -1.06 0 N-CA-C 102.499 -3.149 . . . . 26.21 102.499 -179.201 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 882' ' ' ARG . . . . . 0.412 ' HD2' ' O ' ' A' ' 912' ' ' HOH 0.39 5.7 ptt-85 -114.07 163.31 19.3 Favored Pre-proline 0 C--N 1.322 -0.621 0 N-CA-C 116.951 2.204 . . . . 26.21 116.951 -177.754 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 883' ' ' PRO . . . . . 0.564 ' HA ' ' O ' ' A' ' 822' ' ' PHE . 89.1 Cg_exo -65.6 138.5 54.54 Favored 'Trans proline' 0 CA--C 1.513 -0.57 0 C-N-CA 122.882 2.388 . . . . 26.21 111.828 174.131 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 884' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.251 1.155 0 O-C-N 126.397 2.311 . . . . 26.21 111.783 -178.026 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 885' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 886' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 887' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 888' ' ' HOH . . . . . 0.417 ' O ' ' HB2' ' A' ' 867' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 889' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 890' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 891' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 892' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 893' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 894' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 895' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 896' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 897' ' ' HOH . . . . . 0.654 ' O ' HD13 ' A' ' 874' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 898' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 899' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 900' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 901' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 902' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 903' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 904' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 905' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 906' ' ' HOH . . . . . 0.547 ' O ' ' HB3' ' A' ' 857' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 907' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 908' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 909' ' ' HOH . . . . . 0.668 ' O ' ' HG3' ' A' ' 839' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 910' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 911' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 912' ' ' HOH . . . . . 0.412 ' O ' ' HD2' ' A' ' 882' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 913' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 914' ' ' HOH . . . . . 0.464 ' O ' ' HB ' ' A' ' 849' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 915' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 916' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 917' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 918' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 919' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 920' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_