data_4pti_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 4pti _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' ' ' ARG . . . . . . . . . . . . . 8.3 ptp85 . . . . . 0 C--O 1.262 1.719 0 CA-C-O 120.809 0.338 . . . . 25.18 110.681 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_exo -59.7 149.01 85.44 Favored 'Trans proline' 0 C--N 1.279 -3.127 0 O-C-N 124.657 1.872 . . . . 14.46 113.628 178.184 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 78.4 m-20 -57.96 -32.81 68.19 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 119.69 -1.881 . . . . 34.9 112.129 179.695 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 15.3 p90 -62.69 -15.73 53.95 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 115.242 1.571 . . . . 23.77 115.242 179.034 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 89.5 m -70.44 -18.63 63.0 Favored 'General case' 0 C--N 1.272 -2.792 0 O-C-N 124.397 1.061 . . . . 12.56 111.012 177.399 -64.766 -83.811 -81.435 104.013 2.05 101.939 -65.334 -70.546 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 55.7 mt -89.04 -2.51 58.6 Favored 'General case' 0 C--O 1.253 1.286 0 N-CA-C 114.193 1.182 . . . . 24.65 114.193 176.783 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . 0.348 62.6 mt-10 -77.98 149.62 77.05 Favored Pre-proline 0 C--O 1.259 1.559 0 C-N-CA 117.992 -1.483 . . . . 34.39 108.847 178.019 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -72.0 158.47 52.43 Favored 'Trans proline' 0 C--O 1.256 1.38 0 N-CA-C 107.423 -1.799 . . . . 27.88 107.423 177.497 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -66.98 143.3 65.48 Favored 'Trans proline' 0 C--N 1.312 -1.385 0 C-N-CA 122.145 1.897 . . . . 14.89 109.21 -177.051 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 89.4 t80 -120.9 115.47 23.28 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 108.443 -0.947 . . . . 23.02 108.443 -175.865 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 17.5 m -77.12 -35.76 55.99 Favored 'General case' 0 C--O 1.276 2.453 0 O-C-N 124.298 0.999 . . . . 23.58 110.67 -176.715 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 89.76 176.05 45.56 Favored Glycine 0 N--CA 1.496 2.675 0 N-CA-C 108.054 -2.018 . . . . 16.15 108.054 175.363 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_endo -82.99 -9.92 10.55 Favored 'Trans proline' 0 C--N 1.308 -1.586 0 C-N-CA 123.566 2.844 . . . . 18.86 117.352 -175.853 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 89.4 m -91.61 158.98 16.12 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 119.835 1.198 . . . . 13.35 111.047 -177.189 -68.14 95.241 95.987 107.144 2.088 105.854 -117.27 70.74 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -118.64 31.91 6.41 Favored 'General case' 0 C--N 1.291 -1.951 0 N-CA-C 113.08 0.77 . . . . 32.27 113.08 -169.604 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -76.81 172.69 12.7 Favored 'General case' 0 C--O 1.251 1.146 0 C-N-CA 125.032 1.333 . . . . 12.62 108.218 169.079 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 85.6 mtm-85 -130.16 80.57 1.96 Allowed 'General case' 0 C--O 1.263 1.784 0 C-N-CA 119.898 -0.721 . . . . 35.87 109.248 -174.526 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 72.3 mt -108.59 111.02 34.21 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 CA-C-N 113.078 -1.874 . . . . 21.94 110.935 -175.343 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 41.9 mm -78.1 119.8 27.69 Favored 'Isoleucine or valine' 0 C--O 1.259 1.578 0 CA-C-O 124.662 2.172 . . . . 20.69 109.055 -177.748 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 27.9 mmt85 -122.26 178.8 4.78 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 113.198 -1.819 . . . . 24.1 107.882 175.88 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 60.7 m-85 -113.91 146.64 39.77 Favored 'General case' 0 C--O 1.254 1.315 0 CA-C-N 114.332 -1.304 . . . . 24.69 112.369 172.22 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 30.8 p90 -129.69 159.61 35.94 Favored 'General case' 0 N--CA 1.496 1.834 0 N-CA-C 107.353 -1.351 . . . . 16.55 107.353 168.318 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 86.1 t80 -87.28 126.69 34.99 Favored 'General case' 0 N--CA 1.441 -0.879 0 O-C-N 125.358 1.661 . . . . 12.56 110.009 173.474 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 52.5 t-20 -99.66 96.56 7.71 Favored 'General case' 0 C--O 1.257 1.47 0 O-C-N 123.905 0.753 . . . . 22.83 110.71 175.775 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.98 -28.28 66.18 Favored 'General case' 0 C--O 1.249 1.028 0 CA-C-O 117.165 -1.398 . . . . 18.95 114.249 -171.601 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 62.1 mttp -69.9 -35.31 74.51 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-O 118.359 -0.829 . . . . 38.15 111.704 172.932 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -89.68 -19.56 24.69 Favored 'General case' 0 C--O 1.267 2.007 0 O-C-N 124.845 1.341 . . . . 17.25 111.04 -174.068 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 79.24 12.8 83.55 Favored Glycine 0 C--O 1.253 1.336 0 C-N-CA 117.895 -2.097 . . . . 15.08 116.687 -178.958 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.8 pp -155.94 171.39 20.16 Favored 'General case' 0 C--O 1.249 1.033 0 O-C-N 124.602 0.825 . . . . 17.94 111.564 -178.081 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 93.1 m -95.28 145.98 24.69 Favored 'General case' 0 C--O 1.254 1.335 0 C-N-CA 117.906 -1.517 . . . . 14.86 112.82 -173.224 -66.365 -119.385 -87.869 104.041 2.024 105.682 -90.966 175.829 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -130.86 160.99 32.8 Favored 'General case' 0 C--N 1.302 -1.48 0 N-CA-C 107.309 -1.367 . . . . 35.23 107.309 -173.574 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 24.6 p -89.02 155.52 19.43 Favored 'General case' 0 C--N 1.281 -2.384 0 CA-C-O 124.85 2.262 . . . . 16.93 111.871 178.963 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 5.2 p90 -150.51 164.16 36.65 Favored 'General case' 0 C--O 1.254 1.295 0 CA-C-N 112.52 -2.127 . . . . 10.39 107.815 174.789 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 74.5 t -97.07 113.14 30.66 Favored 'Isoleucine or valine' 0 C--O 1.249 1.047 0 O-C-N 125.434 1.709 . . . . 15.81 107.363 177.543 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 14.0 t80 -85.78 135.39 33.75 Favored 'General case' 0 C--O 1.256 1.413 0 O-C-N 127.932 3.27 . . . . 14.45 106.172 173.82 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -78.57 -8.5 87.62 Favored Glycine 0 N--CA 1.487 2.078 0 CA-C-O 117.82 -1.544 . . . . 13.02 115.608 179.877 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 99.02 6.55 55.9 Favored Glycine 0 C--N 1.303 -1.273 0 C-N-CA 126.419 1.962 . . . . 14.39 114.377 170.796 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 19.1 p -146.23 156.74 43.6 Favored 'General case' 0 C--O 1.256 1.413 0 CA-C-N 119.167 1.484 . . . . 11.7 112.79 171.783 70.74 -117.27 95.987 105.854 2.088 107.144 95.241 -68.14 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 28.4 mmt180 62.07 35.93 15.6 Favored 'General case' 0 C--O 1.254 1.312 0 O-C-N 126.864 2.602 . . . . 12.66 113.131 172.347 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -55.97 155.93 5.8 Favored 'General case' 0 N--CA 1.496 1.854 0 C-N-CA 119.702 -0.799 . . . . 19.47 111.352 -176.391 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 75.2 mttt -104.39 171.52 7.29 Favored 'General case' 0 C--N 1.287 -2.142 0 CA-C-N 112.942 -1.936 . . . . 38.35 108.468 164.419 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 27.8 mtp180 -72.74 -26.04 61.42 Favored 'General case' 0 N--CA 1.427 -1.593 0 CA-C-O 116.288 -1.815 . . . . 28.07 113.208 -167.943 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 47.1 t-20 -82.2 73.97 9.2 Favored 'General case' 0 C--O 1.261 1.658 0 C-N-CA 117.723 -1.591 . . . . 10.41 109.224 179.272 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 36.7 t-20 -162.55 102.13 1.05 Allowed 'General case' 0 N--CA 1.516 2.87 0 CA-C-N 113.35 -1.75 . . . . 14.67 109.719 -167.701 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 65.1 m-85 -122.63 154.5 37.92 Favored 'General case' 0 C--O 1.253 1.242 0 CA-C-N 115.303 -0.862 . . . . 13.79 111.091 -169.068 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 53.2 mttt -86.1 -8.16 58.08 Favored 'General case' 0 C--N 1.299 -1.617 0 C-N-CA 117.483 -1.687 . . . . 38.89 113.807 179.216 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 58.8 p -151.18 158.22 43.67 Favored 'General case' 0 C--O 1.257 1.497 0 C-N-CA 118.965 -1.094 . . . . 14.67 109.541 177.332 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.19 -30.03 70.9 Favored 'General case' 0 C--O 1.263 1.774 0 C-N-CA 118.181 -1.408 . . . . 10.2 112.181 174.329 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 50.7 mp0 -70.53 -38.96 74.28 Favored 'General case' 0 C--O 1.25 1.084 0 CA-C-N 119.015 0.825 . . . . 12.66 112.297 -179.609 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 39.7 m-20 -69.98 -38.41 76.04 Favored 'General case' 0 C--O 1.261 1.694 0 C-N-CA 116.903 -1.919 . . . . 40.9 112.439 175.361 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 41.7 t -62.38 -44.83 95.53 Favored 'General case' 0 C--O 1.269 2.097 0 O-C-N 124.649 1.218 . . . . 13.35 110.661 179.107 175.829 -90.966 -87.869 105.682 2.024 104.041 -119.385 -66.365 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 92.5 mmm -71.71 -35.28 70.17 Favored 'General case' 0 C--O 1.256 1.415 0 C-N-CA 115.823 -2.351 . . . . 12.61 111.884 179.237 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 10.1 ttp180 -61.6 -38.16 86.56 Favored 'General case' 0 C--O 1.261 1.685 0 N-CA-C 108.361 -0.977 . . . . 33.78 108.361 -179.238 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 46.9 m -81.6 -41.67 21.18 Favored 'General case' 0 C--N 1.308 -1.231 0 C-N-CA 118.664 -1.214 . . . . 14.28 111.658 -179.773 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 86.3 m -111.38 -7.86 14.35 Favored 'General case' 0 C--N 1.294 -1.805 0 CA-C-N 120.231 1.378 . . . . 14.51 113.444 -165.719 -70.546 -65.334 -81.435 101.939 2.05 104.013 -83.811 -64.766 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -75.62 -5.6 78.94 Favored Glycine 0 C--N 1.285 -2.275 0 C-N-CA 117.505 -2.283 . . . . 30.75 113.582 -167.502 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 84.06 167.71 42.74 Favored Glycine 0 C--O 1.26 1.747 0 C-N-CA 125.67 1.605 . . . . 40.53 110.18 164.335 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.267 2.026 0 CA-C-N 114.413 -0.893 . . . . 50.07 111.802 179.216 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 158' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 159' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 160' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 8.3 ptp85 . . . . . 0 C--O 1.262 1.719 0 CA-C-O 120.809 0.338 . . . . 25.18 110.681 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_exo -59.7 149.01 85.44 Favored 'Trans proline' 0 C--N 1.279 -3.127 0 O-C-N 124.657 1.872 . . . . 14.460000000000001 113.628 178.184 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 78.4 m-20 -57.96 -32.81 68.19 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 119.69 -1.881 . . . . 34.899999999999999 112.129 179.695 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 15.3 p90 -62.69 -15.73 53.95 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 115.242 1.571 . . . . 23.77 115.242 179.034 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 89.5 m -70.44 -18.63 63.0 Favored 'General case' 0 C--N 1.272 -2.792 0 O-C-N 124.397 1.061 . . . . 12.56 111.012 177.399 -64.766 -83.811 -81.435 104.013 2.05 101.939 -65.334 -70.546 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 55.7 mt -89.04 -2.51 58.6 Favored 'General case' 0 C--O 1.253 1.286 0 N-CA-C 114.193 1.182 . . . . 24.649999999999999 114.193 176.783 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . 0.348 62.6 mt-10 -77.98 149.62 77.05 Favored Pre-proline 0 C--O 1.259 1.559 0 C-N-CA 117.992 -1.483 . . . . 34.390000000000001 108.847 178.019 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -72.0 158.47 52.43 Favored 'Trans proline' 0 C--O 1.256 1.38 0 N-CA-C 107.423 -1.799 . . . . 27.879999999999999 107.423 177.497 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -66.98 143.3 65.48 Favored 'Trans proline' 0 C--N 1.312 -1.385 0 C-N-CA 122.145 1.897 . . . . 14.890000000000001 109.21 -177.051 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 89.4 t80 -120.9 115.47 23.28 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 108.443 -0.947 . . . . 23.02 108.443 -175.865 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 17.5 m -77.12 -35.76 55.99 Favored 'General case' 0 C--O 1.276 2.453 0 O-C-N 124.298 0.999 . . . . 23.579999999999998 110.67 -176.715 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 89.76 176.05 45.56 Favored Glycine 0 N--CA 1.496 2.675 0 N-CA-C 108.054 -2.018 . . . . 16.149999999999999 108.054 175.363 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_endo -82.99 -9.92 10.55 Favored 'Trans proline' 0 C--N 1.308 -1.586 0 C-N-CA 123.566 2.844 . . . . 18.859999999999999 117.352 -175.853 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 89.4 m -91.61 158.98 16.12 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 119.835 1.198 . . . . 13.35 111.047 -177.189 -68.14 95.241 95.987 107.144 2.088 105.854 -117.27 70.74 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -118.64 31.91 6.41 Favored 'General case' 0 C--N 1.291 -1.951 0 N-CA-C 113.08 0.77 . . . . 32.270000000000003 113.08 -169.604 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -76.81 172.69 12.7 Favored 'General case' 0 C--O 1.251 1.146 0 C-N-CA 125.032 1.333 . . . . 12.619999999999999 108.218 169.079 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 85.6 mtm-85 -130.16 80.57 1.96 Allowed 'General case' 0 C--O 1.263 1.784 0 C-N-CA 119.898 -0.721 . . . . 35.869999999999997 109.248 -174.526 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 72.3 mt -108.59 111.02 34.21 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 CA-C-N 113.078 -1.874 . . . . 21.940000000000001 110.935 -175.343 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 41.9 mm -78.1 119.8 27.69 Favored 'Isoleucine or valine' 0 C--O 1.259 1.578 0 CA-C-O 124.662 2.172 . . . . 20.690000000000001 109.055 -177.748 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 27.9 mmt85 -122.26 178.8 4.78 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 113.198 -1.819 . . . . 24.100000000000001 107.882 175.88 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' TYR . . . . . 0.42 ' CE2' ' HB2' ' A' ' 48' ' ' ALA . 60.7 m-85 -113.91 146.64 39.77 Favored 'General case' 0 C--O 1.254 1.315 0 CA-C-N 114.332 -1.304 . . . . 24.690000000000001 112.369 172.22 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 30.8 p90 -129.69 159.61 35.94 Favored 'General case' 0 N--CA 1.496 1.834 0 N-CA-C 107.353 -1.351 . . . . 16.550000000000001 107.353 168.318 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 86.1 t80 -87.28 126.69 34.99 Favored 'General case' 0 N--CA 1.441 -0.879 0 O-C-N 125.358 1.661 . . . . 12.56 110.009 173.474 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 52.5 t-20 -99.66 96.56 7.71 Favored 'General case' 0 C--O 1.257 1.47 0 O-C-N 123.905 0.753 . . . . 22.829999999999998 110.71 175.775 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.98 -28.28 66.18 Favored 'General case' 0 C--O 1.249 1.028 0 CA-C-O 117.165 -1.398 . . . . 18.949999999999999 114.249 -171.601 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 62.1 mttp -69.9 -35.31 74.51 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-O 118.359 -0.829 . . . . 38.149999999999999 111.704 172.932 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -89.68 -19.56 24.69 Favored 'General case' 0 C--O 1.267 2.007 0 O-C-N 124.845 1.341 . . . . 17.25 111.04 -174.068 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 79.24 12.8 83.55 Favored Glycine 0 C--O 1.253 1.336 0 C-N-CA 117.895 -2.097 . . . . 15.08 116.687 -178.958 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.8 pp -155.94 171.39 20.16 Favored 'General case' 0 C--O 1.249 1.033 0 O-C-N 124.602 0.825 . . . . 17.940000000000001 111.564 -178.081 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 93.1 m -95.28 145.98 24.69 Favored 'General case' 0 C--O 1.254 1.335 0 C-N-CA 117.906 -1.517 . . . . 14.859999999999999 112.82 -173.224 -66.365 -119.385 -87.869 104.041 2.024 105.682 -90.966 175.829 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 98.0 mt-30 -130.86 160.99 32.8 Favored 'General case' 0 C--N 1.302 -1.48 0 N-CA-C 107.309 -1.367 . . . . 35.229999999999997 107.309 -173.574 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 24.6 p -89.02 155.52 19.43 Favored 'General case' 0 C--N 1.281 -2.384 0 CA-C-O 124.85 2.262 . . . . 16.93 111.871 178.963 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 5.2 p90 -150.51 164.16 36.65 Favored 'General case' 0 C--O 1.254 1.295 0 CA-C-N 112.52 -2.127 . . . . 10.390000000000001 107.815 174.789 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 74.5 t -97.07 113.14 30.66 Favored 'Isoleucine or valine' 0 C--O 1.249 1.047 0 O-C-N 125.434 1.709 . . . . 15.81 107.363 177.543 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 14.0 t80 -85.78 135.39 33.75 Favored 'General case' 0 C--O 1.256 1.413 0 O-C-N 127.932 3.27 . . . . 14.449999999999999 106.172 173.82 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -78.57 -8.5 87.62 Favored Glycine 0 N--CA 1.487 2.078 0 CA-C-O 117.82 -1.544 . . . . 13.02 115.608 179.877 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 99.02 6.55 55.9 Favored Glycine 0 C--N 1.303 -1.273 0 C-N-CA 126.419 1.962 . . . . 14.390000000000001 114.377 170.796 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 19.1 p -146.23 156.74 43.6 Favored 'General case' 0 C--O 1.256 1.413 0 CA-C-N 119.167 1.484 . . . . 11.699999999999999 112.79 171.783 70.74 -117.27 95.987 105.854 2.088 107.144 95.241 -68.14 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 28.4 mmt180 62.07 35.93 15.6 Favored 'General case' 0 C--O 1.254 1.312 0 O-C-N 126.864 2.602 . . . . 12.66 113.131 172.347 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -55.97 155.93 5.8 Favored 'General case' 0 N--CA 1.496 1.854 0 C-N-CA 119.702 -0.799 . . . . 19.469999999999999 111.352 -176.391 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 75.2 mttt -104.39 171.52 7.29 Favored 'General case' 0 C--N 1.287 -2.142 0 CA-C-N 112.942 -1.936 . . . . 38.350000000000001 108.468 164.419 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 27.8 mtp180 -72.74 -26.04 61.42 Favored 'General case' 0 N--CA 1.427 -1.593 0 CA-C-O 116.288 -1.815 . . . . 28.07 113.208 -167.943 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 47.1 t-20 -82.2 73.97 9.2 Favored 'General case' 0 C--O 1.261 1.658 0 C-N-CA 117.723 -1.591 . . . . 10.41 109.224 179.272 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 36.7 t-20 -162.55 102.13 1.05 Allowed 'General case' 0 N--CA 1.516 2.87 0 CA-C-N 113.35 -1.75 . . . . 14.67 109.719 -167.701 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 65.1 m-85 -122.63 154.5 37.92 Favored 'General case' 0 C--O 1.253 1.242 0 CA-C-N 115.303 -0.862 . . . . 13.789999999999999 111.091 -169.068 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 53.2 mttt -86.1 -8.16 58.08 Favored 'General case' 0 C--N 1.299 -1.617 0 C-N-CA 117.483 -1.687 . . . . 38.890000000000001 113.807 179.216 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 58.8 p -151.18 158.22 43.67 Favored 'General case' 0 C--O 1.257 1.497 0 C-N-CA 118.965 -1.094 . . . . 14.67 109.541 177.332 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ALA . . . . . 0.42 ' HB2' ' CE2' ' A' ' 21' ' ' TYR . . . -65.19 -30.03 70.9 Favored 'General case' 0 C--O 1.263 1.774 0 C-N-CA 118.181 -1.408 . . . . 10.199999999999999 112.181 174.329 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 50.7 mp0 -70.53 -38.96 74.28 Favored 'General case' 0 C--O 1.25 1.084 0 CA-C-N 119.015 0.825 . . . . 12.66 112.297 -179.609 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 39.7 m-20 -69.98 -38.41 76.04 Favored 'General case' 0 C--O 1.261 1.694 0 C-N-CA 116.903 -1.919 . . . . 40.899999999999999 112.439 175.361 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 41.7 t -62.38 -44.83 95.53 Favored 'General case' 0 C--O 1.269 2.097 0 O-C-N 124.649 1.218 . . . . 13.35 110.661 179.107 175.829 -90.966 -87.869 105.682 2.024 104.041 -119.385 -66.365 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 92.5 mmm -71.71 -35.28 70.17 Favored 'General case' 0 C--O 1.256 1.415 0 C-N-CA 115.823 -2.351 . . . . 12.609999999999999 111.884 179.237 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 10.1 ttp180 -61.6 -38.16 86.56 Favored 'General case' 0 C--O 1.261 1.685 0 N-CA-C 108.361 -0.977 . . . . 33.780000000000001 108.361 -179.238 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 46.9 m -81.6 -41.67 21.18 Favored 'General case' 0 C--N 1.308 -1.231 0 C-N-CA 118.664 -1.214 . . . . 14.279999999999999 111.658 -179.773 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 86.3 m -111.38 -7.86 14.35 Favored 'General case' 0 C--N 1.294 -1.805 0 CA-C-N 120.231 1.378 . . . . 14.51 113.444 -165.719 -70.546 -65.334 -81.435 101.939 2.05 104.013 -83.811 -64.766 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -75.62 -5.6 78.94 Favored Glycine 0 C--N 1.285 -2.275 0 C-N-CA 117.505 -2.283 . . . . 30.75 113.582 -167.502 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 84.06 167.71 42.74 Favored Glycine 0 C--O 1.26 1.747 0 C-N-CA 125.67 1.605 . . . . 40.530000000000001 110.18 164.335 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.267 2.026 0 CA-C-N 114.413 -0.893 . . . . 50.07 111.802 179.216 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 149' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 151' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 152' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 153' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 154' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 155' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 156' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 157' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 158' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 159' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 160' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 8.3 ptp85 . . . . . 0 C--O 1.262 1.719 0 CA-C-O 120.809 0.338 . . . . 25.18 110.681 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_exo -59.7 149.01 85.44 Favored 'Trans proline' 0 C--N 1.279 -3.127 0 O-C-N 124.657 1.872 . . . . 14.460000000000001 113.628 178.184 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 78.4 m-20 -57.96 -32.81 68.19 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 119.69 -1.881 . . . . 34.899999999999999 112.129 179.695 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 15.3 p90 -62.69 -15.73 53.95 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 115.242 1.571 . . . . 23.77 115.242 179.034 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 89.5 m -70.44 -18.63 63.0 Favored 'General case' 0 C--N 1.272 -2.792 0 O-C-N 124.397 1.061 . . . . 12.56 111.012 177.399 -64.766 -83.811 -81.435 104.013 2.05 101.939 -65.334 -70.546 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 55.7 mt -89.04 -2.51 58.6 Favored 'General case' 0 C--O 1.253 1.286 0 N-CA-C 114.193 1.182 . . . . 24.649999999999999 114.193 176.783 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . 0.348 62.6 mt-10 -77.98 149.62 77.05 Favored Pre-proline 0 C--O 1.259 1.559 0 C-N-CA 117.992 -1.483 . . . . 34.390000000000001 108.847 178.019 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -72.0 158.47 52.43 Favored 'Trans proline' 0 C--O 1.256 1.38 0 N-CA-C 107.423 -1.799 . . . . 27.879999999999999 107.423 177.497 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -66.98 143.3 65.48 Favored 'Trans proline' 0 C--N 1.312 -1.385 0 C-N-CA 122.145 1.897 . . . . 14.890000000000001 109.21 -177.051 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 89.4 t80 -120.9 115.47 23.28 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 108.443 -0.947 . . . . 23.02 108.443 -175.865 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 17.5 m -77.12 -35.76 55.99 Favored 'General case' 0 C--O 1.276 2.453 0 O-C-N 124.298 0.999 . . . . 23.579999999999998 110.67 -176.715 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 89.76 176.05 45.56 Favored Glycine 0 N--CA 1.496 2.675 0 N-CA-C 108.054 -2.018 . . . . 16.149999999999999 108.054 175.363 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_endo -82.99 -9.92 10.55 Favored 'Trans proline' 0 C--N 1.308 -1.586 0 C-N-CA 123.566 2.844 . . . . 18.859999999999999 117.352 -175.853 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 89.4 m -91.61 158.98 16.12 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 119.835 1.198 . . . . 13.35 111.047 -177.189 -68.14 95.241 95.987 107.144 2.088 105.854 -117.27 70.74 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -118.64 31.91 6.41 Favored 'General case' 0 C--N 1.291 -1.951 0 N-CA-C 113.08 0.77 . . . . 32.270000000000003 113.08 -169.604 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -76.81 172.69 12.7 Favored 'General case' 0 C--O 1.251 1.146 0 C-N-CA 125.032 1.333 . . . . 12.619999999999999 108.218 169.079 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 85.6 mtm-85 -130.16 80.57 1.96 Allowed 'General case' 0 C--O 1.263 1.784 0 C-N-CA 119.898 -0.721 . . . . 35.869999999999997 109.248 -174.526 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 72.3 mt -108.59 111.02 34.21 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 CA-C-N 113.078 -1.874 . . . . 21.940000000000001 110.935 -175.343 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 41.9 mm -78.1 119.8 27.69 Favored 'Isoleucine or valine' 0 C--O 1.259 1.578 0 CA-C-O 124.662 2.172 . . . . 20.690000000000001 109.055 -177.748 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 27.9 mmt85 -122.26 178.8 4.78 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 113.198 -1.819 . . . . 24.100000000000001 107.882 175.88 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.42 ' CE2' ' HB2' ' A' ' 48' ' ' ALA . 60.7 m-85 -113.91 146.64 39.77 Favored 'General case' 0 C--O 1.254 1.315 0 CA-C-N 114.332 -1.304 . . . . 24.690000000000001 112.369 172.22 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 30.8 p90 -129.69 159.61 35.94 Favored 'General case' 0 N--CA 1.496 1.834 0 N-CA-C 107.353 -1.351 . . . . 16.550000000000001 107.353 168.318 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 86.1 t80 -87.28 126.69 34.99 Favored 'General case' 0 N--CA 1.441 -0.879 0 O-C-N 125.358 1.661 . . . . 12.56 110.009 173.474 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.449 HD22 ' NE2' ' A' ' 31' ' ' GLN . 52.5 t-20 -99.66 96.56 7.71 Favored 'General case' 0 C--O 1.257 1.47 0 O-C-N 123.905 0.753 . . . . 22.829999999999998 110.71 175.775 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.98 -28.28 66.18 Favored 'General case' 0 C--O 1.249 1.028 0 CA-C-O 117.165 -1.398 . . . . 18.949999999999999 114.249 -171.601 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 62.1 mttp -69.9 -35.31 74.51 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-O 118.359 -0.829 . . . . 38.149999999999999 111.704 172.932 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -89.68 -19.56 24.69 Favored 'General case' 0 C--O 1.267 2.007 0 O-C-N 124.845 1.341 . . . . 17.25 111.04 -174.068 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 79.24 12.8 83.55 Favored Glycine 0 C--O 1.253 1.336 0 C-N-CA 117.895 -2.097 . . . . 15.08 116.687 -178.958 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.8 pp -155.94 171.39 20.16 Favored 'General case' 0 C--O 1.249 1.033 0 O-C-N 124.602 0.825 . . . . 17.940000000000001 111.564 -178.081 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 93.1 m -95.28 145.98 24.69 Favored 'General case' 0 C--O 1.254 1.335 0 C-N-CA 117.906 -1.517 . . . . 14.859999999999999 112.82 -173.224 -66.365 -119.385 -87.869 104.041 2.024 105.682 -90.966 175.829 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.449 ' NE2' HD22 ' A' ' 24' ' ' ASN . 23.8 mt-30 -130.86 160.99 32.8 Favored 'General case' 0 C--N 1.302 -1.48 0 N-CA-C 107.309 -1.367 . . . . 35.229999999999997 107.309 -173.574 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 24.6 p -89.02 155.52 19.43 Favored 'General case' 0 C--N 1.281 -2.384 0 CA-C-O 124.85 2.262 . . . . 16.93 111.871 178.963 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 5.2 p90 -150.51 164.16 36.65 Favored 'General case' 0 C--O 1.254 1.295 0 CA-C-N 112.52 -2.127 . . . . 10.390000000000001 107.815 174.789 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 74.5 t -97.07 113.14 30.66 Favored 'Isoleucine or valine' 0 C--O 1.249 1.047 0 O-C-N 125.434 1.709 . . . . 15.81 107.363 177.543 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 14.0 t80 -85.78 135.39 33.75 Favored 'General case' 0 C--O 1.256 1.413 0 O-C-N 127.932 3.27 . . . . 14.449999999999999 106.172 173.82 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -78.57 -8.5 87.62 Favored Glycine 0 N--CA 1.487 2.078 0 CA-C-O 117.82 -1.544 . . . . 13.02 115.608 179.877 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 99.02 6.55 55.9 Favored Glycine 0 C--N 1.303 -1.273 0 C-N-CA 126.419 1.962 . . . . 14.390000000000001 114.377 170.796 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 19.1 p -146.23 156.74 43.6 Favored 'General case' 0 C--O 1.256 1.413 0 CA-C-N 119.167 1.484 . . . . 11.699999999999999 112.79 171.783 70.74 -117.27 95.987 105.854 2.088 107.144 95.241 -68.14 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 28.4 mmt180 62.07 35.93 15.6 Favored 'General case' 0 C--O 1.254 1.312 0 O-C-N 126.864 2.602 . . . . 12.66 113.131 172.347 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -55.97 155.93 5.8 Favored 'General case' 0 N--CA 1.496 1.854 0 C-N-CA 119.702 -0.799 . . . . 19.469999999999999 111.352 -176.391 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 75.2 mttt -104.39 171.52 7.29 Favored 'General case' 0 C--N 1.287 -2.142 0 CA-C-N 112.942 -1.936 . . . . 38.350000000000001 108.468 164.419 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 27.8 mtp180 -72.74 -26.04 61.42 Favored 'General case' 0 N--CA 1.427 -1.593 0 CA-C-O 116.288 -1.815 . . . . 28.07 113.208 -167.943 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 47.1 t-20 -82.2 73.97 9.2 Favored 'General case' 0 C--O 1.261 1.658 0 C-N-CA 117.723 -1.591 . . . . 10.41 109.224 179.272 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 36.7 t-20 -162.55 102.13 1.05 Allowed 'General case' 0 N--CA 1.516 2.87 0 CA-C-N 113.35 -1.75 . . . . 14.67 109.719 -167.701 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 65.1 m-85 -122.63 154.5 37.92 Favored 'General case' 0 C--O 1.253 1.242 0 CA-C-N 115.303 -0.862 . . . . 13.789999999999999 111.091 -169.068 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 53.2 mttt -86.1 -8.16 58.08 Favored 'General case' 0 C--N 1.299 -1.617 0 C-N-CA 117.483 -1.687 . . . . 38.890000000000001 113.807 179.216 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 58.8 p -151.18 158.22 43.67 Favored 'General case' 0 C--O 1.257 1.497 0 C-N-CA 118.965 -1.094 . . . . 14.67 109.541 177.332 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.42 ' HB2' ' CE2' ' A' ' 21' ' ' TYR . . . -65.19 -30.03 70.9 Favored 'General case' 0 C--O 1.263 1.774 0 C-N-CA 118.181 -1.408 . . . . 10.199999999999999 112.181 174.329 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 50.7 mp0 -70.53 -38.96 74.28 Favored 'General case' 0 C--O 1.25 1.084 0 CA-C-N 119.015 0.825 . . . . 12.66 112.297 -179.609 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 39.7 m-20 -69.98 -38.41 76.04 Favored 'General case' 0 C--O 1.261 1.694 0 C-N-CA 116.903 -1.919 . . . . 40.899999999999999 112.439 175.361 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 41.7 t -62.38 -44.83 95.53 Favored 'General case' 0 C--O 1.269 2.097 0 O-C-N 124.649 1.218 . . . . 13.35 110.661 179.107 175.829 -90.966 -87.869 105.682 2.024 104.041 -119.385 -66.365 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 92.5 mmm -71.71 -35.28 70.17 Favored 'General case' 0 C--O 1.256 1.415 0 C-N-CA 115.823 -2.351 . . . . 12.609999999999999 111.884 179.237 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 10.1 ttp180 -61.6 -38.16 86.56 Favored 'General case' 0 C--O 1.261 1.685 0 N-CA-C 108.361 -0.977 . . . . 33.780000000000001 108.361 -179.238 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 46.9 m -81.6 -41.67 21.18 Favored 'General case' 0 C--N 1.308 -1.231 0 C-N-CA 118.664 -1.214 . . . . 14.279999999999999 111.658 -179.773 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 86.3 m -111.38 -7.86 14.35 Favored 'General case' 0 C--N 1.294 -1.805 0 CA-C-N 120.231 1.378 . . . . 14.51 113.444 -165.719 -70.546 -65.334 -81.435 101.939 2.05 104.013 -83.811 -64.766 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -75.62 -5.6 78.94 Favored Glycine 0 C--N 1.285 -2.275 0 C-N-CA 117.505 -2.283 . . . . 30.75 113.582 -167.502 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 84.06 167.71 42.74 Favored Glycine 0 C--O 1.26 1.747 0 C-N-CA 125.67 1.605 . . . . 40.530000000000001 110.18 164.335 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.267 2.026 0 CA-C-N 114.413 -0.893 . . . . 50.07 111.802 179.216 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 158' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 159' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 160' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_