data_1kfm_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 1kfm _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 ' 2' ' ' SER . . . . . . . . . . . . . 4.6 p . . . . . 0 N--CA 1.491 1.581 0 N-CA-C 112.725 0.639 . . . . 60.97 112.725 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . . . -68.86 -47.19 66.57 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.841 0.353 . . . . 58.19 111.839 -179.742 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -64.7 -39.3 93.42 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.178 -0.465 . . . . 54.17 111.563 -179.472 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 15.0 tppt? -56.11 -43.67 78.37 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.214 -0.448 . . . . 61.61 110.772 179.653 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 57.8 mt -72.1 -35.12 52.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 N-CA-C 113.334 0.864 . . . . 51.05 113.334 -179.194 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 41.1 m-20 -78.97 -13.58 59.71 Favored 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 118.464 -1.294 . . . . 57.34 111.12 179.73 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 5.0 tp60 -80.18 -34.6 37.38 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 103.753 -2.684 . . . . 58.34 103.753 177.012 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 91.0 mt -70.74 -47.0 61.96 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.271 -0.877 . . . . 48.08 109.218 178.848 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 75.3 m -51.56 -47.13 63.57 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 109.338 -0.616 . . . . 48.23 109.338 179.447 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 69.6 m -62.65 -50.56 70.72 Favored 'General case' 0 C--O 1.226 -0.179 0 CA-C-N 115.853 -0.612 . . . . 50.42 110.705 179.35 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . . . -54.15 -47.1 72.3 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 116.676 -0.238 . . . . 42.94 111.119 -179.918 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 71.9 t -63.4 -37.0 78.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.398 -0.365 . . . . 41.3 110.502 179.774 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . . . -64.36 -45.5 87.49 Favored 'General case' 0 C--N 1.333 -0.147 0 N-CA-C 109.924 -0.399 . . . . 45.35 109.924 179.601 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 32.4 m -62.47 -45.84 91.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.694 -0.685 . . . . 49.82 110.612 179.521 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 96.0 mt -59.96 -41.66 92.39 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.108 -0.496 . . . . 47.83 110.397 179.627 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -56.64 -46.51 80.98 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.22 -0.445 . . . . 52.49 110.212 179.871 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.56 -36.76 84.84 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.198 -0.455 . . . . 45.73 110.459 179.443 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.7 mtpp -70.66 -36.29 73.29 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.22 0.452 . . . . 56.9 112.22 -179.973 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 68.0 t -75.88 -33.78 26.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 C-N-CA 120.749 -0.38 . . . . 50.16 111.901 -179.679 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 77.3 m-20 -66.45 -46.36 76.69 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.559 -0.456 . . . . 56.51 110.246 179.111 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -68.82 -30.47 69.03 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.0 -0.546 . . . . 63.15 112.28 -179.72 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 50.5 mt -71.36 -28.1 63.81 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 108.98 -0.748 . . . . 48.26 108.98 177.949 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 15.3 t -68.21 -39.26 82.45 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 108.427 -0.953 . . . . 48.7 108.427 178.521 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 79.5 m-20 -68.14 -38.46 82.2 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 108.288 -1.005 . . . . 47.21 108.288 178.765 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 27.3 m-20 -67.24 -38.38 85.09 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.456 -0.497 . . . . 53.88 111.171 179.138 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 97.1 t -68.06 -43.07 85.6 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 CA-C-O 120.855 0.36 . . . . 41.01 110.739 -179.927 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 32.5 t30 -59.73 -42.51 93.28 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.141 -0.688 . . . . 43.47 109.141 179.473 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.7 -39.14 87.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.782 -0.645 . . . . 37.33 112.661 179.51 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -70.49 -34.87 72.84 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.045 0.45 . . . . 34.29 109.932 179.853 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.76 -47.71 74.31 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 123.352 0.661 . . . . 57.34 109.435 179.556 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 26.6 t -63.15 -43.54 98.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.502 -0.772 . . . . 44.88 111.316 179.583 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 18.5 m-20 -61.75 -46.75 88.25 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.997 -0.547 . . . . 47.59 110.946 179.491 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -64.42 -38.75 92.13 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-N 116.002 -0.544 . . . . 29.75 112.145 -178.84 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 59.1 tp60 -67.49 -38.36 84.24 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.08 0.467 . . . . 48.49 110.08 179.898 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -66.79 -36.17 81.79 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.838 -0.619 . . . . 30.72 111.129 179.645 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -70.49 -40.85 73.35 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 121.744 0.783 . . . . 31.18 108.888 179.528 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 22.5 ttmm -60.67 -45.17 95.15 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.061 -0.972 . . . . 51.45 109.899 178.728 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 76.8 m-20 -68.09 -37.88 81.7 Favored 'General case' 0 C--O 1.225 -0.189 0 C-N-CA 120.926 -0.309 . . . . 48.38 111.596 179.939 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -69.2 -37.32 78.04 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 119.057 -1.057 . . . . 39.61 110.275 -179.997 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -68.66 -32.92 73.11 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 109.857 -0.423 . . . . 29.65 109.857 179.253 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.77 -38.47 80.06 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 108.187 -1.042 . . . . 31.05 108.187 178.196 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 52.8 ttp85 -64.38 -47.67 78.37 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 109.461 -0.57 . . . . 49.54 109.461 179.931 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -54.21 -50.99 65.83 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.331 -0.395 . . . . 27.85 110.05 179.031 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 48.8 m-20 -64.78 -26.5 68.38 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 115.157 1.54 . . . . 31.78 115.157 -179.772 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 85.3 mt-30 -77.87 -37.67 47.64 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 108.54 -0.911 . . . . 42.15 108.54 177.935 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 80.3 mtp180 -66.81 -32.45 73.74 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 108.043 -1.095 . . . . 36.05 108.043 178.572 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 16.9 mt -70.09 -38.44 75.68 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 109.58 -0.526 . . . . 37.46 109.58 178.105 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 62.8 m-20 -61.71 -37.15 83.11 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 120.667 -0.413 . . . . 50.16 111.349 179.466 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 67.7 m-20 -76.52 6.62 5.5 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 113.483 0.92 . . . . 57.22 113.483 -179.485 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 77.7 mtp . . . . . 0 C--O 1.254 1.324 0 CA-C-O 117.95 -1.024 . . . . 64.74 111.81 -179.695 . . . . . . . . 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 build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.6 p . . . . . 0 N--CA 1.491 1.581 0 N-CA-C 112.725 0.639 . . . . 60.969999999999999 112.725 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . . . -68.86 -47.19 66.57 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.841 0.353 . . . . 58.189999999999998 111.839 -179.742 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -64.7 -39.3 93.42 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.178 -0.465 . . . . 54.170000000000002 111.563 -179.472 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' LYS . . . . . 0.423 ' O ' ' HG ' ' A' ' 9' ' ' LEU . 15.0 tppt? -56.11 -43.67 78.37 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.214 -0.448 . . . . 61.609999999999999 110.772 179.653 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 57.8 mt -72.1 -35.12 52.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 N-CA-C 113.334 0.864 . . . . 51.049999999999997 113.334 -179.194 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 41.1 m-20 -78.97 -13.58 59.71 Favored 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 118.464 -1.294 . . . . 57.340000000000003 111.12 179.73 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 5.0 tp60 -80.18 -34.6 37.38 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 103.753 -2.684 . . . . 58.340000000000003 103.753 177.012 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' LEU . . . . . 0.423 ' HG ' ' O ' ' A' ' 5' ' ' LYS . 91.0 mt -70.74 -47.0 61.96 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.271 -0.877 . . . . 48.079999999999998 109.218 178.848 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 75.3 m -51.56 -47.13 63.57 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 109.338 -0.616 . . . . 48.229999999999997 109.338 179.447 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 69.6 m -62.65 -50.56 70.72 Favored 'General case' 0 C--O 1.226 -0.179 0 CA-C-N 115.853 -0.612 . . . . 50.420000000000002 110.705 179.35 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ASP . . . . . 0.45 ' O ' ' HG ' ' A' ' 16' ' ' LEU . . . -54.15 -47.1 72.3 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 116.676 -0.238 . . . . 42.939999999999998 111.119 -179.918 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 71.9 t -63.4 -37.0 78.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.398 -0.365 . . . . 41.299999999999997 110.502 179.774 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . . . -64.36 -45.5 87.49 Favored 'General case' 0 C--N 1.333 -0.147 0 N-CA-C 109.924 -0.399 . . . . 45.350000000000001 109.924 179.601 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 32.4 m -62.47 -45.84 91.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.694 -0.685 . . . . 49.82 110.612 179.521 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' LEU . . . . . 0.45 ' HG ' ' O ' ' A' ' 12' ' ' ASP . 96.0 mt -59.96 -41.66 92.39 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.108 -0.496 . . . . 47.829999999999998 110.397 179.627 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -56.64 -46.51 80.98 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.22 -0.445 . . . . 52.490000000000002 110.212 179.871 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.56 -36.76 84.84 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.198 -0.455 . . . . 45.729999999999997 110.459 179.443 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' LYS . . . . . 0.489 ' O ' ' HG ' ' A' ' 23' ' ' LEU . 14.7 mtpp -70.66 -36.29 73.29 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.22 0.452 . . . . 56.899999999999999 112.22 -179.973 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 68.0 t -75.88 -33.78 26.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 C-N-CA 120.749 -0.38 . . . . 50.159999999999997 111.901 -179.679 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 77.3 m-20 -66.45 -46.36 76.69 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.559 -0.456 . . . . 56.509999999999998 110.246 179.111 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -68.82 -30.47 69.03 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.0 -0.546 . . . . 63.149999999999999 112.28 -179.72 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 23' ' ' LEU . . . . . 0.731 ' O ' HG23 ' A' ' 27' ' ' VAL . 50.5 mt -71.36 -28.1 63.81 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 108.98 -0.748 . . . . 48.259999999999998 108.98 177.949 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 15.3 t -68.21 -39.26 82.45 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 108.427 -0.953 . . . . 48.700000000000003 108.427 178.521 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ASN . . . . . 0.456 ' HB3' ' O ' ' A' ' 106' ' ' HOH . 79.5 m-20 -68.14 -38.46 82.2 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 108.288 -1.005 . . . . 47.210000000000001 108.288 178.765 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 27.3 m-20 -67.24 -38.38 85.09 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.456 -0.497 . . . . 53.880000000000003 111.171 179.138 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' VAL . . . . . 0.731 HG23 ' O ' ' A' ' 23' ' ' LEU . 97.1 t -68.06 -43.07 85.6 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 CA-C-O 120.855 0.36 . . . . 41.009999999999998 110.739 -179.927 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 32.5 t30 -59.73 -42.51 93.28 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.141 -0.688 . . . . 43.469999999999999 109.141 179.473 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.7 -39.14 87.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.782 -0.645 . . . . 37.329999999999998 112.661 179.51 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -70.49 -34.87 72.84 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.045 0.45 . . . . 34.289999999999999 109.932 179.853 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.76 -47.71 74.31 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 123.352 0.661 . . . . 57.340000000000003 109.435 179.556 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 26.6 t -63.15 -43.54 98.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.502 -0.772 . . . . 44.880000000000003 111.316 179.583 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 18.5 m-20 -61.75 -46.75 88.25 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.997 -0.547 . . . . 47.590000000000003 110.946 179.491 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -64.42 -38.75 92.13 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-N 116.002 -0.544 . . . . 29.75 112.145 -178.84 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 9.6 tp-100 -67.49 -38.36 84.24 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.08 0.467 . . . . 48.490000000000002 110.08 179.898 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -66.79 -36.17 81.79 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.838 -0.619 . . . . 30.719999999999999 111.129 179.645 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -70.49 -40.85 73.35 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 121.744 0.783 . . . . 31.18 108.888 179.528 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 22.5 ttmm -60.67 -45.17 95.15 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.061 -0.972 . . . . 51.450000000000003 109.899 178.728 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 76.8 m-20 -68.09 -37.88 81.7 Favored 'General case' 0 C--O 1.225 -0.189 0 C-N-CA 120.926 -0.309 . . . . 48.380000000000003 111.596 179.939 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -69.2 -37.32 78.04 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 119.057 -1.057 . . . . 39.609999999999999 110.275 -179.997 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -68.66 -32.92 73.11 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 109.857 -0.423 . . . . 29.649999999999999 109.857 179.253 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ALA . . . . . 0.4 ' O ' ' HG3' ' A' ' 46' ' ' GLN . . . -68.77 -38.47 80.06 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 108.187 -1.042 . . . . 31.050000000000001 108.187 178.196 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 52.8 ttp85 -64.38 -47.67 78.37 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 109.461 -0.57 . . . . 49.539999999999999 109.461 179.931 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -54.21 -50.99 65.83 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.331 -0.395 . . . . 27.850000000000001 110.05 179.031 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 48.8 m-20 -64.78 -26.5 68.38 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 115.157 1.54 . . . . 31.780000000000001 115.157 -179.772 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' GLN . . . . . 0.4 ' HG3' ' O ' ' A' ' 42' ' ' ALA . 85.3 mt-30 -77.87 -37.67 47.64 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 108.54 -0.911 . . . . 42.149999999999999 108.54 177.935 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 80.3 mtp180 -66.81 -32.45 73.74 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 108.043 -1.095 . . . . 36.049999999999997 108.043 178.572 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 16.9 mt -70.09 -38.44 75.68 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 109.58 -0.526 . . . . 37.460000000000001 109.58 178.105 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 62.8 m-20 -61.71 -37.15 83.11 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 120.667 -0.413 . . . . 50.159999999999997 111.349 179.466 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 67.7 m-20 -76.52 6.62 5.5 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 113.483 0.92 . . . . 57.219999999999999 113.483 -179.485 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 77.7 mtp . . . . . 0 C--O 1.254 1.324 0 CA-C-O 117.95 -1.024 . . . . 64.739999999999995 111.81 -179.695 . . . . . . . . 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 . . . . . 0.456 ' O ' ' HB3' ' A' ' 25' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.6 p . . . . . 0 N--CA 1.491 1.581 0 N-CA-C 112.725 0.639 . . . . 60.97 112.725 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . . . -68.86 -47.19 66.57 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.841 0.353 . . . . 58.19 111.839 -179.742 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -64.7 -39.3 93.42 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.178 -0.465 . . . . 54.17 111.563 -179.472 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.423 ' O ' ' HG ' ' A' ' 9' ' ' LEU . 15.0 tppt? -56.11 -43.67 78.37 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.214 -0.448 . . . . 61.61 110.772 179.653 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 57.8 mt -72.1 -35.12 52.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 N-CA-C 113.334 0.864 . . . . 51.05 113.334 -179.194 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 41.1 m-20 -78.97 -13.58 59.71 Favored 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 118.464 -1.294 . . . . 57.34 111.12 179.73 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 5.0 tp60 -80.18 -34.6 37.38 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 103.753 -2.684 . . . . 58.34 103.753 177.012 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.423 ' HG ' ' O ' ' A' ' 5' ' ' LYS . 91.0 mt -70.74 -47.0 61.96 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.271 -0.877 . . . . 48.08 109.218 178.848 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 75.3 m -51.56 -47.13 63.57 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 109.338 -0.616 . . . . 48.23 109.338 179.447 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 69.6 m -62.65 -50.56 70.72 Favored 'General case' 0 C--O 1.226 -0.179 0 CA-C-N 115.853 -0.612 . . . . 50.42 110.705 179.35 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.45 ' O ' ' HG ' ' A' ' 16' ' ' LEU . . . -54.15 -47.1 72.3 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 116.676 -0.238 . . . . 42.94 111.119 -179.918 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 71.9 t -63.4 -37.0 78.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.398 -0.365 . . . . 41.3 110.502 179.774 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . . . -64.36 -45.5 87.49 Favored 'General case' 0 C--N 1.333 -0.147 0 N-CA-C 109.924 -0.399 . . . . 45.35 109.924 179.601 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 32.4 m -62.47 -45.84 91.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.694 -0.685 . . . . 49.82 110.612 179.521 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.45 ' HG ' ' O ' ' A' ' 12' ' ' ASP . 96.0 mt -59.96 -41.66 92.39 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.108 -0.496 . . . . 47.83 110.397 179.627 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -56.64 -46.51 80.98 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.22 -0.445 . . . . 52.49 110.212 179.871 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.56 -36.76 84.84 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.198 -0.455 . . . . 45.73 110.459 179.443 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.489 ' O ' ' HG ' ' A' ' 23' ' ' LEU . 14.7 mtpp -70.66 -36.29 73.29 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.22 0.452 . . . . 56.9 112.22 -179.973 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 68.0 t -75.88 -33.78 26.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 C-N-CA 120.749 -0.38 . . . . 50.16 111.901 -179.679 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 77.3 m-20 -66.45 -46.36 76.69 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.559 -0.456 . . . . 56.51 110.246 179.111 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -68.82 -30.47 69.03 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.0 -0.546 . . . . 63.15 112.28 -179.72 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.731 ' O ' HG23 ' A' ' 27' ' ' VAL . 50.5 mt -71.36 -28.1 63.81 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 108.98 -0.748 . . . . 48.26 108.98 177.949 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 15.3 t -68.21 -39.26 82.45 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 108.427 -0.953 . . . . 48.7 108.427 178.521 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.456 ' HB3' ' O ' ' A' ' 106' ' ' HOH . 79.5 m-20 -68.14 -38.46 82.2 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 108.288 -1.005 . . . . 47.21 108.288 178.765 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 27.3 m-20 -67.24 -38.38 85.09 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.456 -0.497 . . . . 53.88 111.171 179.138 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.731 HG23 ' O ' ' A' ' 23' ' ' LEU . 97.1 t -68.06 -43.07 85.6 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 CA-C-O 120.855 0.36 . . . . 41.01 110.739 -179.927 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 32.5 t30 -59.73 -42.51 93.28 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.141 -0.688 . . . . 43.47 109.141 179.473 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.7 -39.14 87.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.782 -0.645 . . . . 37.33 112.661 179.51 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -70.49 -34.87 72.84 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.045 0.45 . . . . 34.29 109.932 179.853 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.76 -47.71 74.31 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 123.352 0.661 . . . . 57.34 109.435 179.556 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 26.6 t -63.15 -43.54 98.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.502 -0.772 . . . . 44.88 111.316 179.583 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 18.5 m-20 -61.75 -46.75 88.25 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.997 -0.547 . . . . 47.59 110.946 179.491 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -64.42 -38.75 92.13 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-N 116.002 -0.544 . . . . 29.75 112.145 -178.84 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 59.1 tp60 -67.49 -38.36 84.24 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.08 0.467 . . . . 48.49 110.08 179.898 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -66.79 -36.17 81.79 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.838 -0.619 . . . . 30.72 111.129 179.645 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -70.49 -40.85 73.35 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 121.744 0.783 . . . . 31.18 108.888 179.528 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 22.5 ttmm -60.67 -45.17 95.15 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.061 -0.972 . . . . 51.45 109.899 178.728 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 76.8 m-20 -68.09 -37.88 81.7 Favored 'General case' 0 C--O 1.225 -0.189 0 C-N-CA 120.926 -0.309 . . . . 48.38 111.596 179.939 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -69.2 -37.32 78.04 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 119.057 -1.057 . . . . 39.61 110.275 -179.997 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -68.66 -32.92 73.11 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 109.857 -0.423 . . . . 29.65 109.857 179.253 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.4 ' O ' ' HG3' ' A' ' 46' ' ' GLN . . . -68.77 -38.47 80.06 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 108.187 -1.042 . . . . 31.05 108.187 178.196 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 52.8 ttp85 -64.38 -47.67 78.37 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 109.461 -0.57 . . . . 49.54 109.461 179.931 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -54.21 -50.99 65.83 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.331 -0.395 . . . . 27.85 110.05 179.031 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 48.8 m-20 -64.78 -26.5 68.38 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 115.157 1.54 . . . . 31.78 115.157 -179.772 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.4 ' HG3' ' O ' ' A' ' 42' ' ' ALA . 85.3 mt-30 -77.87 -37.67 47.64 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 108.54 -0.911 . . . . 42.15 108.54 177.935 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 80.3 mtp180 -66.81 -32.45 73.74 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 108.043 -1.095 . . . . 36.05 108.043 178.572 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 16.9 mt -70.09 -38.44 75.68 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 109.58 -0.526 . . . . 37.46 109.58 178.105 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 62.8 m-20 -61.71 -37.15 83.11 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 120.667 -0.413 . . . . 50.16 111.349 179.466 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 67.7 m-20 -76.52 6.62 5.5 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 113.483 0.92 . . . . 57.22 113.483 -179.485 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 77.7 mtp . . . . . 0 C--O 1.254 1.324 0 CA-C-O 117.95 -1.024 . . . . 64.74 111.81 -179.695 . . . . . . . . 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 . . . . . 0.456 ' O ' ' HB3' ' A' ' 25' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 stop_ save_