data_2x6p_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 2x6p _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 ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.181 . . . . . . . . 43.08 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -83.79 -45.69 13.05 Favored 'General case' 0 CA--C 1.495 -1.163 0 C-N-CA 126.476 1.91 . . . . 52.87 111.962 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 38.8 t-105 -49.64 -53.84 21.9 Favored 'General case' 0 C--O 1.207 -1.161 0 C-N-CA 118.086 -1.446 . . . . 55.55 113.811 172.057 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -68.35 -28.77 67.43 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 117.742 2.497 . . . . 44.2 117.742 178.03 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -66.27 -41.1 90.35 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 120.483 -0.487 . . . . 36.75 109.776 170.54 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.6 tp -60.43 -43.21 97.02 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 122.965 0.506 . . . . 48.82 110.59 175.18 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 64.5 mt-10 -64.68 -36.05 83.03 Favored 'General case' 0 N--CA 1.423 -1.809 0 C-N-CA 120.08 -0.648 . . . . 33.36 110.798 -178.541 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 12.0 mmtm -75.52 -27.68 58.82 Favored 'General case' 0 N--CA 1.49 1.561 0 CA-C-O 122.019 0.914 . . . . 56.09 112.294 -178.498 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' LYS . . . . . 0.498 ' NZ ' ' O ' ' A' 2001 ' ' HOH . 42.9 mttt -70.55 -39.71 73.83 Favored 'General case' 0 C--O 1.265 1.902 0 CA-C-O 122.536 1.16 . . . . 44.72 109.894 175.727 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.6 tp -66.2 -42.26 89.02 Favored 'General case' 0 N--CA 1.407 -2.595 0 CA-C-N 113.84 -1.527 . . . . 45.15 109.23 176.777 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.69 -45.26 94.87 Favored 'General case' 0 N--CA 1.478 0.928 0 O-C-N 120.026 -1.671 . . . . 36.32 114.917 174.978 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -62.28 -44.18 97.12 Favored 'General case' 0 C--O 1.195 -1.795 0 CA-C-O 118.644 -0.693 . . . . 39.46 110.65 175.707 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' LEU . . . . . 0.454 ' CD2' ' O ' ' A' ' 8' ' ' LYS . 4.2 mm? -53.67 -42.93 68.43 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 119.968 1.258 . . . . 45.95 108.989 175.753 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' GLU . . . . . 0.4 ' O ' ' CG ' ' A' ' 17' ' ' GLN . 59.5 mt-10 -64.05 -39.13 93.41 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 121.767 0.794 . . . . 54.1 112.147 -177.748 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.3 t -73.19 -44.41 59.86 Favored 'General case' 0 CA--C 1.554 1.107 0 CA-C-N 115.269 -0.878 . . . . 47.53 112.609 179.477 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 65.5 mttt -54.97 -48.63 72.99 Favored 'General case' 0 C--O 1.248 1.018 0 C-N-CA 123.913 0.885 . . . . 54.25 112.03 170.635 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 37.1 tp -63.42 -40.17 96.47 Favored 'General case' 0 C--O 1.252 1.226 0 N-CA-C 109.722 -0.474 . . . . 40.34 109.722 -178.941 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' GLN . . . . . 0.4 ' CG ' ' O ' ' A' ' 13' ' ' GLU . 20.3 mm-40 -62.18 -40.88 97.5 Favored 'General case' 0 CA--C 1.509 -0.612 0 CA-C-O 116.897 -1.525 . . . . 67.94 113.007 174.331 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.7 -46.84 86.4 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 125.121 1.368 . . . . 44.83 113.582 173.127 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.7 m -50.3 -52.32 37.69 Favored 'General case' 0 N--CA 1.488 1.447 0 N-CA-C 116.806 2.15 . . . . 59.98 116.806 163.269 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 74.3 mt-10 -52.66 -36.37 56.77 Favored 'General case' 0 C--O 1.243 0.711 0 O-C-N 124.587 1.179 . . . . 57.44 110.447 176.908 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 40.7 mtmt -79.45 -43.19 23.75 Favored 'General case' 0 C--O 1.178 -2.672 0 N-CA-C 114.019 1.118 . . . . 68.81 114.019 -177.56 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' LYS . . . . . 0.404 ' NZ ' ' OE2' ' B' ' 27' ' ' GLU . 32.0 tttp -55.9 -53.94 50.71 Favored 'General case' 0 C--O 1.175 -2.854 0 C-N-CA 124.987 1.315 . . . . 58.34 108.67 168.275 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -49.62 -42.2 44.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.461 . . . . 45.63 111.347 -179.729 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' GLU . . . . . 0.794 ' OE2' ' NZ ' ' C' ' 22' ' ' LYS . 6.5 mm-40 -66.95 -56.98 7.84 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.253 -0.43 . . . . 55.64 111.332 -179.761 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.13 -21.05 65.85 Favored 'General case' 0 CA--C 1.583 2.24 0 N-CA-C 116.545 2.054 . . . . 52.87 116.545 -179.771 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.5 mp -68.06 -42.02 81.11 Favored 'General case' 0 C--O 1.214 -0.773 0 O-C-N 119.741 -1.849 . . . . 60.95 110.181 158.459 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 58.7 tt0 -55.69 -32.18 63.06 Favored 'General case' 0 C--O 1.201 -1.485 0 C-N-CA 118.913 -1.115 . . . . 54.43 110.726 177.846 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 77.3 m-70 -104.17 -156.66 0.58 Allowed 'General case' 0 N--CA 1.51 2.542 0 N-CA-C 116.624 2.083 . . . . 60.39 116.624 -178.327 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.55 2.264 0 CA-C-N 115.705 -0.68 . . . . 65.89 114.424 176.642 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.071 . . . . . . . . 62.18 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 1' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -56.14 -26.12 48.98 Favored 'General case' 0 CA--C 1.558 1.27 0 C-N-CA 125.071 1.349 . . . . 61.94 113.076 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 76.3 t-105 -68.98 -52.04 33.16 Favored 'General case' 0 CA--C 1.5 -0.963 0 N-CA-C 113.217 0.821 . . . . 55.91 113.217 -166.853 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.36 -26.41 46.66 Favored 'General case' 0 N--CA 1.438 -1.039 0 N-CA-C 108.341 -0.985 . . . . 72.92 108.341 -175.372 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -60.81 -54.38 45.87 Favored 'General case' 0 C--O 1.27 2.179 0 CA-C-O 121.289 0.566 . . . . 48.96 110.968 170.758 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 1.5 tt -56.81 -42.97 80.51 Favored 'General case' 0 CA--C 1.561 1.397 0 CA-C-O 118.162 -0.923 . . . . 49.98 112.964 173.601 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -59.87 -38.46 82.23 Favored 'General case' 0 C--O 1.251 1.154 0 CA-C-N 119.317 0.962 . . . . 46.22 112.212 176.399 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 1.9 mmtt -67.45 -40.42 85.4 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 107.468 -1.308 . . . . 66.88 107.468 179.862 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' LYS . . . . . 0.467 ' CE ' ' CD2' ' C' ' 9' ' ' LEU . 1.8 tttt -67.54 -40.75 84.99 Favored 'General case' 0 N--CA 1.44 -0.937 0 CA-C-O 118.083 -0.961 . . . . 63.6 109.962 -178.772 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 12.5 tp -63.01 -48.71 77.62 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 113.358 0.873 . . . . 43.08 113.358 172.287 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -52.52 -42.77 64.63 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-O 116.722 -1.609 . . . . 37.76 114.723 170.942 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.58 -42.31 87.18 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 119.827 1.194 . . . . 37.16 110.328 178.305 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 7.6 mp -62.46 -47.27 84.77 Favored 'General case' 0 CA--C 1.473 -1.998 0 N-CA-C 114.133 1.16 . . . . 51.85 114.133 177.064 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 54.3 tt0 -53.43 -40.42 65.14 Favored 'General case' 0 CA--C 1.55 0.973 0 O-C-N 124.519 1.137 . . . . 58.57 113.765 174.734 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 84.2 p -80.0 -33.33 39.38 Favored 'General case' 0 N--CA 1.413 -2.294 0 O-C-N 119.849 -1.782 . . . . 41.99 110.675 179.001 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' LYS . . . . . 0.594 ' NZ ' ' O ' ' B' 2006 ' ' HOH . 33.5 mttt -60.8 -38.97 87.17 Favored 'General case' 0 N--CA 1.487 1.385 0 CA-C-O 122.589 1.185 . . . . 54.66 110.593 172.529 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 41.3 tp -68.77 -37.2 79.16 Favored 'General case' 0 C--O 1.192 -1.926 0 O-C-N 120.469 -1.395 . . . . 45.29 111.295 178.96 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -62.93 -43.88 97.58 Favored 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 124.317 1.047 . . . . 61.42 109.326 178.988 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.96 -46.48 87.96 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 107.954 -1.128 . . . . 37.51 107.954 176.302 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 13.1 t -61.03 -43.21 99.22 Favored 'General case' 0 N--CA 1.418 -2.042 0 N-CA-C 108.241 -1.022 . . . . 56.27 108.241 -175.952 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 72.1 mt-10 -70.57 -35.88 73.31 Favored 'General case' 0 N--CA 1.479 0.987 0 O-C-N 121.889 -0.507 . . . . 51.27 110.399 -176.733 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 20.2 mttp -67.15 -39.3 86.49 Favored 'General case' 0 C--O 1.262 1.745 0 N-CA-C 114.27 1.211 . . . . 64.83 114.27 173.331 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 61.7 mttt -72.9 -39.53 66.28 Favored 'General case' 0 C--O 1.215 -0.744 0 CA-C-O 116.574 -1.679 . . . . 59.99 107.205 178.853 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 11.5 mt -59.78 -43.45 94.38 Favored 'General case' 0 N--CA 1.491 1.6 0 CA-C-N 121.519 1.963 . . . . 50.37 112.755 175.55 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 41.0 tp10 -62.23 -43.36 99.0 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-O 118.438 -0.791 . . . . 61.04 110.426 178.186 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -56.62 -47.7 79.07 Favored 'General case' 0 N--CA 1.498 1.929 0 N-CA-C 113.404 0.89 . . . . 45.79 113.404 171.892 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 18.6 tp -58.01 -50.24 74.08 Favored 'General case' 0 CA--C 1.548 0.871 0 O-C-N 124.558 1.161 . . . . 49.47 108.78 175.645 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' GLU . . . . . 0.404 ' OE2' ' NZ ' ' A' ' 22' ' ' LYS . 54.6 tt0 -39.57 -46.41 1.76 Allowed 'General case' 0 N--CA 1.498 1.934 0 N-CA-C 115.334 1.605 . . . . 70.35 115.334 169.849 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 65.9 m-70 -92.2 6.38 46.91 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.306 0.643 . . . . 62.85 110.357 -176.053 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.183 0 N-CA-C 107.181 -2.368 . . . . 65.5 107.181 -173.12 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.245 0.865 . . . . . . . . 49.6 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 1' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -83.7 -36.22 23.89 Favored 'General case' 0 C--O 1.201 -1.48 0 C-N-CA 116.291 -2.163 . . . . 43.97 109.111 . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 2' ' ' TRP . . . . . . . . . . . . . 77.4 t-105 -48.06 -49.49 31.33 Favored 'General case' 0 N--CA 1.419 -2.003 0 CA-C-N 118.477 0.581 . . . . 64.25 109.979 178.379 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 3' ' ' GLU . . . . . . . . . . . . . 57.6 mm-40 -66.23 -25.51 66.94 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 113.635 0.976 . . . . 64.91 113.635 -176.835 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 4' ' ' ALA . . . . . . . . . . . . . . . -74.73 -41.69 59.65 Favored 'General case' 0 C--O 1.211 -0.969 0 CA-C-O 117.557 -1.211 . . . . 42.33 110.178 176.354 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 5' ' ' LEU . . . . . . . . . . . . . 98.2 mt -59.61 -43.67 93.68 Favored 'General case' 0 N--CA 1.435 -1.181 0 C-N-CA 124.172 0.989 . . . . 50.09 112.285 173.794 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 6' ' ' GLU . . . . . . . . . . . . . 66.4 mt-10 -65.55 -43.19 90.69 Favored 'General case' 0 C--O 1.188 -2.183 0 CA-C-O 118.598 -0.715 . . . . 55.86 112.512 176.691 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 7' ' ' LYS . . . . . . . . . . . . . 48.4 mmtt -60.63 -35.73 76.88 Favored 'General case' 0 C--N 1.318 -0.78 0 C-N-CA 118.416 -1.313 . . . . 72.16 114.144 175.652 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 8' ' ' LYS . . . . . . . . . . . . . 86.0 mttt -67.26 -41.58 85.33 Favored 'General case' 0 C--O 1.189 -2.095 0 CA-C-O 116.504 -1.712 . . . . 40.52 107.107 178.978 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 9' ' ' LEU . . . . . 0.467 ' CD2' ' CE ' ' B' ' 8' ' ' LYS . 9.4 tt -62.58 -42.75 99.75 Favored 'General case' 0 CA--C 1.555 1.156 0 CA-C-N 120.015 1.279 . . . . 45.75 109.968 178.485 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.46 -48.84 79.41 Favored 'General case' 0 C--O 1.219 -0.527 0 N-CA-C 113.18 0.807 . . . . 42.55 113.18 176.335 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 11' ' ' ALA . . . . . . . . . . . . . . . -59.14 -47.54 84.91 Favored 'General case' 0 C--O 1.213 -0.843 0 C-N-CA 124.888 1.275 . . . . 38.7 111.812 175.343 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 12' ' ' LEU . . . . . . . . . . . . . 34.9 mt -55.66 -43.1 75.97 Favored 'General case' 0 C--O 1.196 -1.722 0 CA-C-O 121.632 0.729 . . . . 48.74 110.899 174.457 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 54.0 tt0 -69.53 -33.42 72.78 Favored 'General case' 0 C--N 1.297 -1.699 0 N-CA-C 113.791 1.034 . . . . 63.48 113.791 -177.081 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 14' ' ' SER . . . . . . . . . . . . . 74.4 m -64.01 -43.12 96.61 Favored 'General case' 0 CA--C 1.488 -1.411 0 C-N-CA 124.353 1.061 . . . . 50.97 112.769 171.453 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 15' ' ' LYS . . . . . . . . . . . . . 18.4 mttt -69.01 -37.89 78.94 Favored 'General case' 0 C--O 1.198 -1.648 0 N-CA-C 108.108 -1.071 . . . . 63.73 108.108 178.251 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 16' ' ' LEU . . . . . . . . . . . . . 66.2 tp -62.19 -51.84 66.2 Favored 'General case' 0 CA--C 1.573 1.856 0 C-N-CA 118.966 -1.094 . . . . 41.35 112.175 178.099 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 40.9 tt0 -49.73 -39.9 38.94 Favored 'General case' 0 CA--C 1.493 -1.249 0 C-N-CA 125.397 1.479 . . . . 61.84 109.87 173.539 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.05 -43.51 64.79 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 113.136 0.791 . . . . 40.62 113.136 178.401 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 19' ' ' CYS . . . . . . . . . . . . . 5.0 t -61.6 -35.78 78.83 Favored 'General case' 0 CA--C 1.579 2.067 0 CA-C-O 121.143 0.497 . . . . 59.0 110.177 171.46 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 20' ' ' GLU . . . . . . . . . . . . . 80.1 mt-10 -66.37 -44.12 84.04 Favored 'General case' 0 C--N 1.318 -0.801 0 O-C-N 119.235 -2.166 . . . . 49.67 113.002 178.234 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 21' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -61.9 -42.6 99.27 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-O 118.095 -0.955 . . . . 60.15 111.679 175.103 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 22' ' ' LYS . . . . . 0.794 ' NZ ' ' OE2' ' A' ' 24' ' ' GLU . 32.2 tttt -62.86 -39.56 94.79 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 114.582 1.327 . . . . 64.31 114.582 173.007 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 23' ' ' LEU . . . . . . . . . . . . . 57.2 tp -63.56 -45.92 88.26 Favored 'General case' 0 C--O 1.191 -2.026 0 CA-C-O 117.76 -1.114 . . . . 36.95 112.22 176.327 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 24' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -56.48 -39.46 73.26 Favored 'General case' 0 C--O 1.245 0.854 0 CA-C-N 120.529 1.513 . . . . 34.72 111.646 173.83 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.46 -35.59 77.79 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 108.038 -1.097 . . . . 37.78 108.038 -176.789 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 92.8 mt -74.88 -33.24 62.05 Favored 'General case' 0 C--O 1.201 -1.452 0 CA-C-O 117.248 -1.358 . . . . 52.01 112.517 178.074 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 27' ' ' GLU . . . . . . . . . . . . . 70.4 mt-10 -68.88 -34.69 75.85 Favored 'General case' 0 C--O 1.176 -2.772 0 CA-C-N 119.111 0.869 . . . . 37.01 110.903 -179.811 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 28' ' ' HIS . . . . . . . . . . . . . 90.8 m-70 -118.98 -3.82 10.66 Favored 'General case' 0 N--CA 1.432 -1.34 0 N-CA-C 114.759 1.392 . . . . 37.28 114.759 -162.332 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.061 0 N-CA-C 110.852 -0.899 . . . . 52.96 110.852 176.338 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 1030 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 1031 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 1032 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 1033 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C 1030 ' ' ' ZN' . . . . . 0.716 'ZN ' ' O ' ' C' 2005 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C 1031 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2001 ' ' HOH . . . . . 0.498 ' O ' ' NZ ' ' A' ' 8' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 2002 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2003 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2004 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2005 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 2001 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 2002 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 2003 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 2004 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 2005 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 2006 ' ' HOH . . . . . 0.594 ' O ' ' NZ ' ' B' ' 15' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B 2007 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 2008 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C 2001 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C 2002 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C 2003 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C 2004 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C 2005 ' ' HOH . . . . . 0.716 ' O ' 'ZN ' ' C' 1030 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C 2006 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.181 . . . . . . . . 43.079999999999998 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -83.79 -45.69 13.05 Favored 'General case' 0 CA--C 1.495 -1.163 0 C-N-CA 126.476 1.91 . . . . 52.869999999999997 111.962 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 38.8 t-105 -49.64 -53.84 21.9 Favored 'General case' 0 C--O 1.207 -1.161 0 C-N-CA 118.086 -1.446 . . . . 55.549999999999997 113.811 172.057 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' GLU . . . . . 0.444 ' O ' ' HG2' ' A' ' 7' ' ' LYS . 94.5 mt-10 -68.35 -28.77 67.43 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 117.742 2.497 . . . . 44.200000000000003 117.742 178.03 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -66.27 -41.1 90.35 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 120.483 -0.487 . . . . 36.75 109.776 170.54 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.6 tp -60.43 -43.21 97.02 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 122.965 0.506 . . . . 48.82 110.59 175.18 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 64.5 mt-10 -64.68 -36.05 83.03 Favored 'General case' 0 N--CA 1.423 -1.809 0 C-N-CA 120.08 -0.648 . . . . 33.359999999999999 110.798 -178.541 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' LYS . . . . . 0.444 ' HG2' ' O ' ' A' ' 3' ' ' GLU . 12.0 mmtm -75.52 -27.68 58.82 Favored 'General case' 0 N--CA 1.49 1.561 0 CA-C-O 122.019 0.914 . . . . 56.090000000000003 112.294 -178.498 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 8' ' ' LYS . . . . . 0.655 ' O ' HD23 ' A' ' 12' ' ' LEU . 42.9 mttt -70.55 -39.71 73.83 Favored 'General case' 0 C--O 1.265 1.902 0 CA-C-O 122.536 1.16 . . . . 44.719999999999999 109.894 175.727 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.6 tp -66.2 -42.26 89.02 Favored 'General case' 0 N--CA 1.407 -2.595 0 CA-C-N 113.84 -1.527 . . . . 45.149999999999999 109.23 176.777 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.69 -45.26 94.87 Favored 'General case' 0 N--CA 1.478 0.928 0 O-C-N 120.026 -1.671 . . . . 36.32 114.917 174.978 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -62.28 -44.18 97.12 Favored 'General case' 0 C--O 1.195 -1.795 0 CA-C-O 118.644 -0.693 . . . . 39.460000000000001 110.65 175.707 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' LEU . . . . . 0.655 HD23 ' O ' ' A' ' 8' ' ' LYS . 4.2 mm? -53.67 -42.93 68.43 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 119.968 1.258 . . . . 45.950000000000003 108.989 175.753 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 13' ' ' GLU . . . . . 0.851 ' HG2' HD21 ' C' ' 12' ' ' LEU . 59.5 mt-10 -64.05 -39.13 93.41 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 121.767 0.794 . . . . 54.100000000000001 112.147 -177.748 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.3 t -73.19 -44.41 59.86 Favored 'General case' 0 CA--C 1.554 1.107 0 CA-C-N 115.269 -0.878 . . . . 47.530000000000001 112.609 179.477 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 65.5 mttt -54.97 -48.63 72.99 Favored 'General case' 0 C--O 1.248 1.018 0 C-N-CA 123.913 0.885 . . . . 54.25 112.03 170.635 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' LEU . . . . . 0.413 HD21 ' HB2' ' C' ' 15' ' ' LYS . 37.1 tp -63.42 -40.17 96.47 Favored 'General case' 0 C--O 1.252 1.226 0 N-CA-C 109.722 -0.474 . . . . 40.340000000000003 109.722 -178.941 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 17' ' ' GLN . . . . . 0.794 ' HG2' ' O ' ' A' ' 13' ' ' GLU . 20.3 mm-40 -62.18 -40.88 97.5 Favored 'General case' 0 CA--C 1.509 -0.612 0 CA-C-O 116.897 -1.525 . . . . 67.939999999999998 113.007 174.331 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.7 -46.84 86.4 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 125.121 1.368 . . . . 44.829999999999998 113.582 173.127 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.7 m -50.3 -52.32 37.69 Favored 'General case' 0 N--CA 1.488 1.447 0 N-CA-C 116.806 2.15 . . . . 59.979999999999997 116.806 163.269 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 74.3 mt-10 -52.66 -36.37 56.77 Favored 'General case' 0 C--O 1.243 0.711 0 O-C-N 124.587 1.179 . . . . 57.439999999999998 110.447 176.908 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 40.7 mtmt -79.45 -43.19 23.75 Favored 'General case' 0 C--O 1.178 -2.672 0 N-CA-C 114.019 1.118 . . . . 68.810000000000002 114.019 -177.56 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 32.0 tttp -55.9 -53.94 50.71 Favored 'General case' 0 C--O 1.175 -2.854 0 C-N-CA 124.987 1.315 . . . . 58.340000000000003 108.67 168.275 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' LEU . . . . . 0.493 HD13 HD21 ' B' ' 23' ' ' LEU . 1.0 OUTLIER -49.62 -42.2 44.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.461 . . . . 45.630000000000003 111.347 -179.729 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 24' ' ' GLU . . . . . 0.794 ' OE2' ' NZ ' ' C' ' 22' ' ' LYS . 6.5 mm-40 -66.95 -56.98 7.84 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.253 -0.43 . . . . 55.640000000000001 111.332 -179.761 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.13 -21.05 65.85 Favored 'General case' 0 CA--C 1.583 2.24 0 N-CA-C 116.545 2.054 . . . . 52.869999999999997 116.545 -179.771 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.5 mp -68.06 -42.02 81.11 Favored 'General case' 0 C--O 1.214 -0.773 0 O-C-N 119.741 -1.849 . . . . 60.950000000000003 110.181 158.459 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' GLU . . . . . 0.547 ' OE1' ' HE3' ' C' ' 22' ' ' LYS . 58.7 tt0 -55.69 -32.18 63.06 Favored 'General case' 0 C--O 1.201 -1.485 0 C-N-CA 118.913 -1.115 . . . . 54.43 110.726 177.846 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 77.3 m-70 -104.17 -156.66 0.58 Allowed 'General case' 0 N--CA 1.51 2.542 0 N-CA-C 116.624 2.083 . . . . 60.390000000000001 116.624 -178.327 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.55 2.264 0 CA-C-N 115.705 -0.68 . . . . 65.890000000000001 114.424 176.642 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.071 . . . . . . . . 62.18 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 1' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -56.14 -26.12 48.98 Favored 'General case' 0 CA--C 1.558 1.27 0 C-N-CA 125.071 1.349 . . . . 61.939999999999998 113.076 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 76.3 t-105 -68.98 -52.04 33.16 Favored 'General case' 0 CA--C 1.5 -0.963 0 N-CA-C 113.217 0.821 . . . . 55.909999999999997 113.217 -166.853 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.36 -26.41 46.66 Favored 'General case' 0 N--CA 1.438 -1.039 0 N-CA-C 108.341 -0.985 . . . . 72.920000000000002 108.341 -175.372 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -60.81 -54.38 45.87 Favored 'General case' 0 C--O 1.27 2.179 0 CA-C-O 121.289 0.566 . . . . 48.960000000000001 110.968 170.758 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 1.5 tt -56.81 -42.97 80.51 Favored 'General case' 0 CA--C 1.561 1.397 0 CA-C-O 118.162 -0.923 . . . . 49.979999999999997 112.964 173.601 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -59.87 -38.46 82.23 Favored 'General case' 0 C--O 1.251 1.154 0 CA-C-N 119.317 0.962 . . . . 46.219999999999999 112.212 176.399 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 1.9 mmtt -67.45 -40.42 85.4 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 107.468 -1.308 . . . . 66.879999999999995 107.468 179.862 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 8' ' ' LYS . . . . . 0.909 ' HE2' ' CD2' ' C' ' 9' ' ' LEU . 1.8 tttt -67.54 -40.75 84.99 Favored 'General case' 0 N--CA 1.44 -0.937 0 CA-C-O 118.083 -0.961 . . . . 63.600000000000001 109.962 -178.772 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 12.5 tp -63.01 -48.71 77.62 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 113.358 0.873 . . . . 43.079999999999998 113.358 172.287 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -52.52 -42.77 64.63 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-O 116.722 -1.609 . . . . 37.759999999999998 114.723 170.942 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.58 -42.31 87.18 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 119.827 1.194 . . . . 37.159999999999997 110.328 178.305 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 7.6 mp -62.46 -47.27 84.77 Favored 'General case' 0 CA--C 1.473 -1.998 0 N-CA-C 114.133 1.16 . . . . 51.850000000000001 114.133 177.064 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 54.3 tt0 -53.43 -40.42 65.14 Favored 'General case' 0 CA--C 1.55 0.973 0 O-C-N 124.519 1.137 . . . . 58.57 113.765 174.734 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 84.2 p -80.0 -33.33 39.38 Favored 'General case' 0 N--CA 1.413 -2.294 0 O-C-N 119.849 -1.782 . . . . 41.990000000000002 110.675 179.001 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' LYS . . . . . 0.594 ' NZ ' ' O ' ' B' 2006 ' ' HOH . 33.5 mttt -60.8 -38.97 87.17 Favored 'General case' 0 N--CA 1.487 1.385 0 CA-C-O 122.589 1.185 . . . . 54.659999999999997 110.593 172.529 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 41.3 tp -68.77 -37.2 79.16 Favored 'General case' 0 C--O 1.192 -1.926 0 O-C-N 120.469 -1.395 . . . . 45.289999999999999 111.295 178.96 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -62.93 -43.88 97.58 Favored 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 124.317 1.047 . . . . 61.420000000000002 109.326 178.988 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.96 -46.48 87.96 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 107.954 -1.128 . . . . 37.509999999999998 107.954 176.302 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 13.1 t -61.03 -43.21 99.22 Favored 'General case' 0 N--CA 1.418 -2.042 0 N-CA-C 108.241 -1.022 . . . . 56.270000000000003 108.241 -175.952 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 72.1 mt-10 -70.57 -35.88 73.31 Favored 'General case' 0 N--CA 1.479 0.987 0 O-C-N 121.889 -0.507 . . . . 51.270000000000003 110.399 -176.733 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 20.2 mttp -67.15 -39.3 86.49 Favored 'General case' 0 C--O 1.262 1.745 0 N-CA-C 114.27 1.211 . . . . 64.829999999999998 114.27 173.331 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 22' ' ' LYS . . . . . 0.47 ' HE2' ' O ' ' C' 2006 ' ' HOH . 61.7 mttt -72.9 -39.53 66.28 Favored 'General case' 0 C--O 1.215 -0.744 0 CA-C-O 116.574 -1.679 . . . . 59.990000000000002 107.205 178.853 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 23' ' ' LEU . . . . . 0.493 HD21 HD13 ' A' ' 23' ' ' LEU . 11.5 mt -59.78 -43.45 94.38 Favored 'General case' 0 N--CA 1.491 1.6 0 CA-C-N 121.519 1.963 . . . . 50.369999999999997 112.755 175.55 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 41.0 tp10 -62.23 -43.36 99.0 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-O 118.438 -0.791 . . . . 61.039999999999999 110.426 178.186 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -56.62 -47.7 79.07 Favored 'General case' 0 N--CA 1.498 1.929 0 N-CA-C 113.404 0.89 . . . . 45.789999999999999 113.404 171.892 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 18.6 tp -58.01 -50.24 74.08 Favored 'General case' 0 CA--C 1.548 0.871 0 O-C-N 124.558 1.161 . . . . 49.469999999999999 108.78 175.645 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 54.6 tt0 -39.57 -46.41 1.76 Allowed 'General case' 0 N--CA 1.498 1.934 0 N-CA-C 115.334 1.605 . . . . 70.349999999999994 115.334 169.849 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 65.9 m-70 -92.2 6.38 46.91 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.306 0.643 . . . . 62.850000000000001 110.357 -176.053 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.183 0 N-CA-C 107.181 -2.368 . . . . 65.5 107.181 -173.12 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.245 0.865 . . . . . . . . 49.600000000000001 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 1' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -83.7 -36.22 23.89 Favored 'General case' 0 C--O 1.201 -1.48 0 C-N-CA 116.291 -2.163 . . . . 43.969999999999999 109.111 . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 2' ' ' TRP . . . . . . . . . . . . . 77.4 t-105 -48.06 -49.49 31.33 Favored 'General case' 0 N--CA 1.419 -2.003 0 CA-C-N 118.477 0.581 . . . . 64.25 109.979 178.379 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 3' ' ' GLU . . . . . . . . . . . . . 57.6 mm-40 -66.23 -25.51 66.94 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 113.635 0.976 . . . . 64.909999999999997 113.635 -176.835 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 4' ' ' ALA . . . . . . . . . . . . . . . -74.73 -41.69 59.65 Favored 'General case' 0 C--O 1.211 -0.969 0 CA-C-O 117.557 -1.211 . . . . 42.329999999999998 110.178 176.354 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 5' ' ' LEU . . . . . . . . . . . . . 98.2 mt -59.61 -43.67 93.68 Favored 'General case' 0 N--CA 1.435 -1.181 0 C-N-CA 124.172 0.989 . . . . 50.090000000000003 112.285 173.794 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 6' ' ' GLU . . . . . . . . . . . . . 66.4 mt-10 -65.55 -43.19 90.69 Favored 'General case' 0 C--O 1.188 -2.183 0 CA-C-O 118.598 -0.715 . . . . 55.859999999999999 112.512 176.691 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 7' ' ' LYS . . . . . . . . . . . . . 48.4 mmtt -60.63 -35.73 76.88 Favored 'General case' 0 C--N 1.318 -0.78 0 C-N-CA 118.416 -1.313 . . . . 72.159999999999997 114.144 175.652 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 8' ' ' LYS . . . . . . . . . . . . . 86.0 mttt -67.26 -41.58 85.33 Favored 'General case' 0 C--O 1.189 -2.095 0 CA-C-O 116.504 -1.712 . . . . 40.520000000000003 107.107 178.978 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 9' ' ' LEU . . . . . 0.909 ' CD2' ' HE2' ' B' ' 8' ' ' LYS . 9.4 tt -62.58 -42.75 99.75 Favored 'General case' 0 CA--C 1.555 1.156 0 CA-C-N 120.015 1.279 . . . . 45.75 109.968 178.485 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.46 -48.84 79.41 Favored 'General case' 0 C--O 1.219 -0.527 0 N-CA-C 113.18 0.807 . . . . 42.549999999999997 113.18 176.335 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 11' ' ' ALA . . . . . . . . . . . . . . . -59.14 -47.54 84.91 Favored 'General case' 0 C--O 1.213 -0.843 0 C-N-CA 124.888 1.275 . . . . 38.700000000000003 111.812 175.343 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 12' ' ' LEU . . . . . 0.851 HD21 ' HG2' ' A' ' 13' ' ' GLU . 34.9 mt -55.66 -43.1 75.97 Favored 'General case' 0 C--O 1.196 -1.722 0 CA-C-O 121.632 0.729 . . . . 48.740000000000002 110.899 174.457 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 54.0 tt0 -69.53 -33.42 72.78 Favored 'General case' 0 C--N 1.297 -1.699 0 N-CA-C 113.791 1.034 . . . . 63.479999999999997 113.791 -177.081 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 14' ' ' SER . . . . . . . . . . . . . 74.4 m -64.01 -43.12 96.61 Favored 'General case' 0 CA--C 1.488 -1.411 0 C-N-CA 124.353 1.061 . . . . 50.969999999999999 112.769 171.453 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 15' ' ' LYS . . . . . 0.413 ' HB2' HD21 ' A' ' 16' ' ' LEU . 18.4 mttt -69.01 -37.89 78.94 Favored 'General case' 0 C--O 1.198 -1.648 0 N-CA-C 108.108 -1.071 . . . . 63.729999999999997 108.108 178.251 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 16' ' ' LEU . . . . . . . . . . . . . 66.2 tp -62.19 -51.84 66.2 Favored 'General case' 0 CA--C 1.573 1.856 0 C-N-CA 118.966 -1.094 . . . . 41.350000000000001 112.175 178.099 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 40.9 tt0 -49.73 -39.9 38.94 Favored 'General case' 0 CA--C 1.493 -1.249 0 C-N-CA 125.397 1.479 . . . . 61.840000000000003 109.87 173.539 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.05 -43.51 64.79 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 113.136 0.791 . . . . 40.619999999999997 113.136 178.401 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 19' ' ' CYS . . . . . . . . . . . . . 5.0 t -61.6 -35.78 78.83 Favored 'General case' 0 CA--C 1.579 2.067 0 CA-C-O 121.143 0.497 . . . . 59.0 110.177 171.46 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 20' ' ' GLU . . . . . . . . . . . . . 80.1 mt-10 -66.37 -44.12 84.04 Favored 'General case' 0 C--N 1.318 -0.801 0 O-C-N 119.235 -2.166 . . . . 49.670000000000002 113.002 178.234 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 21' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -61.9 -42.6 99.27 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-O 118.095 -0.955 . . . . 60.149999999999999 111.679 175.103 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 22' ' ' LYS . . . . . 0.794 ' NZ ' ' OE2' ' A' ' 24' ' ' GLU . 32.2 tttt -62.86 -39.56 94.79 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 114.582 1.327 . . . . 64.310000000000002 114.582 173.007 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 23' ' ' LEU . . . . . . . . . . . . . 57.2 tp -63.56 -45.92 88.26 Favored 'General case' 0 C--O 1.191 -2.026 0 CA-C-O 117.76 -1.114 . . . . 36.950000000000003 112.22 176.327 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 24' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -56.48 -39.46 73.26 Favored 'General case' 0 C--O 1.245 0.854 0 CA-C-N 120.529 1.513 . . . . 34.719999999999999 111.646 173.83 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.46 -35.59 77.79 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 108.038 -1.097 . . . . 37.780000000000001 108.038 -176.789 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 92.8 mt -74.88 -33.24 62.05 Favored 'General case' 0 C--O 1.201 -1.452 0 CA-C-O 117.248 -1.358 . . . . 52.009999999999998 112.517 178.074 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 27' ' ' GLU . . . . . . . . . . . . . 70.4 mt-10 -68.88 -34.69 75.85 Favored 'General case' 0 C--O 1.176 -2.772 0 CA-C-N 119.111 0.869 . . . . 37.009999999999998 110.903 -179.811 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 28' ' ' HIS . . . . . . . . . . . . . 90.8 m-70 -118.98 -3.82 10.66 Favored 'General case' 0 N--CA 1.432 -1.34 0 N-CA-C 114.759 1.392 . . . . 37.280000000000001 114.759 -162.332 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.061 0 N-CA-C 110.852 -0.899 . . . . 52.960000000000001 110.852 176.338 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 1030 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 1031 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 1032 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 1033 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C 1030 ' ' ' ZN' . . . . . 0.716 'ZN ' ' O ' ' C' 2005 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C 1031 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2001 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2002 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2003 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2004 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2005 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 2001 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 2002 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 2003 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 2004 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 2005 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 2006 ' ' HOH . . . . . 0.594 ' O ' ' NZ ' ' B' ' 15' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 2007 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 2008 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C 2001 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C 2002 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C 2003 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C 2004 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C 2005 ' ' HOH . . . . . 0.716 ' O ' 'ZN ' ' C' 1030 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C 2006 ' ' HOH . . . . . 0.47 ' O ' ' HE2' ' B' ' 22' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.181 . . . . . . . . 43.079999999999998 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -83.79 -45.69 13.05 Favored 'General case' 0 CA--C 1.495 -1.163 0 C-N-CA 126.476 1.91 . . . . 52.869999999999997 111.962 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 38.8 t-105 -49.64 -53.84 21.9 Favored 'General case' 0 C--O 1.207 -1.161 0 C-N-CA 118.086 -1.446 . . . . 55.549999999999997 113.811 172.057 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.444 ' O ' ' HG2' ' A' ' 7' ' ' LYS . 94.5 mt-10 -68.35 -28.77 67.43 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 117.742 2.497 . . . . 44.200000000000003 117.742 178.03 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -66.27 -41.1 90.35 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 120.483 -0.487 . . . . 36.75 109.776 170.54 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 2.6 tp -60.43 -43.21 97.02 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 122.965 0.506 . . . . 48.82 110.59 175.18 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 64.5 mt-10 -64.68 -36.05 83.03 Favored 'General case' 0 N--CA 1.423 -1.809 0 C-N-CA 120.08 -0.648 . . . . 33.359999999999999 110.798 -178.541 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.444 ' HG2' ' O ' ' A' ' 3' ' ' GLU . 12.0 mmtm -75.52 -27.68 58.82 Favored 'General case' 0 N--CA 1.49 1.561 0 CA-C-O 122.019 0.914 . . . . 56.090000000000003 112.294 -178.498 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.655 ' O ' HD23 ' A' ' 12' ' ' LEU . 42.9 mttt -70.55 -39.71 73.83 Favored 'General case' 0 C--O 1.265 1.902 0 CA-C-O 122.536 1.16 . . . . 44.719999999999999 109.894 175.727 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.6 tp -66.2 -42.26 89.02 Favored 'General case' 0 N--CA 1.407 -2.595 0 CA-C-N 113.84 -1.527 . . . . 45.149999999999999 109.23 176.777 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.69 -45.26 94.87 Favored 'General case' 0 N--CA 1.478 0.928 0 O-C-N 120.026 -1.671 . . . . 36.32 114.917 174.978 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -62.28 -44.18 97.12 Favored 'General case' 0 C--O 1.195 -1.795 0 CA-C-O 118.644 -0.693 . . . . 39.460000000000001 110.65 175.707 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.655 HD23 ' O ' ' A' ' 8' ' ' LYS . 4.2 mm? -53.67 -42.93 68.43 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 119.968 1.258 . . . . 45.950000000000003 108.989 175.753 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.851 ' HG2' HD21 ' C' ' 12' ' ' LEU . 59.5 mt-10 -64.05 -39.13 93.41 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 121.767 0.794 . . . . 54.100000000000001 112.147 -177.748 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.3 t -73.19 -44.41 59.86 Favored 'General case' 0 CA--C 1.554 1.107 0 CA-C-N 115.269 -0.878 . . . . 47.530000000000001 112.609 179.477 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 65.5 mttt -54.97 -48.63 72.99 Favored 'General case' 0 C--O 1.248 1.018 0 C-N-CA 123.913 0.885 . . . . 54.25 112.03 170.635 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.413 HD21 ' HB2' ' C' ' 15' ' ' LYS . 37.1 tp -63.42 -40.17 96.47 Favored 'General case' 0 C--O 1.252 1.226 0 N-CA-C 109.722 -0.474 . . . . 40.340000000000003 109.722 -178.941 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.794 ' HG2' ' O ' ' A' ' 13' ' ' GLU . 20.3 mm-40 -62.18 -40.88 97.5 Favored 'General case' 0 CA--C 1.509 -0.612 0 CA-C-O 116.897 -1.525 . . . . 67.939999999999998 113.007 174.331 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.7 -46.84 86.4 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 125.121 1.368 . . . . 44.829999999999998 113.582 173.127 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.7 m -50.3 -52.32 37.69 Favored 'General case' 0 N--CA 1.488 1.447 0 N-CA-C 116.806 2.15 . . . . 59.979999999999997 116.806 163.269 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 74.3 mt-10 -52.66 -36.37 56.77 Favored 'General case' 0 C--O 1.243 0.711 0 O-C-N 124.587 1.179 . . . . 57.439999999999998 110.447 176.908 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 40.7 mtmt -79.45 -43.19 23.75 Favored 'General case' 0 C--O 1.178 -2.672 0 N-CA-C 114.019 1.118 . . . . 68.810000000000002 114.019 -177.56 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 32.0 tttp -55.9 -53.94 50.71 Favored 'General case' 0 C--O 1.175 -2.854 0 C-N-CA 124.987 1.315 . . . . 58.340000000000003 108.67 168.275 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.493 HD13 HD21 ' B' ' 23' ' ' LEU . 1.0 OUTLIER -49.62 -42.2 44.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.461 . . . . 45.630000000000003 111.347 -179.729 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.794 ' OE2' ' NZ ' ' C' ' 22' ' ' LYS . 6.5 mm-40 -66.95 -56.98 7.84 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.253 -0.43 . . . . 55.640000000000001 111.332 -179.761 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.13 -21.05 65.85 Favored 'General case' 0 CA--C 1.583 2.24 0 N-CA-C 116.545 2.054 . . . . 52.869999999999997 116.545 -179.771 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.5 mp -68.06 -42.02 81.11 Favored 'General case' 0 C--O 1.214 -0.773 0 O-C-N 119.741 -1.849 . . . . 60.950000000000003 110.181 158.459 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.547 ' OE1' ' HE3' ' C' ' 22' ' ' LYS . 58.7 tt0 -55.69 -32.18 63.06 Favored 'General case' 0 C--O 1.201 -1.485 0 C-N-CA 118.913 -1.115 . . . . 54.43 110.726 177.846 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 77.3 m-70 -104.17 -156.66 0.58 Allowed 'General case' 0 N--CA 1.51 2.542 0 N-CA-C 116.624 2.083 . . . . 60.390000000000001 116.624 -178.327 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.55 2.264 0 CA-C-N 115.705 -0.68 . . . . 65.890000000000001 114.424 176.642 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.071 . . . . . . . . 62.18 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 1' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -56.14 -26.12 48.98 Favored 'General case' 0 CA--C 1.558 1.27 0 C-N-CA 125.071 1.349 . . . . 61.939999999999998 113.076 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 2' ' ' TRP . . . . . . . . . . . . . 76.3 t-105 -68.98 -52.04 33.16 Favored 'General case' 0 CA--C 1.5 -0.963 0 N-CA-C 113.217 0.821 . . . . 55.909999999999997 113.217 -166.853 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.36 -26.41 46.66 Favored 'General case' 0 N--CA 1.438 -1.039 0 N-CA-C 108.341 -0.985 . . . . 72.920000000000002 108.341 -175.372 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -60.81 -54.38 45.87 Favored 'General case' 0 C--O 1.27 2.179 0 CA-C-O 121.289 0.566 . . . . 48.960000000000001 110.968 170.758 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 1.5 tt -56.81 -42.97 80.51 Favored 'General case' 0 CA--C 1.561 1.397 0 CA-C-O 118.162 -0.923 . . . . 49.979999999999997 112.964 173.601 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -59.87 -38.46 82.23 Favored 'General case' 0 C--O 1.251 1.154 0 CA-C-N 119.317 0.962 . . . . 46.219999999999999 112.212 176.399 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' LYS . . . . . . . . . . . . . 1.9 mmtt -67.45 -40.42 85.4 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 107.468 -1.308 . . . . 66.879999999999995 107.468 179.862 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' LYS . . . . . 0.909 ' HE2' ' CD2' ' C' ' 9' ' ' LEU . 1.8 tttt -67.54 -40.75 84.99 Favored 'General case' 0 N--CA 1.44 -0.937 0 CA-C-O 118.083 -0.961 . . . . 63.600000000000001 109.962 -178.772 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 12.5 tp -63.01 -48.71 77.62 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 113.358 0.873 . . . . 43.079999999999998 113.358 172.287 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -52.52 -42.77 64.63 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-O 116.722 -1.609 . . . . 37.759999999999998 114.723 170.942 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.58 -42.31 87.18 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 119.827 1.194 . . . . 37.159999999999997 110.328 178.305 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 7.6 mp -62.46 -47.27 84.77 Favored 'General case' 0 CA--C 1.473 -1.998 0 N-CA-C 114.133 1.16 . . . . 51.850000000000001 114.133 177.064 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 54.3 tt0 -53.43 -40.42 65.14 Favored 'General case' 0 CA--C 1.55 0.973 0 O-C-N 124.519 1.137 . . . . 58.57 113.765 174.734 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 84.2 p -80.0 -33.33 39.38 Favored 'General case' 0 N--CA 1.413 -2.294 0 O-C-N 119.849 -1.782 . . . . 41.990000000000002 110.675 179.001 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' LYS . . . . . 0.594 ' NZ ' ' O ' ' B' 2006 ' ' HOH . 33.5 mttt -60.8 -38.97 87.17 Favored 'General case' 0 N--CA 1.487 1.385 0 CA-C-O 122.589 1.185 . . . . 54.659999999999997 110.593 172.529 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' LEU . . . . . . . . . . . . . 41.3 tp -68.77 -37.2 79.16 Favored 'General case' 0 C--O 1.192 -1.926 0 O-C-N 120.469 -1.395 . . . . 45.289999999999999 111.295 178.96 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -62.93 -43.88 97.58 Favored 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 124.317 1.047 . . . . 61.420000000000002 109.326 178.988 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.96 -46.48 87.96 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 107.954 -1.128 . . . . 37.509999999999998 107.954 176.302 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 13.1 t -61.03 -43.21 99.22 Favored 'General case' 0 N--CA 1.418 -2.042 0 N-CA-C 108.241 -1.022 . . . . 56.270000000000003 108.241 -175.952 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 72.1 mt-10 -70.57 -35.88 73.31 Favored 'General case' 0 N--CA 1.479 0.987 0 O-C-N 121.889 -0.507 . . . . 51.270000000000003 110.399 -176.733 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 20.2 mttp -67.15 -39.3 86.49 Favored 'General case' 0 C--O 1.262 1.745 0 N-CA-C 114.27 1.211 . . . . 64.829999999999998 114.27 173.331 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' LYS . . . . . 0.47 ' HE2' ' O ' ' C' 2006 ' ' HOH . 61.7 mttt -72.9 -39.53 66.28 Favored 'General case' 0 C--O 1.215 -0.744 0 CA-C-O 116.574 -1.679 . . . . 59.990000000000002 107.205 178.853 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' LEU . . . . . 0.493 HD21 HD13 ' A' ' 23' ' ' LEU . 11.5 mt -59.78 -43.45 94.38 Favored 'General case' 0 N--CA 1.491 1.6 0 CA-C-N 121.519 1.963 . . . . 50.369999999999997 112.755 175.55 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 41.0 tp10 -62.23 -43.36 99.0 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-O 118.438 -0.791 . . . . 61.039999999999999 110.426 178.186 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -56.62 -47.7 79.07 Favored 'General case' 0 N--CA 1.498 1.929 0 N-CA-C 113.404 0.89 . . . . 45.789999999999999 113.404 171.892 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 18.6 tp -58.01 -50.24 74.08 Favored 'General case' 0 CA--C 1.548 0.871 0 O-C-N 124.558 1.161 . . . . 49.469999999999999 108.78 175.645 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 54.6 tt0 -39.57 -46.41 1.76 Allowed 'General case' 0 N--CA 1.498 1.934 0 N-CA-C 115.334 1.605 . . . . 70.349999999999994 115.334 169.849 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 65.9 m-70 -92.2 6.38 46.91 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.306 0.643 . . . . 62.850000000000001 110.357 -176.053 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.183 0 N-CA-C 107.181 -2.368 . . . . 65.5 107.181 -173.12 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.245 0.865 . . . . . . . . 49.600000000000001 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 1' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -83.7 -36.22 23.89 Favored 'General case' 0 C--O 1.201 -1.48 0 C-N-CA 116.291 -2.163 . . . . 43.969999999999999 109.111 . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 2' ' ' TRP . . . . . . . . . . . . . 77.4 t-105 -48.06 -49.49 31.33 Favored 'General case' 0 N--CA 1.419 -2.003 0 CA-C-N 118.477 0.581 . . . . 64.25 109.979 178.379 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 3' ' ' GLU . . . . . . . . . . . . . 57.6 mm-40 -66.23 -25.51 66.94 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 113.635 0.976 . . . . 64.909999999999997 113.635 -176.835 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 4' ' ' ALA . . . . . . . . . . . . . . . -74.73 -41.69 59.65 Favored 'General case' 0 C--O 1.211 -0.969 0 CA-C-O 117.557 -1.211 . . . . 42.329999999999998 110.178 176.354 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 5' ' ' LEU . . . . . . . . . . . . . 98.2 mt -59.61 -43.67 93.68 Favored 'General case' 0 N--CA 1.435 -1.181 0 C-N-CA 124.172 0.989 . . . . 50.090000000000003 112.285 173.794 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 6' ' ' GLU . . . . . . . . . . . . . 66.4 mt-10 -65.55 -43.19 90.69 Favored 'General case' 0 C--O 1.188 -2.183 0 CA-C-O 118.598 -0.715 . . . . 55.859999999999999 112.512 176.691 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 7' ' ' LYS . . . . . . . . . . . . . 48.4 mmtt -60.63 -35.73 76.88 Favored 'General case' 0 C--N 1.318 -0.78 0 C-N-CA 118.416 -1.313 . . . . 72.159999999999997 114.144 175.652 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 8' ' ' LYS . . . . . . . . . . . . . 86.0 mttt -67.26 -41.58 85.33 Favored 'General case' 0 C--O 1.189 -2.095 0 CA-C-O 116.504 -1.712 . . . . 40.520000000000003 107.107 178.978 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 9' ' ' LEU . . . . . 0.909 ' CD2' ' HE2' ' B' ' 8' ' ' LYS . 9.4 tt -62.58 -42.75 99.75 Favored 'General case' 0 CA--C 1.555 1.156 0 CA-C-N 120.015 1.279 . . . . 45.75 109.968 178.485 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.46 -48.84 79.41 Favored 'General case' 0 C--O 1.219 -0.527 0 N-CA-C 113.18 0.807 . . . . 42.549999999999997 113.18 176.335 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 11' ' ' ALA . . . . . . . . . . . . . . . -59.14 -47.54 84.91 Favored 'General case' 0 C--O 1.213 -0.843 0 C-N-CA 124.888 1.275 . . . . 38.700000000000003 111.812 175.343 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 12' ' ' LEU . . . . . 0.851 HD21 ' HG2' ' A' ' 13' ' ' GLU . 34.9 mt -55.66 -43.1 75.97 Favored 'General case' 0 C--O 1.196 -1.722 0 CA-C-O 121.632 0.729 . . . . 48.740000000000002 110.899 174.457 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 13' ' ' GLU . . . . . . . . . . . . . 54.0 tt0 -69.53 -33.42 72.78 Favored 'General case' 0 C--N 1.297 -1.699 0 N-CA-C 113.791 1.034 . . . . 63.479999999999997 113.791 -177.081 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 14' ' ' SER . . . . . . . . . . . . . 74.4 m -64.01 -43.12 96.61 Favored 'General case' 0 CA--C 1.488 -1.411 0 C-N-CA 124.353 1.061 . . . . 50.969999999999999 112.769 171.453 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 15' ' ' LYS . . . . . 0.413 ' HB2' HD21 ' A' ' 16' ' ' LEU . 18.4 mttt -69.01 -37.89 78.94 Favored 'General case' 0 C--O 1.198 -1.648 0 N-CA-C 108.108 -1.071 . . . . 63.729999999999997 108.108 178.251 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 16' ' ' LEU . . . . . . . . . . . . . 66.2 tp -62.19 -51.84 66.2 Favored 'General case' 0 CA--C 1.573 1.856 0 C-N-CA 118.966 -1.094 . . . . 41.350000000000001 112.175 178.099 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 17' ' ' GLN . . . . . . . . . . . . . 40.9 tt0 -49.73 -39.9 38.94 Favored 'General case' 0 CA--C 1.493 -1.249 0 C-N-CA 125.397 1.479 . . . . 61.840000000000003 109.87 173.539 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.05 -43.51 64.79 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 113.136 0.791 . . . . 40.619999999999997 113.136 178.401 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 19' ' ' CYS . . . . . . . . . . . . . 5.0 t -61.6 -35.78 78.83 Favored 'General case' 0 CA--C 1.579 2.067 0 CA-C-O 121.143 0.497 . . . . 59.0 110.177 171.46 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 20' ' ' GLU . . . . . . . . . . . . . 80.1 mt-10 -66.37 -44.12 84.04 Favored 'General case' 0 C--N 1.318 -0.801 0 O-C-N 119.235 -2.166 . . . . 49.670000000000002 113.002 178.234 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 21' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -61.9 -42.6 99.27 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-O 118.095 -0.955 . . . . 60.149999999999999 111.679 175.103 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 22' ' ' LYS . . . . . 0.794 ' NZ ' ' OE2' ' A' ' 24' ' ' GLU . 32.2 tttt -62.86 -39.56 94.79 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 114.582 1.327 . . . . 64.310000000000002 114.582 173.007 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 23' ' ' LEU . . . . . . . . . . . . . 57.2 tp -63.56 -45.92 88.26 Favored 'General case' 0 C--O 1.191 -2.026 0 CA-C-O 117.76 -1.114 . . . . 36.950000000000003 112.22 176.327 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 24' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -56.48 -39.46 73.26 Favored 'General case' 0 C--O 1.245 0.854 0 CA-C-N 120.529 1.513 . . . . 34.719999999999999 111.646 173.83 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.46 -35.59 77.79 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 108.038 -1.097 . . . . 37.780000000000001 108.038 -176.789 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 26' ' ' LEU . . . . . . . . . . . . . 92.8 mt -74.88 -33.24 62.05 Favored 'General case' 0 C--O 1.201 -1.452 0 CA-C-O 117.248 -1.358 . . . . 52.009999999999998 112.517 178.074 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 27' ' ' GLU . . . . . . . . . . . . . 70.4 mt-10 -68.88 -34.69 75.85 Favored 'General case' 0 C--O 1.176 -2.772 0 CA-C-N 119.111 0.869 . . . . 37.009999999999998 110.903 -179.811 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 28' ' ' HIS . . . . . . . . . . . . . 90.8 m-70 -118.98 -3.82 10.66 Favored 'General case' 0 N--CA 1.432 -1.34 0 N-CA-C 114.759 1.392 . . . . 37.280000000000001 114.759 -162.332 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 29' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.061 0 N-CA-C 110.852 -0.899 . . . . 52.960000000000001 110.852 176.338 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 1030 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 1031 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 1032 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 1033 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C 1030 ' ' ' ZN' . . . . . 0.716 'ZN ' ' O ' ' C' 2005 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C 1031 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2001 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2002 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2003 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2004 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2005 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 2001 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 2002 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 2003 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 2004 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 2005 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 2006 ' ' HOH . . . . . 0.594 ' O ' ' NZ ' ' B' ' 15' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 2007 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 2008 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C 2001 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C 2002 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C 2003 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C 2004 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C 2005 ' ' HOH . . . . . 0.716 ' O ' 'ZN ' ' C' 1030 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C 2006 ' ' HOH . . . . . 0.47 ' O ' ' HE2' ' B' ' 22' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 stop_ save_