data_1nhl_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 1nhl _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 ' 28' ' ' SER . . . . . . . . . . . . . 19.8 m . . . . . 0 N--CA 1.49 1.566 0 N-CA-C 112.319 0.489 . . . . 34.37 112.319 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 32.2 p -60.75 -33.4 72.88 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 108.373 -0.973 . . . . 32.16 108.373 178.735 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 7.0 tmm_? -68.16 -38.62 82.31 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 108.902 -0.777 . . . . 38.47 108.902 178.608 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ARG . . . . . 0.401 ' NH1' ' O ' ' A' ' 90' ' ' HOH . 76.5 mtp180 -70.66 -46.71 62.72 Favored 'General case' 0 C--O 1.223 -0.29 0 C-N-CA 118.866 -1.134 . . . . 17.46 108.22 179.009 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 85.4 mt -53.61 -42.3 49.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.166 -0.47 . . . . 14.75 109.823 178.502 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 64.1 tp -64.52 -43.84 92.78 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 120.58 -0.448 . . . . 15.11 111.487 179.66 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -60.35 -44.73 97.25 Favored Glycine 0 C--N 1.333 0.415 0 N-CA-C 110.321 -1.111 . . . . 12.22 110.321 -179.802 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 37.6 mt -64.78 -39.62 93.91 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 113.745 1.017 . . . . 14.65 113.745 -179.907 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.08 -43.11 99.38 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 108.673 -0.862 . . . . 15.42 108.673 179.047 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 73.9 mt -62.34 -44.27 99.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 C-N-CA 120.803 -0.359 . . . . 23.14 110.632 179.079 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -66.48 -38.23 86.82 Favored 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 120.742 -0.383 . . . . 35.84 111.85 179.584 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 29.8 t -63.32 -32.99 74.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.101 0.477 . . . . 22.64 110.962 179.448 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 49.8 tt0 -65.25 -42.62 93.13 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.986 -0.376 . . . . 22.62 109.986 178.958 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -64.22 -34.59 78.46 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 108.023 -1.102 . . . . 30.39 108.023 179.149 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.22 -38.94 86.1 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.274 -0.639 . . . . 17.11 109.274 179.464 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -64.0 -40.32 98.1 Favored Glycine 0 N--CA 1.45 -0.421 0 N-CA-C 110.177 -1.169 . . . . 15.42 110.177 179.396 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 85.0 mt -64.66 -46.7 91.59 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.433 0 O-C-N 122.661 -0.317 . . . . 27.35 110.351 179.32 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 57.7 mttm -59.01 -38.91 80.35 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 119.547 -0.861 . . . . 30.41 109.584 178.795 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 79.7 m -60.81 -50.78 72.05 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.936 -0.575 . . . . 16.03 109.777 179.575 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 23.0 mt -61.58 -41.46 90.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.212 -0.449 . . . . 12.67 110.37 179.199 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 51.7 m -62.3 -39.06 91.74 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.136 0.494 . . . . 14.76 109.959 179.521 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' MSE . . . . . . . . . . . . . 70.0 mtp -66.84 -37.03 83.69 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 119.876 -0.73 . . . . 32.29 112.843 179.316 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -70.24 -41.64 73.27 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 119.464 -0.894 . . . . 13.93 109.672 178.929 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -58.2 -41.36 83.83 Favored 'General case' 0 C--O 1.223 -0.309 0 N-CA-C 108.808 -0.812 . . . . 27.37 108.808 179.132 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -67.82 -29.4 68.56 Favored 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 107.836 -1.172 . . . . 31.77 107.836 177.94 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 4.8 tt0 -74.66 -31.03 61.82 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.14 -0.624 . . . . 21.52 110.491 -179.889 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 55.7 tptt -63.89 -53.99 41.73 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.372 -0.831 . . . . 27.45 111.983 -179.43 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -55.93 -40.75 73.59 Favored 'General case' 0 CA--C 1.515 -0.404 0 CA-C-N 116.403 -0.362 . . . . 36.69 110.694 179.965 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 27.4 tt0 -63.2 -42.13 99.26 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.979 -0.555 . . . . 25.03 109.99 179.906 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 48.3 mt -65.02 -39.11 92.92 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 107.956 -1.128 . . . . 19.83 107.956 178.235 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 99.7 m-20 -57.92 -45.77 86.03 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 119.569 -0.852 . . . . 20.1 109.331 179.259 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 84.3 mtm-85 -60.37 -41.85 94.6 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 119.971 -0.692 . . . . 22.71 111.338 -179.933 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 77.7 mt -64.61 -54.17 33.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 N-CA-C 112.312 0.486 . . . . 24.14 112.312 -179.193 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -52.35 -51.89 56.35 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.941 -0.572 . . . . 31.05 112.406 -178.736 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 19.9 pt-20 -67.99 -32.27 72.55 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 119.563 -0.855 . . . . 46.57 108.907 -179.948 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.01 -39.77 92.42 Favored Glycine 0 N--CA 1.447 -0.613 0 N-CA-C 107.2 -2.36 . . . . 37.76 107.2 178.565 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 5.8 mp -64.21 -43.88 93.63 Favored 'General case' 0 CA--C 1.518 -0.287 0 N-CA-C 108.385 -0.969 . . . . 40.08 108.385 178.66 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 62.5 m-20 -64.8 -5.03 5.02 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.472 -0.785 . . . . 49.3 113.101 -179.352 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 85.4 mt-30 -93.63 -37.79 11.68 Favored 'General case' 0 C--O 1.204 -1.312 0 CA-C-O 122.362 1.077 . . . . 43.26 111.341 176.347 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 71.7 mt -69.05 -48.23 70.8 Favored 'Isoleucine or valine' 0 C--N 1.345 0.396 0 CA-C-N 113.175 -1.83 . . . . 46.99 112.542 178.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 7.5 p-10 -58.39 -24.28 59.51 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.698 -0.482 . . . . 56.64 109.698 -179.168 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 7.7 mmpt? -63.29 -62.59 1.59 Allowed 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 107.61 -1.256 . . . . 57.62 107.61 179.175 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -56.71 -49.01 76.43 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 108.485 -0.931 . . . . 63.7 108.485 179.418 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' MSE . . . . . . . . . . . . . 36.6 tpp -61.06 -5.75 1.59 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.587 -0.733 . . . . 79.23 112.362 -179.501 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 1.6 tpm_? -90.33 -53.14 4.58 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.01 -0.737 . . . . 65.55 109.01 -179.885 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 23.1 pt-20 -81.12 -24.52 37.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.647 -0.706 . . . . 62.61 112.56 -179.375 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 21.4 m -54.81 -53.85 49.92 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 108.975 -0.75 . . . . 56.33 108.975 179.596 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -63.0 -19.47 64.38 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.226 -0.657 . . . . 52.44 109.226 179.645 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -83.58 -38.16 22.0 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.969 -0.56 . . . . 51.99 110.389 179.679 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 56.1 m -65.84 -36.76 84.36 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 108.442 -0.947 . . . . 49.45 108.442 179.425 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 94.2 mt -56.54 -47.94 78.36 Favored 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 106.491 -1.67 . . . . 51.6 106.491 178.523 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 73.7 m -45.46 -44.62 12.45 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.908 -0.587 . . . . 53.47 111.633 179.798 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -85.17 36.73 0.64 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.937 0.398 . . . . 57.35 110.85 179.778 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 93.7 mt . . . . . 0 C--O 1.247 0.972 0 CA-C-O 118.357 -0.83 . . . . 49.69 110.339 -179.999 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' HOH . . . . . 0.401 ' O ' ' NH1' ' A' ' 31' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 19.8 m . . . . . 0 N--CA 1.49 1.566 0 N-CA-C 112.319 0.489 . . . . 34.369999999999997 112.319 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 32.2 p -60.75 -33.4 72.88 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 108.373 -0.973 . . . . 32.159999999999997 108.373 178.735 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 7.0 tmm_? -68.16 -38.62 82.31 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 108.902 -0.777 . . . . 38.469999999999999 108.902 178.608 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 76.5 mtp180 -70.66 -46.71 62.72 Favored 'General case' 0 C--O 1.223 -0.29 0 C-N-CA 118.866 -1.134 . . . . 17.460000000000001 108.22 179.009 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 85.4 mt -53.61 -42.3 49.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.166 -0.47 . . . . 14.75 109.823 178.502 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 64.1 tp -64.52 -43.84 92.78 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 120.58 -0.448 . . . . 15.109999999999999 111.487 179.66 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -60.35 -44.73 97.25 Favored Glycine 0 C--N 1.333 0.415 0 N-CA-C 110.321 -1.111 . . . . 12.220000000000001 110.321 -179.802 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' LEU . . . . . 0.4 HD23 ' HA ' ' A' ' 35' ' ' LEU . 37.6 mt -64.78 -39.62 93.91 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 113.745 1.017 . . . . 14.65 113.745 -179.907 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.08 -43.11 99.38 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 108.673 -0.862 . . . . 15.42 108.673 179.047 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 73.9 mt -62.34 -44.27 99.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 C-N-CA 120.803 -0.359 . . . . 23.140000000000001 110.632 179.079 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -66.48 -38.23 86.82 Favored 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 120.742 -0.383 . . . . 35.840000000000003 111.85 179.584 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 29.8 t -63.32 -32.99 74.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.101 0.477 . . . . 22.640000000000001 110.962 179.448 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 49.8 tt0 -65.25 -42.62 93.13 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.986 -0.376 . . . . 22.620000000000001 109.986 178.958 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -64.22 -34.59 78.46 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 108.023 -1.102 . . . . 30.390000000000001 108.023 179.149 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.22 -38.94 86.1 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.274 -0.639 . . . . 17.109999999999999 109.274 179.464 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -64.0 -40.32 98.1 Favored Glycine 0 N--CA 1.45 -0.421 0 N-CA-C 110.177 -1.169 . . . . 15.42 110.177 179.396 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 85.0 mt -64.66 -46.7 91.59 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.433 0 O-C-N 122.661 -0.317 . . . . 27.350000000000001 110.351 179.32 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' LYS . . . . . 0.452 ' HG2' ' O ' ' A' ' 86' ' ' HOH . 57.7 mttm -59.01 -38.91 80.35 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 119.547 -0.861 . . . . 30.41 109.584 178.795 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 46' ' ' THR . . . . . 0.729 ' O ' HD23 ' A' ' 50' ' ' LEU . 79.7 m -60.81 -50.78 72.05 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.936 -0.575 . . . . 16.030000000000001 109.777 179.575 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 23.0 mt -61.58 -41.46 90.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.212 -0.449 . . . . 12.67 110.37 179.199 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 51.7 m -62.3 -39.06 91.74 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.136 0.494 . . . . 14.76 109.959 179.521 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' MSE . . . . . . . . . . . . . 70.0 mtp -66.84 -37.03 83.69 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 119.876 -0.73 . . . . 32.289999999999999 112.843 179.316 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' LEU . . . . . 0.729 HD23 ' O ' ' A' ' 46' ' ' THR . 4.0 mm? -70.24 -41.64 73.27 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 119.464 -0.894 . . . . 13.93 109.672 178.929 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -58.2 -41.36 83.83 Favored 'General case' 0 C--O 1.223 -0.309 0 N-CA-C 108.808 -0.812 . . . . 27.370000000000001 108.808 179.132 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -67.82 -29.4 68.56 Favored 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 107.836 -1.172 . . . . 31.77 107.836 177.94 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 4.8 tt0 -74.66 -31.03 61.82 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.14 -0.624 . . . . 21.52 110.491 -179.889 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 55.7 tptt -63.89 -53.99 41.73 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.372 -0.831 . . . . 27.449999999999999 111.983 -179.43 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -55.93 -40.75 73.59 Favored 'General case' 0 CA--C 1.515 -0.404 0 CA-C-N 116.403 -0.362 . . . . 36.689999999999998 110.694 179.965 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 27.4 tt0 -63.2 -42.13 99.26 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.979 -0.555 . . . . 25.030000000000001 109.99 179.906 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 48.3 mt -65.02 -39.11 92.92 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 107.956 -1.128 . . . . 19.829999999999998 107.956 178.235 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ASN . . . . . 0.422 ' O ' ' HG2' ' A' ' 62' ' ' GLU . 99.7 m-20 -57.92 -45.77 86.03 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 119.569 -0.852 . . . . 20.100000000000001 109.331 179.259 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 84.3 mtm-85 -60.37 -41.85 94.6 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 119.971 -0.692 . . . . 22.710000000000001 111.338 -179.933 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 77.7 mt -64.61 -54.17 33.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 N-CA-C 112.312 0.486 . . . . 24.140000000000001 112.312 -179.193 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -52.35 -51.89 56.35 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.941 -0.572 . . . . 31.050000000000001 112.406 -178.736 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' GLU . . . . . 0.422 ' HG2' ' O ' ' A' ' 58' ' ' ASN . 19.9 pt-20 -67.99 -32.27 72.55 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 119.563 -0.855 . . . . 46.57 108.907 -179.948 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.01 -39.77 92.42 Favored Glycine 0 N--CA 1.447 -0.613 0 N-CA-C 107.2 -2.36 . . . . 37.759999999999998 107.2 178.565 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 5.8 mp -64.21 -43.88 93.63 Favored 'General case' 0 CA--C 1.518 -0.287 0 N-CA-C 108.385 -0.969 . . . . 40.079999999999998 108.385 178.66 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 62.5 m-20 -64.8 -5.03 5.02 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.472 -0.785 . . . . 49.299999999999997 113.101 -179.352 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 85.4 mt-30 -93.63 -37.79 11.68 Favored 'General case' 0 C--O 1.204 -1.312 0 CA-C-O 122.362 1.077 . . . . 43.259999999999998 111.341 176.347 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 71.7 mt -69.05 -48.23 70.8 Favored 'Isoleucine or valine' 0 C--N 1.345 0.396 0 CA-C-N 113.175 -1.83 . . . . 46.990000000000002 112.542 178.921 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ASN . . . . . 0.444 ' O ' ' HB2' ' A' ' 72' ' ' ARG . 7.5 p-10 -58.39 -24.28 59.51 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.698 -0.482 . . . . 56.640000000000001 109.698 -179.168 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 7.7 mmpt? -63.29 -62.59 1.59 Allowed 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 107.61 -1.256 . . . . 57.619999999999997 107.61 179.175 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -56.71 -49.01 76.43 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 108.485 -0.931 . . . . 63.700000000000003 108.485 179.418 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' MSE . . . . . . . . . . . . . 36.6 tpp -61.06 -5.75 1.59 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.587 -0.733 . . . . 79.230000000000004 112.362 -179.501 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' ARG . . . . . 0.444 ' HB2' ' O ' ' A' ' 68' ' ' ASN . 1.6 tpm_? -90.33 -53.14 4.58 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.01 -0.737 . . . . 65.549999999999997 109.01 -179.885 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 73' ' ' GLU . . . . . 0.402 ' O ' ' HB2' ' A' ' 76' ' ' LYS . 23.1 pt-20 -81.12 -24.52 37.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.647 -0.706 . . . . 62.609999999999999 112.56 -179.375 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 21.4 m -54.81 -53.85 49.92 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 108.975 -0.75 . . . . 56.329999999999998 108.975 179.596 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' GLU . . . . . 0.789 ' HB2' ' O ' ' A' ' 123' ' ' HOH . 40.1 tt0 -63.0 -19.47 64.38 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.226 -0.657 . . . . 52.439999999999998 109.226 179.645 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 76' ' ' LYS . . . . . 0.402 ' HB2' ' O ' ' A' ' 73' ' ' GLU . 68.2 mttm -83.58 -38.16 22.0 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.969 -0.56 . . . . 51.990000000000002 110.389 179.679 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 56.1 m -65.84 -36.76 84.36 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 108.442 -0.947 . . . . 49.450000000000003 108.442 179.425 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' LEU . . . . . 0.483 ' O ' ' HB2' ' A' ' 81' ' ' LEU . 94.2 mt -56.54 -47.94 78.36 Favored 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 106.491 -1.67 . . . . 51.600000000000001 106.491 178.523 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 79' ' ' THR . . . . . 0.554 ' HA ' ' O ' ' A' ' 99' ' ' HOH . 73.7 m -45.46 -44.62 12.45 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.908 -0.587 . . . . 53.469999999999999 111.633 179.798 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -85.17 36.73 0.64 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.937 0.398 . . . . 57.350000000000001 110.85 179.778 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' LEU . . . . . 0.483 ' HB2' ' O ' ' A' ' 78' ' ' LEU . 93.7 mt . . . . . 0 C--O 1.247 0.972 0 CA-C-O 118.357 -0.83 . . . . 49.689999999999998 110.339 -179.999 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 83' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 84' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 85' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 86' ' ' HOH . . . . . 0.452 ' O ' ' HG2' ' A' ' 45' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 88' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 89' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 90' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 91' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 92' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 93' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 94' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 95' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 96' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 97' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 98' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 99' ' ' HOH . . . . . 0.554 ' O ' ' HA ' ' A' ' 79' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 123' ' ' HOH . . . . . 0.789 ' O ' ' HB2' ' A' ' 75' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 19.8 m . . . . . 0 N--CA 1.49 1.566 0 N-CA-C 112.319 0.489 . . . . 34.369999999999997 112.319 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 32.2 p -60.75 -33.4 72.88 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 108.373 -0.973 . . . . 32.159999999999997 108.373 178.735 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 7.0 tmm_? -68.16 -38.62 82.31 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 108.902 -0.777 . . . . 38.469999999999999 108.902 178.608 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 76.5 mtp180 -70.66 -46.71 62.72 Favored 'General case' 0 C--O 1.223 -0.29 0 C-N-CA 118.866 -1.134 . . . . 17.460000000000001 108.22 179.009 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 85.4 mt -53.61 -42.3 49.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.166 -0.47 . . . . 14.75 109.823 178.502 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 64.1 tp -64.52 -43.84 92.78 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 120.58 -0.448 . . . . 15.109999999999999 111.487 179.66 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -60.35 -44.73 97.25 Favored Glycine 0 C--N 1.333 0.415 0 N-CA-C 110.321 -1.111 . . . . 12.220000000000001 110.321 -179.802 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.4 HD23 ' HA ' ' A' ' 35' ' ' LEU . 37.6 mt -64.78 -39.62 93.91 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 113.745 1.017 . . . . 14.65 113.745 -179.907 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.08 -43.11 99.38 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 108.673 -0.862 . . . . 15.42 108.673 179.047 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 73.9 mt -62.34 -44.27 99.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 C-N-CA 120.803 -0.359 . . . . 23.140000000000001 110.632 179.079 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -66.48 -38.23 86.82 Favored 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 120.742 -0.383 . . . . 35.840000000000003 111.85 179.584 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 29.8 t -63.32 -32.99 74.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.101 0.477 . . . . 22.640000000000001 110.962 179.448 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 49.8 tt0 -65.25 -42.62 93.13 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.986 -0.376 . . . . 22.620000000000001 109.986 178.958 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -64.22 -34.59 78.46 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 108.023 -1.102 . . . . 30.390000000000001 108.023 179.149 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.22 -38.94 86.1 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.274 -0.639 . . . . 17.109999999999999 109.274 179.464 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -64.0 -40.32 98.1 Favored Glycine 0 N--CA 1.45 -0.421 0 N-CA-C 110.177 -1.169 . . . . 15.42 110.177 179.396 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 85.0 mt -64.66 -46.7 91.59 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.433 0 O-C-N 122.661 -0.317 . . . . 27.350000000000001 110.351 179.32 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.452 ' HG2' ' O ' ' A' ' 86' ' ' HOH . 57.7 mttm -59.01 -38.91 80.35 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 119.547 -0.861 . . . . 30.41 109.584 178.795 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' THR . . . . . 0.729 ' O ' HD23 ' A' ' 50' ' ' LEU . 79.7 m -60.81 -50.78 72.05 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.936 -0.575 . . . . 16.030000000000001 109.777 179.575 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 23.0 mt -61.58 -41.46 90.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.212 -0.449 . . . . 12.67 110.37 179.199 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 51.7 m -62.3 -39.06 91.74 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.136 0.494 . . . . 14.76 109.959 179.521 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' MSE . . . . . . . . . . . . . 70.0 mtp -66.84 -37.03 83.69 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 119.876 -0.73 . . . . 32.289999999999999 112.843 179.316 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.729 HD23 ' O ' ' A' ' 46' ' ' THR . 4.0 mm? -70.24 -41.64 73.27 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 119.464 -0.894 . . . . 13.93 109.672 178.929 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -58.2 -41.36 83.83 Favored 'General case' 0 C--O 1.223 -0.309 0 N-CA-C 108.808 -0.812 . . . . 27.370000000000001 108.808 179.132 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -67.82 -29.4 68.56 Favored 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 107.836 -1.172 . . . . 31.77 107.836 177.94 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 4.8 tt0 -74.66 -31.03 61.82 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.14 -0.624 . . . . 21.52 110.491 -179.889 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 55.7 tptt -63.89 -53.99 41.73 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.372 -0.831 . . . . 27.449999999999999 111.983 -179.43 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -55.93 -40.75 73.59 Favored 'General case' 0 CA--C 1.515 -0.404 0 CA-C-N 116.403 -0.362 . . . . 36.689999999999998 110.694 179.965 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 27.4 tt0 -63.2 -42.13 99.26 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.979 -0.555 . . . . 25.030000000000001 109.99 179.906 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 48.3 mt -65.02 -39.11 92.92 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 107.956 -1.128 . . . . 19.829999999999998 107.956 178.235 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.422 ' O ' ' HG2' ' A' ' 62' ' ' GLU . 99.7 m-20 -57.92 -45.77 86.03 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 119.569 -0.852 . . . . 20.100000000000001 109.331 179.259 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 84.3 mtm-85 -60.37 -41.85 94.6 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 119.971 -0.692 . . . . 22.710000000000001 111.338 -179.933 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 77.7 mt -64.61 -54.17 33.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 N-CA-C 112.312 0.486 . . . . 24.140000000000001 112.312 -179.193 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -52.35 -51.89 56.35 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.941 -0.572 . . . . 31.050000000000001 112.406 -178.736 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.422 ' HG2' ' O ' ' A' ' 58' ' ' ASN . 19.9 pt-20 -67.99 -32.27 72.55 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 119.563 -0.855 . . . . 46.57 108.907 -179.948 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -58.01 -39.77 92.42 Favored Glycine 0 N--CA 1.447 -0.613 0 N-CA-C 107.2 -2.36 . . . . 37.759999999999998 107.2 178.565 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 5.8 mp -64.21 -43.88 93.63 Favored 'General case' 0 CA--C 1.518 -0.287 0 N-CA-C 108.385 -0.969 . . . . 40.079999999999998 108.385 178.66 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 62.5 m-20 -64.8 -5.03 5.02 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.472 -0.785 . . . . 49.299999999999997 113.101 -179.352 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 85.4 mt-30 -93.63 -37.79 11.68 Favored 'General case' 0 C--O 1.204 -1.312 0 CA-C-O 122.362 1.077 . . . . 43.259999999999998 111.341 176.347 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 71.7 mt -69.05 -48.23 70.8 Favored 'Isoleucine or valine' 0 C--N 1.345 0.396 0 CA-C-N 113.175 -1.83 . . . . 46.990000000000002 112.542 178.921 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ASN . . . . . 0.444 ' O ' ' HB2' ' A' ' 72' ' ' ARG . 7.5 p-10 -58.39 -24.28 59.51 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.698 -0.482 . . . . 56.640000000000001 109.698 -179.168 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 7.7 mmpt? -63.29 -62.59 1.59 Allowed 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 107.61 -1.256 . . . . 57.619999999999997 107.61 179.175 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -56.71 -49.01 76.43 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 108.485 -0.931 . . . . 63.700000000000003 108.485 179.418 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' MSE . . . . . . . . . . . . . 36.6 tpp -61.06 -5.75 1.59 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.587 -0.733 . . . . 79.230000000000004 112.362 -179.501 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.444 ' HB2' ' O ' ' A' ' 68' ' ' ASN . 1.6 tpm_? -90.33 -53.14 4.58 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.01 -0.737 . . . . 65.549999999999997 109.01 -179.885 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.402 ' O ' ' HB2' ' A' ' 76' ' ' LYS . 23.1 pt-20 -81.12 -24.52 37.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.647 -0.706 . . . . 62.609999999999999 112.56 -179.375 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 21.4 m -54.81 -53.85 49.92 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 108.975 -0.75 . . . . 56.329999999999998 108.975 179.596 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.789 ' HB2' ' O ' ' A' ' 123' ' ' HOH . 40.1 tt0 -63.0 -19.47 64.38 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.226 -0.657 . . . . 52.439999999999998 109.226 179.645 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.402 ' HB2' ' O ' ' A' ' 73' ' ' GLU . 68.2 mttm -83.58 -38.16 22.0 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.969 -0.56 . . . . 51.990000000000002 110.389 179.679 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 56.1 m -65.84 -36.76 84.36 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 108.442 -0.947 . . . . 49.450000000000003 108.442 179.425 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.483 ' O ' ' HB2' ' A' ' 81' ' ' LEU . 94.2 mt -56.54 -47.94 78.36 Favored 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 106.491 -1.67 . . . . 51.600000000000001 106.491 178.523 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' THR . . . . . 0.554 ' HA ' ' O ' ' A' ' 99' ' ' HOH . 73.7 m -45.46 -44.62 12.45 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.908 -0.587 . . . . 53.469999999999999 111.633 179.798 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -85.17 36.73 0.64 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.937 0.398 . . . . 57.350000000000001 110.85 179.778 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.483 ' HB2' ' O ' ' A' ' 78' ' ' LEU . 93.7 mt . . . . . 0 C--O 1.247 0.972 0 CA-C-O 118.357 -0.83 . . . . 49.689999999999998 110.339 -179.999 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' HOH . . . . . 0.452 ' O ' ' HG2' ' A' ' 45' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' HOH . . . . . 0.554 ' O ' ' HA ' ' A' ' 79' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' HOH . . . . . 0.789 ' O ' ' HB2' ' A' ' 75' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_