data_6akm_residue ############################ # Computer software used # ############################ 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 6akm _Structure_validation_residue.Date_analyzed 2019-01-11 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.275 0 CA-C-O 120.674 0.274 . . . . 164.47 111.001 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 27.3 mmm -66.14 161.74 21.24 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.943 0.878 . . . . 155.87 110.799 -175.666 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -66.44 -61.0 2.23 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 113.092 -1.867 . . . . 130.76 112.325 -172.344 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 2.3 pp -49.77 -30.35 5.62 Favored 'Isoleucine or valine' 0 C--O 1.178 -2.66 0 CA-C-O 116.576 -1.678 . . . . 126.97 111.666 -174.551 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . . . -52.93 -39.63 63.0 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-N 120.936 1.698 . . . . 128.29 111.406 -179.244 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . . . -84.9 -30.22 24.56 Favored 'General case' 0 C--O 1.238 0.455 0 N-CA-C 113.137 0.791 . . . . 116.52 113.137 175.623 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 6.5 mt -65.18 -55.7 19.16 Favored 'Isoleucine or valine' 0 C--O 1.237 0.442 0 CA-C-N 118.874 0.761 . . . . 108.82 111.199 172.767 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . . . -54.67 -40.73 69.35 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 119.768 -0.773 . . . . 102.87 111.264 -178.644 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 25.9 p -62.94 -38.69 92.04 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 119.809 -0.756 . . . . 114.42 110.747 177.028 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 75.2 m-20 -69.44 -44.44 71.27 Favored 'General case' 0 C--O 1.24 0.589 0 C-N-CA 120.868 -0.333 . . . . 103.39 111.041 -179.349 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.76 -40.89 97.79 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 120.15 -0.62 . . . . 78.54 111.248 176.957 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . . . -63.39 -36.74 84.72 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 120.016 -0.673 . . . . 84.92 111.156 175.865 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 18.5 m -72.96 -47.06 48.77 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 120.707 -0.397 . . . . 80.24 110.663 -179.817 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.4 tp -47.04 -49.23 21.61 Favored 'General case' 0 C--O 1.239 0.55 0 C-N-CA 123.439 0.696 . . . . 69.47 111.594 170.312 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' LEU . . . . . 0.479 ' CD2' ' CD ' ' B' ' 174' ' ' GLU . 9.3 tp -72.78 -35.12 67.34 Favored 'General case' 0 C--O 1.171 -3.054 0 O-C-N 118.77 -2.456 . . . . 81.94 109.514 -177.32 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -69.03 -37.8 78.81 Favored 'General case' 0 C--N 1.273 -2.742 0 C-N-CA 114.484 -2.886 . . . . 123.12 111.596 -179.704 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 97.1 mtt180 -66.06 -36.07 82.23 Favored 'General case' 0 CA--C 1.515 -0.397 0 C-N-CA 118.702 -1.199 . . . . 91.97 110.728 178.316 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 27.5 mt -62.11 -37.13 83.93 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 119.591 -0.844 . . . . 59.37 110.641 176.655 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 91.6 mtt180 -66.16 -48.19 71.56 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 119.651 -0.82 . . . . 90.23 111.343 -179.851 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -71.37 -24.24 62.04 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 118.187 -1.405 . . . . 104.33 111.119 -177.403 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 29.4 m170 -86.43 -25.63 25.14 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 117.937 -1.505 . . . . 81.01 111.272 178.952 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -65.38 -35.7 81.74 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.055 -0.658 . . . . 51.35 110.728 169.236 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.65 -42.63 95.3 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 119.342 -0.943 . . . . 58.45 111.133 170.356 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.04 -39.64 78.92 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 119.561 -0.856 . . . . 51.22 111.008 178.579 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.12 -34.39 77.94 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 119.471 -0.892 . . . . 38.52 110.687 178.226 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -62.31 -42.93 99.78 Favored 'General case' 0 C--O 1.24 0.566 0 C-N-CA 119.944 -0.702 . . . . 73.88 110.958 177.251 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 38.8 m -66.97 -31.13 71.5 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 120.04 -0.664 . . . . 37.38 111.351 177.225 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 95.2 mt -63.66 -38.9 92.88 Favored 'General case' 0 C--O 1.24 0.558 0 C-N-CA 120.099 -0.64 . . . . 35.69 111.307 174.017 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 40.7 t -57.7 -45.74 86.74 Favored 'Isoleucine or valine' 0 C--O 1.239 0.539 0 C-N-CA 119.529 -0.868 . . . . 36.88 109.063 179.839 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 23.6 m-20 -70.71 -35.28 72.67 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 119.776 -0.77 . . . . 63.6 111.113 -177.685 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -55.16 -51.34 66.8 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-O 121.574 0.702 . . . . 40.35 110.32 173.164 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 64.9 p -72.24 -30.36 64.82 Favored 'General case' 0 CA--C 1.517 -0.313 0 C-N-CA 118.198 -1.401 . . . . 36.82 111.383 -174.394 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -63.14 -41.78 99.36 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-N 117.825 0.284 . . . . 30.91 111.162 174.334 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -63.56 -39.24 93.88 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-O 121.063 0.458 . . . . 34.66 110.553 176.973 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 41.4 tp -64.64 -43.53 93.4 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.314 -0.554 . . . . 38.22 110.741 175.509 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 30.7 t-80 -54.78 -50.3 68.82 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 120.108 -0.637 . . . . 37.59 110.267 175.9 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 26.0 ttm-85 -56.33 -40.95 75.26 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.239 -0.584 . . . . 87.55 110.861 179.802 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 12.5 tpp85 -69.82 -40.35 75.97 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 118.168 -1.413 . . . . 69.42 110.848 -176.335 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 53.4 t -67.07 -39.26 82.88 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 C-N-CA 120.139 -0.624 . . . . 42.94 110.575 179.725 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -67.29 -37.11 82.88 Favored 'General case' 0 C--O 1.238 0.496 0 O-C-N 121.608 -0.683 . . . . 48.29 111.176 179.543 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -69.55 -34.19 73.85 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.335 -0.546 . . . . 57.62 111.732 178.226 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 56.3 mtp -62.75 -38.65 91.39 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 119.555 -0.858 . . . . 73.6 110.375 172.01 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 41.6 ttp180 -70.31 -47.04 62.92 Favored 'General case' 0 C--N 1.303 -1.414 0 C-N-CA 118.951 -1.1 . . . . 68.45 109.94 -179.01 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . . . -64.1 -34.61 78.43 Favored 'General case' 0 C--N 1.303 -1.421 0 C-N-CA 117.709 -1.596 . . . . 79.35 111.705 179.731 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.15 -10.78 60.15 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 120.259 -0.576 . . . . 86.73 112.525 176.009 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -98.82 4.0 59.14 Favored Glycine 0 N--CA 1.447 -0.592 0 CA-C-O 119.117 -0.824 . . . . 90.94 114.94 170.155 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 2.4 m . . . . . 0 C--N 1.332 -0.196 0 CA-C-N 118.579 1.189 . . . . 104.88 110.544 -177.637 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 41.0 t . . . . . 0 CA--C 1.518 -0.283 0 CA-C-O 120.733 0.301 . . . . 155.04 110.35 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 164' ' ' THR . . . . . . . . . . . . . 48.7 p -73.87 -28.03 61.37 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 119.239 -0.984 . . . . 143.9 112.004 -179.967 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 165' ' ' MET . . . . . . . . . . . . . 19.0 mmm -84.91 -7.81 59.02 Favored 'General case' 0 C--O 1.238 0.494 0 N-CA-C 113.367 0.877 . . . . 144.93 113.367 -179.263 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . . . -90.8 -18.5 24.79 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 119.103 -0.475 . . . . 137.99 111.848 163.321 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -88.77 -43.92 10.91 Favored 'General case' 0 C--O 1.241 0.628 0 C-N-CA 123.763 0.825 . . . . 125.0 111.01 -177.489 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 168' ' ' LEU . . . . . . . . . . . . . 8.6 tp -38.6 -71.23 0.08 Allowed 'General case' 0 C--O 1.238 0.45 0 C-N-CA 123.777 0.831 . . . . 116.88 112.764 157.161 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 169' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -53.43 -24.18 11.93 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.78 -0.645 . . . . 115.26 111.087 -172.289 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 170' ' ' GLN . . . . . . . . . . . . . . . -75.93 -51.52 12.26 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 120.619 -0.432 . . . . 104.0 111.236 172.938 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 171' ' ' TYR . . . . . . . . . . . . . 7.9 m-30 -52.45 -48.79 65.63 Favored 'General case' 0 C--O 1.238 0.495 0 CA-C-O 121.108 0.48 . . . . 119.91 111.123 178.618 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 5.5 mp -65.35 -49.87 67.74 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.535 -0.466 . . . . 96.12 111.205 -177.858 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 173' ' ' GLN . . . . . . . . . . . . . 5.1 mm100 -60.33 -32.03 70.86 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 119.809 -0.756 . . . . 102.75 111.748 -179.905 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 174' ' ' GLU . . . . . 0.479 ' CD ' ' CD2' ' A' ' 16' ' ' LEU . . . -82.41 -29.08 31.01 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 120.646 -0.421 . . . . 95.37 112.098 177.919 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 175' ' ' ALA . . . . . . . . . . . . . . . -66.53 -38.13 86.5 Favored 'General case' 0 C--O 1.238 0.453 0 C-N-CA 120.363 -0.535 . . . . 70.08 110.863 170.333 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 176' ' ' LEU . . . . . . . . . . . . . 3.4 mt -64.94 -41.0 95.89 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 119.159 -1.016 . . . . 80.17 111.018 175.003 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 177' ' ' HIS . . . . . . . . . . . . . 28.3 t-80 -62.99 -47.44 83.14 Favored 'General case' 0 C--O 1.238 0.488 0 C-N-CA 119.374 -0.93 . . . . 78.85 110.919 178.604 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 15.1 tpp180 -66.29 -27.64 68.08 Favored 'General case' 0 C--O 1.241 0.616 0 C-N-CA 119.735 -0.786 . . . . 64.72 111.254 -177.119 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 179' ' ' GLU . . . . . . . . . . . . . 12.9 tm-20 -76.68 -28.25 55.86 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 119.479 -0.888 . . . . 82.76 110.775 179.893 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 180' ' ' GLN . . . . . . . . . . . . . 44.1 mt-30 -70.84 -30.52 66.96 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 119.114 -1.034 . . . . 106.1 111.688 170.322 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 181' ' ' MET . . . . . . . . . . . . . 21.9 mmt -61.29 -49.16 78.14 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 121.15 0.5 . . . . 82.06 110.128 171.567 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 182' ' ' LEU . . . . . . . . . . . . . 3.4 tt -57.1 -46.08 82.86 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.272 -0.422 . . . . 60.4 111.136 178.913 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 183' ' ' GLU . . . . . . . . . . . . . 8.9 tm-20 -61.87 -37.62 85.22 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.083 -0.647 . . . . 98.88 111.244 -178.745 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 184' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.82 -36.9 84.7 Favored 'General case' 1 C--O 1.152 -4.069 0 CA-C-O 117.044 -1.455 . . . . 92.95 107.692 178.578 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 185' ' ' LYS . . . . . . . . . . . . . 62.3 mttp -69.23 -39.52 78.47 Favored 'General case' 0 C--N 1.292 -1.895 0 CA-C-N 119.623 1.101 . . . . 42.99 110.968 175.737 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 90.7 mt -63.55 -38.87 92.78 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 119.036 -1.066 . . . . 46.72 110.819 179.196 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -64.98 -37.7 88.53 Favored 'General case' 0 C--O 1.232 0.182 0 C-N-CA 119.854 -0.738 . . . . 36.26 110.813 178.139 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 188' ' ' THR . . . . . . . . . . . . . 22.6 m -65.06 -40.18 94.35 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 119.701 -0.799 . . . . 29.81 110.632 175.74 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 4.1 mt -57.78 -47.81 81.46 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 120.395 -0.522 . . . . 59.19 111.471 175.346 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 190' ' ' GLN . . . . . . . . . . . . . 18.8 tm0? -55.93 -44.43 78.36 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 119.703 -0.799 . . . . 56.84 110.827 -177.524 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 191' ' ' ARG . . . . . . . . . . . . . 27.9 mtt85 -73.65 -33.49 64.52 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 120.49 -0.484 . . . . 43.05 111.846 -178.057 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 192' ' ' LEU . . . . . . . . . . . . . 18.8 mt -67.08 -40.49 86.99 Favored 'General case' 0 C--O 1.239 0.504 0 C-N-CA 119.317 -0.953 . . . . 31.16 110.662 177.69 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 73.2 mt -65.8 -38.86 90.11 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 119.702 -0.799 . . . . 35.79 110.93 177.708 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -65.29 -45.01 86.11 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 119.539 -0.864 . . . . 33.19 111.347 -177.918 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 195' ' ' ILE . . . . . . . . . . . . . 20.0 pt -74.1 -24.22 19.14 Favored 'Isoleucine or valine' 0 C--O 1.239 0.513 0 C-N-CA 118.369 -1.333 . . . . 38.99 111.343 -178.891 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 196' ' ' THR . . . . . . . . . . . . . 15.1 m -68.57 -38.88 81.09 Favored 'General case' 0 C--O 1.239 0.535 0 C-N-CA 119.066 -1.053 . . . . 34.46 111.298 169.468 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 63.1 tp60 -62.04 -44.08 97.47 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 119.617 -0.833 . . . . 45.46 110.922 178.24 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 198' ' ' GLU . . . . . . . . . . . . 0.366 7.6 pt-20 -75.18 -26.96 59.45 Favored 'General case' 0 C--O 1.155 -3.888 0 CA-C-O 117.847 -1.073 . . . . 99.47 110.417 179.754 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 199' ' ' ALA . . . . . . . . . . . . . . . -66.26 -24.78 66.64 Favored 'General case' 0 C--N 1.277 -2.574 0 CA-C-N 119.858 1.208 . . . . 52.03 111.629 177.706 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 200' ' ' SER . . . . . . . . . . . . . 60.4 p -83.27 -11.25 57.95 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 112.623 0.601 . . . . 57.01 112.623 -178.746 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 201' ' ' ASP . . . . . . . . . . . . . 73.5 m-20 -63.68 -40.77 97.64 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 120.727 -0.389 . . . . 90.3 111.661 -167.406 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 202' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -67.11 -44.97 78.59 Favored 'General case' 0 C--O 1.2 -1.527 0 CA-C-O 117.929 -1.034 . . . . 83.64 110.18 -176.956 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 4.9 m -64.39 -44.47 91.22 Favored 'General case' 0 C--N 1.299 -1.623 0 O-C-N 124.464 1.103 . . . . 74.87 110.392 177.946 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 204' ' ' TRP . . . . . . . . . . . . . 42.0 t-105 -61.46 -41.48 97.3 Favored 'General case' 0 C--O 1.239 0.523 0 CA-C-N 116.529 -0.305 . . . . 89.21 111.116 179.277 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 205' ' ' GLN . . . . . . . . . . . . . 29.0 mm100 -62.95 -37.39 86.88 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 120.761 -0.375 . . . . 110.09 111.149 176.916 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 206' ' ' ALA . . . . . . . . . . . . . . . -62.53 -21.99 65.96 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 112.573 0.583 . . . . 89.1 112.573 -179.944 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 207' ' ' LEU . . . . . . . . . . . . . . . -94.98 -4.81 45.98 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 112.656 0.613 . . . . 111.33 112.656 175.644 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 208' ' ' ILE . . . . . . . . . . . . . 2.9 mt . . . . . 0 N--CA 1.465 0.288 0 C-N-CA 124.555 1.142 . . . . 111.4 110.804 -175.816 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.275 0 CA-C-O 120.674 0.274 . . . . 164.47 111.001 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 27.3 mmm -66.14 161.74 21.24 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.943 0.878 . . . . 155.87 110.799 -175.666 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -66.44 -61.0 2.23 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 113.092 -1.867 . . . . 130.76 112.325 -172.344 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' ILE . . . . . 0.566 ' HA ' HD12 ' A' ' 8' ' ' ILE . 2.3 pp -49.77 -30.35 5.62 Favored 'Isoleucine or valine' 0 C--O 1.178 -2.66 0 CA-C-O 116.576 -1.678 . . . . 126.97 111.666 -174.551 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . . . -52.93 -39.63 63.0 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-N 120.936 1.698 . . . . 128.29 111.406 -179.244 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . . . -84.9 -30.22 24.56 Favored 'General case' 0 C--O 1.238 0.455 0 N-CA-C 113.137 0.791 . . . . 116.52 113.137 175.623 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' ILE . . . . . 0.566 HD12 ' HA ' ' A' ' 5' ' ' ILE . 6.5 mt -65.18 -55.7 19.16 Favored 'Isoleucine or valine' 0 C--O 1.237 0.442 0 CA-C-N 118.874 0.761 . . . . 108.82 111.199 172.767 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . . . -54.67 -40.73 69.35 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 119.768 -0.773 . . . . 102.87 111.264 -178.644 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 25.9 p -62.94 -38.69 92.04 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 119.809 -0.756 . . . . 114.42 110.747 177.028 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 75.2 m-20 -69.44 -44.44 71.27 Favored 'General case' 0 C--O 1.24 0.589 0 C-N-CA 120.868 -0.333 . . . . 103.39 111.041 -179.349 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.76 -40.89 97.79 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 120.15 -0.62 . . . . 78.54 111.248 176.957 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . . . -63.39 -36.74 84.72 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 120.016 -0.673 . . . . 84.92 111.156 175.865 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 18.5 m -72.96 -47.06 48.77 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 120.707 -0.397 . . . . 80.24 110.663 -179.817 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.4 tp -47.04 -49.23 21.61 Favored 'General case' 0 C--O 1.239 0.55 0 C-N-CA 123.439 0.696 . . . . 69.47 111.594 170.312 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' LEU . . . . . 0.791 ' CD1' ' HG3' ' B' ' 174' ' ' GLU . 9.3 tp -72.78 -35.12 67.34 Favored 'General case' 0 C--O 1.171 -3.054 0 O-C-N 118.77 -2.456 . . . . 81.94 109.514 -177.32 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -69.03 -37.8 78.81 Favored 'General case' 0 C--N 1.273 -2.742 0 C-N-CA 114.484 -2.886 . . . . 123.12 111.596 -179.704 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 97.1 mtt180 -66.06 -36.07 82.23 Favored 'General case' 0 CA--C 1.515 -0.397 0 C-N-CA 118.702 -1.199 . . . . 91.97 110.728 178.316 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 27.5 mt -62.11 -37.13 83.93 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 119.591 -0.844 . . . . 59.37 110.641 176.655 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 91.6 mtt180 -66.16 -48.19 71.56 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 119.651 -0.82 . . . . 90.23 111.343 -179.851 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -71.37 -24.24 62.04 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 118.187 -1.405 . . . . 104.33 111.119 -177.403 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 29.4 m170 -86.43 -25.63 25.14 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 117.937 -1.505 . . . . 81.01 111.272 178.952 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -65.38 -35.7 81.74 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.055 -0.658 . . . . 51.35 110.728 169.236 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.65 -42.63 95.3 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 119.342 -0.943 . . . . 58.45 111.133 170.356 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.04 -39.64 78.92 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 119.561 -0.856 . . . . 51.22 111.008 178.579 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.12 -34.39 77.94 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 119.471 -0.892 . . . . 38.52 110.687 178.226 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -62.31 -42.93 99.78 Favored 'General case' 0 C--O 1.24 0.566 0 C-N-CA 119.944 -0.702 . . . . 73.88 110.958 177.251 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 38.8 m -66.97 -31.13 71.5 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 120.04 -0.664 . . . . 37.38 111.351 177.225 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 95.2 mt -63.66 -38.9 92.88 Favored 'General case' 0 C--O 1.24 0.558 0 C-N-CA 120.099 -0.64 . . . . 35.69 111.307 174.017 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 40.7 t -57.7 -45.74 86.74 Favored 'Isoleucine or valine' 0 C--O 1.239 0.539 0 C-N-CA 119.529 -0.868 . . . . 36.88 109.063 179.839 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 23.6 m-20 -70.71 -35.28 72.67 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 119.776 -0.77 . . . . 63.6 111.113 -177.685 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -55.16 -51.34 66.8 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-O 121.574 0.702 . . . . 40.35 110.32 173.164 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 64.9 p -72.24 -30.36 64.82 Favored 'General case' 0 CA--C 1.517 -0.313 0 C-N-CA 118.198 -1.401 . . . . 36.82 111.383 -174.394 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -63.14 -41.78 99.36 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-N 117.825 0.284 . . . . 30.91 111.162 174.334 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -63.56 -39.24 93.88 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-O 121.063 0.458 . . . . 34.66 110.553 176.973 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 41.4 tp -64.64 -43.53 93.4 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.314 -0.554 . . . . 38.22 110.741 175.509 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 30.7 t-80 -54.78 -50.3 68.82 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 120.108 -0.637 . . . . 37.59 110.267 175.9 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 26.0 ttm-85 -56.33 -40.95 75.26 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.239 -0.584 . . . . 87.55 110.861 179.802 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 12.5 tpp85 -69.82 -40.35 75.97 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 118.168 -1.413 . . . . 69.42 110.848 -176.335 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 53.4 t -67.07 -39.26 82.88 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 C-N-CA 120.139 -0.624 . . . . 42.94 110.575 179.725 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -67.29 -37.11 82.88 Favored 'General case' 0 C--O 1.238 0.496 0 O-C-N 121.608 -0.683 . . . . 48.29 111.176 179.543 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -69.55 -34.19 73.85 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.335 -0.546 . . . . 57.62 111.732 178.226 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 56.3 mtp -62.75 -38.65 91.39 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 119.555 -0.858 . . . . 73.6 110.375 172.01 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 41.6 ttp180 -70.31 -47.04 62.92 Favored 'General case' 0 C--N 1.303 -1.414 0 C-N-CA 118.951 -1.1 . . . . 68.45 109.94 -179.01 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . . . -64.1 -34.61 78.43 Favored 'General case' 0 C--N 1.303 -1.421 0 C-N-CA 117.709 -1.596 . . . . 79.35 111.705 179.731 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.15 -10.78 60.15 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 120.259 -0.576 . . . . 86.73 112.525 176.009 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -98.82 4.0 59.14 Favored Glycine 0 N--CA 1.447 -0.592 0 CA-C-O 119.117 -0.824 . . . . 90.94 114.94 170.155 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 2.4 m . . . . . 0 C--N 1.332 -0.196 0 CA-C-N 118.579 1.189 . . . . 104.88 110.544 -177.637 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 41.0 t . . . . . 0 CA--C 1.518 -0.283 0 CA-C-O 120.733 0.301 . . . . 155.04 110.35 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 164' ' ' THR . . . . . . . . . . . . . 48.7 p -73.87 -28.03 61.37 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 119.239 -0.984 . . . . 143.9 112.004 -179.967 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 165' ' ' MET . . . . . . . . . . . . . 19.0 mmm -84.91 -7.81 59.02 Favored 'General case' 0 C--O 1.238 0.494 0 N-CA-C 113.367 0.877 . . . . 144.93 113.367 -179.263 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . . . -90.8 -18.5 24.79 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 119.103 -0.475 . . . . 137.99 111.848 163.321 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -88.77 -43.92 10.91 Favored 'General case' 0 C--O 1.241 0.628 0 C-N-CA 123.763 0.825 . . . . 125.0 111.01 -177.489 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 168' ' ' LEU . . . . . . . . . . . . . 8.6 tp -38.6 -71.23 0.08 Allowed 'General case' 0 C--O 1.238 0.45 0 C-N-CA 123.777 0.831 . . . . 116.88 112.764 157.161 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 169' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -53.43 -24.18 11.93 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.78 -0.645 . . . . 115.26 111.087 -172.289 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 170' ' ' GLN . . . . . . . . . . . . . . . -75.93 -51.52 12.26 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 120.619 -0.432 . . . . 104.0 111.236 172.938 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 171' ' ' TYR . . . . . . . . . . . . . 7.9 m-30 -52.45 -48.79 65.63 Favored 'General case' 0 C--O 1.238 0.495 0 CA-C-O 121.108 0.48 . . . . 119.91 111.123 178.618 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 5.5 mp -65.35 -49.87 67.74 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.535 -0.466 . . . . 96.12 111.205 -177.858 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 173' ' ' GLN . . . . . . . . . . . . . 5.1 mm100 -60.33 -32.03 70.86 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 119.809 -0.756 . . . . 102.75 111.748 -179.905 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 174' ' ' GLU . . . . . 0.791 ' HG3' ' CD1' ' A' ' 16' ' ' LEU . . . -82.41 -29.08 31.01 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 120.646 -0.421 . . . . 95.37 112.098 177.919 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 175' ' ' ALA . . . . . 0.441 ' HA ' HD12 ' A' ' 16' ' ' LEU . . . -66.53 -38.13 86.5 Favored 'General case' 0 C--O 1.238 0.453 0 C-N-CA 120.363 -0.535 . . . . 70.08 110.863 170.333 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 176' ' ' LEU . . . . . . . . . . . . . 3.4 mt -64.94 -41.0 95.89 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 119.159 -1.016 . . . . 80.17 111.018 175.003 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 177' ' ' HIS . . . . . . . . . . . . . 28.3 t-80 -62.99 -47.44 83.14 Favored 'General case' 0 C--O 1.238 0.488 0 C-N-CA 119.374 -0.93 . . . . 78.85 110.919 178.604 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 15.1 tpp180 -66.29 -27.64 68.08 Favored 'General case' 0 C--O 1.241 0.616 0 C-N-CA 119.735 -0.786 . . . . 64.72 111.254 -177.119 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 179' ' ' GLU . . . . . . . . . . . . . 12.9 tm-20 -76.68 -28.25 55.86 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 119.479 -0.888 . . . . 82.76 110.775 179.893 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 180' ' ' GLN . . . . . . . . . . . . . 44.1 mt-30 -70.84 -30.52 66.96 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 119.114 -1.034 . . . . 106.1 111.688 170.322 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 181' ' ' MET . . . . . . . . . . . . . 21.9 mmt -61.29 -49.16 78.14 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 121.15 0.5 . . . . 82.06 110.128 171.567 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 182' ' ' LEU . . . . . . . . . . . . . 3.4 tt -57.1 -46.08 82.86 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.272 -0.422 . . . . 60.4 111.136 178.913 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 183' ' ' GLU . . . . . . . . . . . . . 8.9 tm-20 -61.87 -37.62 85.22 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.083 -0.647 . . . . 98.88 111.244 -178.745 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 184' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.82 -36.9 84.7 Favored 'General case' 1 C--O 1.152 -4.069 0 CA-C-O 117.044 -1.455 . . . . 92.95 107.692 178.578 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 185' ' ' LYS . . . . . . . . . . . . . 62.3 mttp -69.23 -39.52 78.47 Favored 'General case' 0 C--N 1.292 -1.895 0 CA-C-N 119.623 1.101 . . . . 42.99 110.968 175.737 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 90.7 mt -63.55 -38.87 92.78 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 119.036 -1.066 . . . . 46.72 110.819 179.196 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -64.98 -37.7 88.53 Favored 'General case' 0 C--O 1.232 0.182 0 C-N-CA 119.854 -0.738 . . . . 36.26 110.813 178.139 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 188' ' ' THR . . . . . . . . . . . . . 22.6 m -65.06 -40.18 94.35 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 119.701 -0.799 . . . . 29.81 110.632 175.74 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 4.1 mt -57.78 -47.81 81.46 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 120.395 -0.522 . . . . 59.19 111.471 175.346 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 190' ' ' GLN . . . . . . . . . . . . . 18.8 tm0? -55.93 -44.43 78.36 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 119.703 -0.799 . . . . 56.84 110.827 -177.524 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 191' ' ' ARG . . . . . . . . . . . . . 27.9 mtt85 -73.65 -33.49 64.52 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 120.49 -0.484 . . . . 43.05 111.846 -178.057 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 192' ' ' LEU . . . . . . . . . . . . . 18.8 mt -67.08 -40.49 86.99 Favored 'General case' 0 C--O 1.239 0.504 0 C-N-CA 119.317 -0.953 . . . . 31.16 110.662 177.69 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 73.2 mt -65.8 -38.86 90.11 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 119.702 -0.799 . . . . 35.79 110.93 177.708 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -65.29 -45.01 86.11 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 119.539 -0.864 . . . . 33.19 111.347 -177.918 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 195' ' ' ILE . . . . . . . . . . . . . 20.0 pt -74.1 -24.22 19.14 Favored 'Isoleucine or valine' 0 C--O 1.239 0.513 0 C-N-CA 118.369 -1.333 . . . . 38.99 111.343 -178.891 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 196' ' ' THR . . . . . . . . . . . . . 15.1 m -68.57 -38.88 81.09 Favored 'General case' 0 C--O 1.239 0.535 0 C-N-CA 119.066 -1.053 . . . . 34.46 111.298 169.468 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 63.1 tp60 -62.04 -44.08 97.47 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 119.617 -0.833 . . . . 45.46 110.922 178.24 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 198' ' ' GLU . . . . . . . . . . . . 0.366 7.6 pt-20 -75.18 -26.96 59.45 Favored 'General case' 0 C--O 1.155 -3.888 0 CA-C-O 117.847 -1.073 . . . . 99.47 110.417 179.754 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 199' ' ' ALA . . . . . . . . . . . . . . . -66.26 -24.78 66.64 Favored 'General case' 0 C--N 1.277 -2.574 0 CA-C-N 119.858 1.208 . . . . 52.03 111.629 177.706 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 200' ' ' SER . . . . . . . . . . . . . 60.4 p -83.27 -11.25 57.95 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 112.623 0.601 . . . . 57.01 112.623 -178.746 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 201' ' ' ASP . . . . . . . . . . . . . 73.5 m-20 -63.68 -40.77 97.64 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 120.727 -0.389 . . . . 90.3 111.661 -167.406 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 202' ' ' THR . . . . . 0.537 ' HB ' ' O ' ' B' ' 302' ' ' HOH . 0.4 OUTLIER -67.11 -44.97 78.59 Favored 'General case' 0 C--O 1.2 -1.527 0 CA-C-O 117.929 -1.034 . . . . 83.64 110.18 -176.956 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 4.9 m -64.39 -44.47 91.22 Favored 'General case' 0 C--N 1.299 -1.623 0 O-C-N 124.464 1.103 . . . . 74.87 110.392 177.946 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 204' ' ' TRP . . . . . . . . . . . . . 42.0 t-105 -61.46 -41.48 97.3 Favored 'General case' 0 C--O 1.239 0.523 0 CA-C-N 116.529 -0.305 . . . . 89.21 111.116 179.277 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 205' ' ' GLN . . . . . . . . . . . . . 29.0 mm100 -62.95 -37.39 86.88 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 120.761 -0.375 . . . . 110.09 111.149 176.916 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 206' ' ' ALA . . . . . . . . . . . . . . . -62.53 -21.99 65.96 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 112.573 0.583 . . . . 89.1 112.573 -179.944 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 207' ' ' LEU . . . . . . . . . . . . . . . -94.98 -4.81 45.98 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 112.656 0.613 . . . . 111.33 112.656 175.644 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 208' ' ' ILE . . . . . . . . . . . . . 2.9 mt . . . . . 0 N--CA 1.465 0.288 0 C-N-CA 124.555 1.142 . . . . 111.4 110.804 -175.816 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 101' ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 302' ' ' HOH . . . . . 0.537 ' O ' ' HB ' ' B' ' 202' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.275 0 CA-C-O 120.674 0.274 . . . . 164.47 111.001 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 27.3 mmm -66.14 161.74 21.24 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.943 0.878 . . . . 155.87 110.799 -175.666 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -66.44 -61.0 2.23 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 113.092 -1.867 . . . . 130.76 112.325 -172.344 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.566 ' HA ' HD12 ' A' ' 8' ' ' ILE . 2.3 pp -49.77 -30.35 5.62 Favored 'Isoleucine or valine' 0 C--O 1.178 -2.66 0 CA-C-O 116.576 -1.678 . . . . 126.97 111.666 -174.551 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . . . -52.93 -39.63 63.0 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-N 120.936 1.698 . . . . 128.29 111.406 -179.244 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . . . -84.9 -30.22 24.56 Favored 'General case' 0 C--O 1.238 0.455 0 N-CA-C 113.137 0.791 . . . . 116.52 113.137 175.623 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.566 HD12 ' HA ' ' A' ' 5' ' ' ILE . 6.5 mt -65.18 -55.7 19.16 Favored 'Isoleucine or valine' 0 C--O 1.237 0.442 0 CA-C-N 118.874 0.761 . . . . 108.82 111.199 172.767 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . . . -54.67 -40.73 69.35 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 119.768 -0.773 . . . . 102.87 111.264 -178.644 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 25.9 p -62.94 -38.69 92.04 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 119.809 -0.756 . . . . 114.42 110.747 177.028 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 75.2 m-20 -69.44 -44.44 71.27 Favored 'General case' 0 C--O 1.24 0.589 0 C-N-CA 120.868 -0.333 . . . . 103.39 111.041 -179.349 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.76 -40.89 97.79 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 120.15 -0.62 . . . . 78.54 111.248 176.957 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . . . -63.39 -36.74 84.72 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 120.016 -0.673 . . . . 84.92 111.156 175.865 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 18.5 m -72.96 -47.06 48.77 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 120.707 -0.397 . . . . 80.24 110.663 -179.817 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.4 tp -47.04 -49.23 21.61 Favored 'General case' 0 C--O 1.239 0.55 0 C-N-CA 123.439 0.696 . . . . 69.47 111.594 170.312 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.791 ' CD1' ' HG3' ' B' ' 174' ' ' GLU . 9.3 tp -72.78 -35.12 67.34 Favored 'General case' 0 C--O 1.171 -3.054 0 O-C-N 118.77 -2.456 . . . . 81.94 109.514 -177.32 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -69.03 -37.8 78.81 Favored 'General case' 0 C--N 1.273 -2.742 0 C-N-CA 114.484 -2.886 . . . . 123.12 111.596 -179.704 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 97.1 mtt180 -66.06 -36.07 82.23 Favored 'General case' 0 CA--C 1.515 -0.397 0 C-N-CA 118.702 -1.199 . . . . 91.97 110.728 178.316 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 27.5 mt -62.11 -37.13 83.93 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 119.591 -0.844 . . . . 59.37 110.641 176.655 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 91.6 mtt180 -66.16 -48.19 71.56 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 119.651 -0.82 . . . . 90.23 111.343 -179.851 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -71.37 -24.24 62.04 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 118.187 -1.405 . . . . 104.33 111.119 -177.403 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 29.4 m170 -86.43 -25.63 25.14 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 117.937 -1.505 . . . . 81.01 111.272 178.952 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -65.38 -35.7 81.74 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.055 -0.658 . . . . 51.35 110.728 169.236 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.65 -42.63 95.3 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 119.342 -0.943 . . . . 58.45 111.133 170.356 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.04 -39.64 78.92 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 119.561 -0.856 . . . . 51.22 111.008 178.579 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.12 -34.39 77.94 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 119.471 -0.892 . . . . 38.52 110.687 178.226 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -62.31 -42.93 99.78 Favored 'General case' 0 C--O 1.24 0.566 0 C-N-CA 119.944 -0.702 . . . . 73.88 110.958 177.251 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 38.8 m -66.97 -31.13 71.5 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 120.04 -0.664 . . . . 37.38 111.351 177.225 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 95.2 mt -63.66 -38.9 92.88 Favored 'General case' 0 C--O 1.24 0.558 0 C-N-CA 120.099 -0.64 . . . . 35.69 111.307 174.017 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 40.7 t -57.7 -45.74 86.74 Favored 'Isoleucine or valine' 0 C--O 1.239 0.539 0 C-N-CA 119.529 -0.868 . . . . 36.88 109.063 179.839 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 23.6 m-20 -70.71 -35.28 72.67 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 119.776 -0.77 . . . . 63.6 111.113 -177.685 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -55.16 -51.34 66.8 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-O 121.574 0.702 . . . . 40.35 110.32 173.164 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 64.9 p -72.24 -30.36 64.82 Favored 'General case' 0 CA--C 1.517 -0.313 0 C-N-CA 118.198 -1.401 . . . . 36.82 111.383 -174.394 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -63.14 -41.78 99.36 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-N 117.825 0.284 . . . . 30.91 111.162 174.334 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -63.56 -39.24 93.88 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-O 121.063 0.458 . . . . 34.66 110.553 176.973 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 41.4 tp -64.64 -43.53 93.4 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.314 -0.554 . . . . 38.22 110.741 175.509 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 30.7 t-80 -54.78 -50.3 68.82 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 120.108 -0.637 . . . . 37.59 110.267 175.9 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 26.0 ttm-85 -56.33 -40.95 75.26 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.239 -0.584 . . . . 87.55 110.861 179.802 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 12.5 tpp85 -69.82 -40.35 75.97 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 118.168 -1.413 . . . . 69.42 110.848 -176.335 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 53.4 t -67.07 -39.26 82.88 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 C-N-CA 120.139 -0.624 . . . . 42.94 110.575 179.725 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -67.29 -37.11 82.88 Favored 'General case' 0 C--O 1.238 0.496 0 O-C-N 121.608 -0.683 . . . . 48.29 111.176 179.543 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -69.55 -34.19 73.85 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.335 -0.546 . . . . 57.62 111.732 178.226 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 56.3 mtp -62.75 -38.65 91.39 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 119.555 -0.858 . . . . 73.6 110.375 172.01 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 41.6 ttp180 -70.31 -47.04 62.92 Favored 'General case' 0 C--N 1.303 -1.414 0 C-N-CA 118.951 -1.1 . . . . 68.45 109.94 -179.01 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . . . -64.1 -34.61 78.43 Favored 'General case' 0 C--N 1.303 -1.421 0 C-N-CA 117.709 -1.596 . . . . 79.35 111.705 179.731 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.15 -10.78 60.15 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 120.259 -0.576 . . . . 86.73 112.525 176.009 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -98.82 4.0 59.14 Favored Glycine 0 N--CA 1.447 -0.592 0 CA-C-O 119.117 -0.824 . . . . 90.94 114.94 170.155 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 2.4 m . . . . . 0 C--N 1.332 -0.196 0 CA-C-N 118.579 1.189 . . . . 104.88 110.544 -177.637 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 163' ' ' SER . . . . . . . . . . . . . 41.0 t . . . . . 0 CA--C 1.518 -0.283 0 CA-C-O 120.733 0.301 . . . . 155.04 110.35 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 164' ' ' THR . . . . . . . . . . . . . 48.7 p -73.87 -28.03 61.37 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 119.239 -0.984 . . . . 143.9 112.004 -179.967 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 165' ' ' MET . . . . . . . . . . . . . 19.0 mmm -84.91 -7.81 59.02 Favored 'General case' 0 C--O 1.238 0.494 0 N-CA-C 113.367 0.877 . . . . 144.93 113.367 -179.263 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . . . -90.8 -18.5 24.79 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 119.103 -0.475 . . . . 137.99 111.848 163.321 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 167' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -88.77 -43.92 10.91 Favored 'General case' 0 C--O 1.241 0.628 0 C-N-CA 123.763 0.825 . . . . 125.0 111.01 -177.489 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 168' ' ' LEU . . . . . . . . . . . . . 8.6 tp -38.6 -71.23 0.08 Allowed 'General case' 0 C--O 1.238 0.45 0 C-N-CA 123.777 0.831 . . . . 116.88 112.764 157.161 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 169' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -53.43 -24.18 11.93 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.78 -0.645 . . . . 115.26 111.087 -172.289 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 170' ' ' GLN . . . . . . . . . . . . . . . -75.93 -51.52 12.26 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 120.619 -0.432 . . . . 104.0 111.236 172.938 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 171' ' ' TYR . . . . . . . . . . . . . 7.9 m-30 -52.45 -48.79 65.63 Favored 'General case' 0 C--O 1.238 0.495 0 CA-C-O 121.108 0.48 . . . . 119.91 111.123 178.618 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 172' ' ' LEU . . . . . . . . . . . . . 5.5 mp -65.35 -49.87 67.74 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.535 -0.466 . . . . 96.12 111.205 -177.858 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 173' ' ' GLN . . . . . . . . . . . . . 5.1 mm100 -60.33 -32.03 70.86 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 119.809 -0.756 . . . . 102.75 111.748 -179.905 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 174' ' ' GLU . . . . . 0.791 ' HG3' ' CD1' ' A' ' 16' ' ' LEU . . . -82.41 -29.08 31.01 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 120.646 -0.421 . . . . 95.37 112.098 177.919 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 175' ' ' ALA . . . . . 0.441 ' HA ' HD12 ' A' ' 16' ' ' LEU . . . -66.53 -38.13 86.5 Favored 'General case' 0 C--O 1.238 0.453 0 C-N-CA 120.363 -0.535 . . . . 70.08 110.863 170.333 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 176' ' ' LEU . . . . . . . . . . . . . 3.4 mt -64.94 -41.0 95.89 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 119.159 -1.016 . . . . 80.17 111.018 175.003 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 177' ' ' HIS . . . . . . . . . . . . . 28.3 t-80 -62.99 -47.44 83.14 Favored 'General case' 0 C--O 1.238 0.488 0 C-N-CA 119.374 -0.93 . . . . 78.85 110.919 178.604 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 178' ' ' ARG . . . . . . . . . . . . . 15.1 tpp180 -66.29 -27.64 68.08 Favored 'General case' 0 C--O 1.241 0.616 0 C-N-CA 119.735 -0.786 . . . . 64.72 111.254 -177.119 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 179' ' ' GLU . . . . . . . . . . . . . 12.9 tm-20 -76.68 -28.25 55.86 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 119.479 -0.888 . . . . 82.76 110.775 179.893 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 180' ' ' GLN . . . . . . . . . . . . . 44.1 mt-30 -70.84 -30.52 66.96 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 119.114 -1.034 . . . . 106.1 111.688 170.322 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 181' ' ' MET . . . . . . . . . . . . . 21.9 mmt -61.29 -49.16 78.14 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 121.15 0.5 . . . . 82.06 110.128 171.567 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 182' ' ' LEU . . . . . . . . . . . . . 3.4 tt -57.1 -46.08 82.86 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.272 -0.422 . . . . 60.4 111.136 178.913 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 183' ' ' GLU . . . . . . . . . . . . . 8.9 tm-20 -61.87 -37.62 85.22 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.083 -0.647 . . . . 98.88 111.244 -178.745 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 184' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.82 -36.9 84.7 Favored 'General case' 1 C--O 1.152 -4.069 0 CA-C-O 117.044 -1.455 . . . . 92.95 107.692 178.578 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 185' ' ' LYS . . . . . . . . . . . . . 62.3 mttp -69.23 -39.52 78.47 Favored 'General case' 0 C--N 1.292 -1.895 0 CA-C-N 119.623 1.101 . . . . 42.99 110.968 175.737 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 186' ' ' LEU . . . . . . . . . . . . . 90.7 mt -63.55 -38.87 92.78 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 119.036 -1.066 . . . . 46.72 110.819 179.196 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -64.98 -37.7 88.53 Favored 'General case' 0 C--O 1.232 0.182 0 C-N-CA 119.854 -0.738 . . . . 36.26 110.813 178.139 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 188' ' ' THR . . . . . . . . . . . . . 22.6 m -65.06 -40.18 94.35 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 119.701 -0.799 . . . . 29.81 110.632 175.74 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 189' ' ' LEU . . . . . . . . . . . . . 4.1 mt -57.78 -47.81 81.46 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 120.395 -0.522 . . . . 59.19 111.471 175.346 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 190' ' ' GLN . . . . . . . . . . . . . 18.8 tm0? -55.93 -44.43 78.36 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 119.703 -0.799 . . . . 56.84 110.827 -177.524 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 191' ' ' ARG . . . . . . . . . . . . . 27.9 mtt85 -73.65 -33.49 64.52 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 120.49 -0.484 . . . . 43.05 111.846 -178.057 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 192' ' ' LEU . . . . . . . . . . . . . 18.8 mt -67.08 -40.49 86.99 Favored 'General case' 0 C--O 1.239 0.504 0 C-N-CA 119.317 -0.953 . . . . 31.16 110.662 177.69 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 193' ' ' LEU . . . . . . . . . . . . . 73.2 mt -65.8 -38.86 90.11 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 119.702 -0.799 . . . . 35.79 110.93 177.708 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 194' ' ' ALA . . . . . . . . . . . . . . . -65.29 -45.01 86.11 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 119.539 -0.864 . . . . 33.19 111.347 -177.918 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 195' ' ' ILE . . . . . . . . . . . . . 20.0 pt -74.1 -24.22 19.14 Favored 'Isoleucine or valine' 0 C--O 1.239 0.513 0 C-N-CA 118.369 -1.333 . . . . 38.99 111.343 -178.891 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 196' ' ' THR . . . . . . . . . . . . . 15.1 m -68.57 -38.88 81.09 Favored 'General case' 0 C--O 1.239 0.535 0 C-N-CA 119.066 -1.053 . . . . 34.46 111.298 169.468 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 197' ' ' GLN . . . . . . . . . . . . . 63.1 tp60 -62.04 -44.08 97.47 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 119.617 -0.833 . . . . 45.46 110.922 178.24 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 198' ' ' GLU . . . . . . . . . . . . 0.366 7.6 pt-20 -75.18 -26.96 59.45 Favored 'General case' 0 C--O 1.155 -3.888 0 CA-C-O 117.847 -1.073 . . . . 99.47 110.417 179.754 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 199' ' ' ALA . . . . . . . . . . . . . . . -66.26 -24.78 66.64 Favored 'General case' 0 C--N 1.277 -2.574 0 CA-C-N 119.858 1.208 . . . . 52.03 111.629 177.706 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 200' ' ' SER . . . . . . . . . . . . . 60.4 p -83.27 -11.25 57.95 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 112.623 0.601 . . . . 57.01 112.623 -178.746 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 201' ' ' ASP . . . . . . . . . . . . . 73.5 m-20 -63.68 -40.77 97.64 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 120.727 -0.389 . . . . 90.3 111.661 -167.406 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 202' ' ' THR . . . . . 0.537 ' HB ' ' O ' ' B' ' 302' ' ' HOH . 0.4 OUTLIER -67.11 -44.97 78.59 Favored 'General case' 0 C--O 1.2 -1.527 0 CA-C-O 117.929 -1.034 . . . . 83.64 110.18 -176.956 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 203' ' ' SER . . . . . . . . . . . . . 4.9 m -64.39 -44.47 91.22 Favored 'General case' 0 C--N 1.299 -1.623 0 O-C-N 124.464 1.103 . . . . 74.87 110.392 177.946 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 204' ' ' TRP . . . . . . . . . . . . . 42.0 t-105 -61.46 -41.48 97.3 Favored 'General case' 0 C--O 1.239 0.523 0 CA-C-N 116.529 -0.305 . . . . 89.21 111.116 179.277 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 205' ' ' GLN . . . . . . . . . . . . . 29.0 mm100 -62.95 -37.39 86.88 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 120.761 -0.375 . . . . 110.09 111.149 176.916 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 206' ' ' ALA . . . . . . . . . . . . . . . -62.53 -21.99 65.96 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 112.573 0.583 . . . . 89.1 112.573 -179.944 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 207' ' ' LEU . . . . . . . . . . . . . . . -94.98 -4.81 45.98 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 112.656 0.613 . . . . 111.33 112.656 175.644 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 208' ' ' ILE . . . . . . . . . . . . . 2.9 mt . . . . . 0 N--CA 1.465 0.288 0 C-N-CA 124.555 1.142 . . . . 111.4 110.804 -175.816 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 302' ' ' HOH . . . . . 0.537 ' O ' ' HB ' ' B' ' 202' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_