data_6h83_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 6h83 _Structure_validation_residue.Date_analyzed 2019-08-09 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 ' 213' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.299 3.667 0 CA-C-O 120.589 0.233 . . . . 60.21 111.02 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 214' ' ' MET . . . . . . . . . . . . . 47.6 tpp -69.29 -37.44 77.84 Favored 'General case' 0 N--CA 1.487 1.401 0 CA-C-O 118.598 -0.715 . . . . 48.77 111.697 -170.36 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 215' ' ' GLU . . . . . 0.492 ' OE2' ' O ' ' A' ' 501' ' ' HOH . 29.6 tt0 -61.97 -42.68 99.4 Favored 'General case' 0 N--CA 1.486 1.345 0 CA-C-N 119.413 1.006 . . . . 52.96 110.676 -174.979 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -59.53 -40.22 86.47 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 115.919 -0.582 . . . . 36.7 110.374 177.414 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 217' ' ' VAL . . . . . . . . . . . . . 56.0 t -68.63 -42.33 83.25 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.0 0 CA-C-O 122.079 0.942 . . . . 34.01 110.802 179.145 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 218' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 -63.6 -38.04 89.62 Favored 'General case' 0 N--CA 1.422 -1.852 0 O-C-N 119.875 -1.766 . . . . 43.11 108.91 -178.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 219' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -60.48 -44.27 96.1 Favored 'General case' 0 N--CA 1.457 -0.102 0 C-N-CA 119.125 -1.03 . . . . 50.97 111.39 176.906 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 220' ' ' ARG . . . . . . . . . . . . . 74.9 mtp180 -61.77 -38.66 88.88 Favored 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 113.585 0.957 . . . . 27.02 113.585 175.627 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 221' ' ' ILE . . . . . . . . . . . . . 88.5 mt -65.04 -46.88 90.05 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.581 0 N-CA-C 107.865 -1.161 . . . . 24.99 107.865 -179.212 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 222' ' ' VAL . . . . . . . . . . . . . 41.7 t -65.44 -46.91 88.69 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.544 0 C-N-CA 119.784 -0.766 . . . . 28.52 109.086 -175.853 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 223' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -56.94 -45.75 82.55 Favored 'General case' 0 C--O 1.266 1.972 0 N-CA-C 109.155 -0.683 . . . . 43.28 109.155 -178.633 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 224' ' ' ALA . . . . . . . . . . . . . . . -64.59 -44.85 89.32 Favored 'General case' 0 C--O 1.242 0.693 0 CA-C-O 122.079 0.942 . . . . 28.09 110.895 -177.834 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 225' ' ' ALA . . . . . . . . . . . . . . . -63.9 -41.18 97.76 Favored 'General case' 0 CA--C 1.539 0.52 0 O-C-N 120.113 -1.617 . . . . 24.86 109.93 -179.986 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 226' ' ' GLU . . . . . . . . . . . . . 91.1 mt-10 -72.94 -10.99 60.41 Favored 'General case' 0 C--O 1.276 2.49 0 C-N-CA 120.05 -0.66 . . . . 39.97 110.121 -172.423 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 227' ' ' ARG . . . . . . . . . . . . . 77.7 mtp85 -85.25 -10.87 56.01 Favored 'General case' 0 C--O 1.241 0.634 0 CA-C-N 119.042 0.837 . . . . 50.33 111.377 179.131 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 228' ' ' VAL . . . . . . . . . . . . . 84.7 t -80.58 132.53 58.05 Favored Pre-proline 0 C--N 1.346 0.441 0 CA-C-O 121.476 0.655 . . . . 28.8 110.771 -177.621 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 229' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_exo -56.61 129.62 35.64 Favored 'Trans proline' 0 N--CA 1.449 -1.119 0 C-N-CA 121.508 1.472 . . . . 33.04 113.774 175.875 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 230' ' ' GLY . . . . . . . . . . . . . . . 99.76 -12.48 61.03 Favored Glycine 0 N--CA 1.402 -3.606 0 O-C-N 121.922 -0.486 . . . . 26.95 113.352 178.716 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 231' ' ' VAL . . . . . . . . . . . . . 76.0 t -81.67 123.52 38.03 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.341 0 CA-C-N 118.123 0.961 . . . . 30.92 109.8 178.63 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 232' ' ' ARG . . . . . . . . . . . . . 89.4 mtt180 -107.54 67.24 0.68 Allowed 'General case' 0 C--O 1.24 0.595 0 N-CA-C 107.189 -1.412 . . . . 41.36 107.189 175.933 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . 76.48 159.98 9.88 Favored Glycine 0 N--CA 1.422 -2.261 0 CA-C-O 125.756 2.865 . . . . 28.1 113.89 -179.918 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 234' ' ' VAL . . . . . . . . . . . . . 83.6 t -88.63 116.41 30.28 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.809 0 O-C-N 120.694 -1.474 . . . . 28.9 107.915 168.264 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 235' ' ' ILE . . . . . . . . . . . . . 96.5 mt -79.84 -44.02 22.95 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.637 0 O-C-N 122.174 -0.329 . . . . 28.01 111.146 179.787 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 236' ' ' HIS . . . . . . . . . . . . . 75.5 t60 -144.97 143.15 30.37 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-N 115.627 -0.715 . . . . 32.82 109.364 -176.565 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 237' ' ' LEU . . . . . . . . . . . . . 32.6 tp -143.71 118.06 9.64 Favored 'General case' 0 C--O 1.249 1.036 0 N-CA-C 107.554 -1.276 . . . . 25.55 107.554 174.278 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 238' ' ' ARG . . . . . . . . . . . . . 17.7 ttm-85 -117.87 114.62 23.51 Favored 'General case' 0 C--O 1.202 -1.444 0 N-CA-C 106.659 -1.608 . . . . 60.02 106.659 172.335 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 239' ' ' ALA . . . . . . . . . . . . . . . -116.51 144.96 43.69 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 124.333 1.02 . . . . 29.49 108.256 -179.077 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 240' ' ' ARG . . . . . 0.693 ' NH1' ' CG ' ' A' ' 240' ' ' ARG . 11.4 ptt180 -142.95 152.09 41.64 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 108.275 -1.009 . . . . 46.67 108.275 174.106 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 241' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -88.19 134.55 33.75 Favored 'General case' 0 C--O 1.278 2.564 0 N-CA-C 106.738 -1.578 . . . . 34.24 106.738 176.652 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 242' ' ' VAL . . . . . . . . . . . . . 65.3 t -116.91 98.27 6.49 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.164 0 N-CA-C 105.767 -1.938 . . . . 37.58 105.767 162.001 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 243' ' ' GLY . . . . . . . . . . . . . . . 63.69 -127.44 36.59 Favored Glycine 1 N--CA 1.394 -4.161 0 C-N-CA 119.742 -1.218 . . . . 30.75 111.569 -165.198 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 244' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -91.33 -3.46 56.78 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 126.276 1.83 . . . . 37.51 110.738 178.791 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 245' ' ' ASP . . . . . . . . . . . . . 79.7 m-20 -95.32 151.98 18.78 Favored 'General case' 0 C--O 1.214 -0.804 0 C-N-CA 123.844 0.858 . . . . 29.04 110.293 -175.463 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 246' ' ' ILE . . . . . . . . . . . . . 9.2 mm -103.83 134.47 44.97 Favored 'Isoleucine or valine' 0 C--O 1.265 1.903 0 C-N-CA 122.772 0.429 . . . . 28.84 110.262 171.628 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 247' ' ' TRP . . . . . . . . . . . . . 35.2 m0 -115.44 134.53 55.0 Favored 'General case' 0 N--CA 1.442 -0.844 0 N-CA-C 105.61 -1.996 . . . . 36.38 105.61 168.034 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 248' ' ' ALA . . . . . . . . . . . . . . . -144.9 151.72 39.12 Favored 'General case' 0 N--CA 1.439 -0.976 0 CA-C-O 121.955 0.883 . . . . 22.76 110.764 -173.016 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 14.7 m80 -123.66 135.14 53.74 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 106.559 -1.645 . . . . 46.3 106.559 170.387 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 250' ' ' MET . . . . . . . . . . . . . 43.6 ttm -138.18 150.41 46.75 Favored 'General case' 0 N--CA 1.497 1.91 0 C-N-CA 126.742 2.017 . . . . 25.31 108.741 -174.435 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 251' ' ' ILE . . . . . . . . . . . . . 53.4 mt -117.19 125.36 73.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 N-CA-C 107.049 -1.463 . . . . 28.17 107.049 163.148 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 252' ' ' ILE . . . . . . . . . . . . . 18.5 pt -103.38 150.84 6.61 Favored 'Isoleucine or valine' 0 C--O 1.242 0.698 0 O-C-N 123.492 0.495 . . . . 23.94 111.101 173.704 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 253' ' ' GLY . . . . . . . . . . . . . . . -80.07 147.86 29.38 Favored Glycine 0 N--CA 1.434 -1.437 0 C-N-CA 120.429 -0.891 . . . . 23.86 111.011 168.432 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 254' ' ' VAL . . . . . . . . . . . . . 27.0 m -138.86 162.91 28.11 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 N-CA-C 107.911 -1.144 . . . . 26.59 107.911 172.797 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 255' ' ' ASP . . . . . . . . . . . . . 54.0 t0 -62.24 124.92 84.3 Favored Pre-proline 0 C--N 1.317 -0.81 0 CA-C-N 114.305 -1.316 . . . . 36.78 109.083 175.009 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 256' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_exo -56.62 -24.01 51.84 Favored 'Trans proline' 0 C--O 1.208 -1.003 0 C-N-CA 122.37 2.047 . . . . 33.64 114.263 178.261 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 257' ' ' GLU . . . . . . . . . . . . . 61.5 mm-40 -88.85 0.51 56.49 Favored 'General case' 0 C--O 1.2 -1.52 0 O-C-N 121.515 -0.741 . . . . 41.6 111.602 -178.625 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 61.5 m-20 -67.48 152.09 46.27 Favored 'General case' 0 C--O 1.251 1.15 0 N-CA-C 106.33 -1.73 . . . . 35.12 106.33 171.1 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 259' ' ' THR . . . . . . . . . . . . . 62.1 p -76.21 161.59 28.66 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 119.264 -0.975 . . . . 28.69 109.144 169.541 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 260' ' ' VAL . . . . . . . . . . . . . 55.6 t -57.12 -39.07 64.29 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.454 0 CA-C-N 115.275 -0.875 . . . . 28.44 109.886 172.773 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 261' ' ' GLU . . . . . . . . . . . . . 46.4 tp10 -64.01 -43.83 94.46 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 118.623 -1.231 . . . . 39.52 111.323 177.524 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 86.1 mt-30 -59.06 -41.98 89.24 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-O 118.824 -0.608 . . . . 31.07 110.279 177.451 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 263' ' ' ALA . . . . . . . . . . . . . . . -63.24 -40.63 97.98 Favored 'General case' 0 C--O 1.238 0.448 0 N-CA-C 108.435 -0.95 . . . . 22.99 108.435 -179.742 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 264' ' ' HIS . . . . . . . . . . . . . 14.0 t60 -61.65 -41.71 97.9 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-O 122.169 0.985 . . . . 39.74 110.817 178.322 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -61.44 -42.73 99.21 Favored 'General case' 0 N--CA 1.433 -1.315 0 O-C-N 121.419 -0.801 . . . . 43.37 111.763 177.862 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 51.1 mt -64.04 -45.98 95.12 Favored 'Isoleucine or valine' 0 C--O 1.247 0.949 0 N-CA-C 108.605 -0.887 . . . . 23.36 108.605 179.083 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 267' ' ' CYS . . . . . . . . . . . . . 62.6 m -59.22 -45.24 91.64 Favored 'General case' 0 C--O 1.257 1.495 0 O-C-N 125.053 1.471 . . . . 24.0 109.127 -179.098 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 268' ' ' GLU . . . . . . . . . . . . . 60.7 mt-10 -61.2 -40.07 92.59 Favored 'General case' 0 N--CA 1.503 2.183 0 O-C-N 121.82 -0.55 . . . . 50.54 110.402 -179.59 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 269' ' ' ALA . . . . . . . . . . . . . . . -65.49 -39.11 91.53 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 111.975 0.361 . . . . 25.44 111.975 177.454 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 270' ' ' VAL . . . . . . . . . . . . . 46.6 t -61.61 -49.68 83.37 Favored 'Isoleucine or valine' 0 C--O 1.243 0.752 0 N-CA-C 108.555 -0.906 . . . . 22.54 108.555 174.416 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 271' ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -54.3 -45.39 72.56 Favored 'General case' 0 C--O 1.265 1.917 0 C-N-CA 117.275 -1.77 . . . . 47.1 110.806 -179.796 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 272' ' ' ALA . . . . . . . . . . . . . . . -64.69 -41.92 95.7 Favored 'General case' 0 C--O 1.267 1.985 0 CA-C-N 118.11 0.414 . . . . 29.54 110.952 -176.777 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 273' ' ' ALA . . . . . . . . . . . . . . . -65.07 -49.93 68.15 Favored 'General case' 0 C--O 1.244 0.8 0 O-C-N 123.92 0.763 . . . . 28.51 109.672 -175.592 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 274' ' ' VAL . . . . . . . . . . . . . 62.7 t -68.03 -48.17 75.72 Favored 'Isoleucine or valine' 0 C--O 1.242 0.668 0 O-C-N 123.794 0.684 . . . . 25.8 109.524 -173.745 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 275' ' ' CYS . . . . . . . . . . . . . 84.0 m -63.84 -31.46 72.65 Favored 'General case' 0 C--O 1.241 0.624 0 O-C-N 123.497 0.498 . . . . 35.8 111.743 179.447 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 276' ' ' GLY . . . . . . . . . . . . . . . -72.92 -27.0 69.67 Favored Glycine 0 C--N 1.343 0.918 0 CA-C-N 117.945 0.338 . . . . 36.49 112.89 177.826 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 277' ' ' LYS . . . . . . . . . . . . . 77.2 mttt -96.66 -25.13 15.68 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 121.627 -0.926 . . . . 40.86 110.965 -174.357 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 278' ' ' ILE . . . . . . . . . . . . . 7.1 mt -123.72 98.17 5.25 Favored 'Isoleucine or valine' 0 C--O 1.247 0.968 0 N-CA-C 106.838 -1.542 . . . . 28.99 106.838 -173.017 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 279' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.61 -28.62 67.9 Favored 'General case' 0 C--O 1.242 0.662 0 CA-C-N 114.381 -1.281 . . . . 56.49 111.388 -167.783 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 19.5 ptp180 -77.54 -6.8 54.89 Favored 'General case' 0 N--CA 1.442 -0.875 0 N-CA-C 113.002 0.742 . . . . 29.87 113.002 -174.786 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 281' ' ' ILE . . . . . . . . . . . . . 97.0 mt -78.71 120.84 30.54 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 N-CA-C 108.167 -1.049 . . . . 25.68 108.167 179.544 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 68.2 mm-40 -110.92 -7.17 14.59 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 119.806 -0.758 . . . . 37.35 111.061 179.721 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 283' ' ' SER . . . . . . . . . . . . . 41.1 t -151.11 125.72 9.58 Favored 'General case' 0 C--O 1.207 -1.143 0 O-C-N 121.073 -1.017 . . . . 32.3 109.677 173.719 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 284' ' ' LEU . . . . . . . . . . . . . 63.2 tp -141.72 117.06 10.14 Favored 'General case' 0 C--O 1.274 2.37 0 C-N-CA 121.182 -0.207 . . . . 30.27 110.59 179.43 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 285' ' ' HIS . . . . . 0.663 ' ND1' ' O ' ' A' ' 503' ' ' HOH . 61.9 m170 -105.68 128.41 53.64 Favored 'General case' 0 N--CA 1.453 -0.295 0 O-C-N 123.592 0.558 . . . . 34.79 109.718 174.618 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 286' ' ' VAL . . . . . . . . . . . . . 57.6 t -123.63 122.9 66.03 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.571 0 O-C-N 125.412 1.695 . . . . 26.0 108.603 -176.679 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 287' ' ' SER . . . . . . . . . . . . . 89.4 p -118.45 170.85 8.58 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 123.332 0.653 . . . . 34.97 109.465 173.572 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 288' ' ' ALA . . . . . . . . . . . . . . . -130.67 148.29 52.44 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-O 121.618 0.723 . . . . 27.6 110.011 -171.319 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 289' ' ' GLU . . . . . . . . . . . . . 63.6 mt-10 -136.07 148.16 48.18 Favored 'General case' 0 C--O 1.209 -1.037 0 N-CA-C 108.145 -1.057 . . . . 44.9 108.145 172.508 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 290' ' ' ALA . . . . . . . . . . . . . . . -59.27 134.89 57.41 Favored 'General case' 0 C--O 1.219 -0.55 0 N-CA-C 109.2 -0.667 . . . . 34.44 109.2 174.591 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 291' ' ' ARG . . . . . . . . . . . . . 34.1 ttt180 -145.31 137.44 25.7 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.34 1.025 . . . . 60.69 109.511 174.96 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 292' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.445 -0.682 0 C-N-CA 127.873 2.469 . . . . 64.36 109.196 -158.982 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 401' ' ' ' CU' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 402' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 403' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 404' ' ' BME . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 405' ' ' ' NA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 501' ' ' HOH . . . . . 0.492 ' O ' ' OE2' ' A' ' 215' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 503' ' ' HOH . . . . . 0.663 ' O ' ' ND1' ' A' ' 285' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 507' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 508' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 509' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 511' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 512' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 513' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 514' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 515' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 516' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 517' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 518' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 519' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 520' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 521' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 522' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 523' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 524' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 525' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 526' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 527' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 528' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 529' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 530' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 531' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 532' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 533' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 534' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 535' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 536' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 537' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 538' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 539' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 540' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 541' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 542' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 543' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 544' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 545' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 546' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 547' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 213' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.299 3.667 0 CA-C-O 120.589 0.233 . . . . 60.21 111.02 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 214' ' ' MET . . . . . . . . . . . . . 47.6 tpp -69.29 -37.44 77.84 Favored 'General case' 0 N--CA 1.487 1.401 0 CA-C-O 118.598 -0.715 . . . . 48.77 111.697 -170.36 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 215' ' ' GLU . . . . . 0.492 ' OE2' ' O ' ' A' ' 501' ' ' HOH . 29.6 tt0 -61.97 -42.68 99.4 Favored 'General case' 0 N--CA 1.486 1.345 0 CA-C-N 119.413 1.006 . . . . 52.96 110.676 -174.979 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -59.53 -40.22 86.47 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 115.919 -0.582 . . . . 36.7 110.374 177.414 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 217' ' ' VAL . . . . . . . . . . . . . 56.0 t -68.63 -42.33 83.25 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.0 0 CA-C-O 122.079 0.942 . . . . 34.01 110.802 179.145 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 218' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 -63.6 -38.04 89.62 Favored 'General case' 0 N--CA 1.422 -1.852 0 O-C-N 119.875 -1.766 . . . . 43.11 108.91 -178.924 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 219' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -60.48 -44.27 96.1 Favored 'General case' 0 N--CA 1.457 -0.102 0 C-N-CA 119.125 -1.03 . . . . 50.97 111.39 176.906 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 220' ' ' ARG . . . . . . . . . . . . . 74.9 mtp180 -61.77 -38.66 88.88 Favored 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 113.585 0.957 . . . . 27.02 113.585 175.627 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 221' ' ' ILE . . . . . . . . . . . . . 88.5 mt -65.04 -46.88 90.05 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.581 0 N-CA-C 107.865 -1.161 . . . . 24.99 107.865 -179.212 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 222' ' ' VAL . . . . . . . . . . . . . 41.7 t -65.44 -46.91 88.69 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.544 0 C-N-CA 119.784 -0.766 . . . . 28.52 109.086 -175.853 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 223' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -56.94 -45.75 82.55 Favored 'General case' 0 C--O 1.266 1.972 0 N-CA-C 109.155 -0.683 . . . . 43.28 109.155 -178.633 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 224' ' ' ALA . . . . . . . . . . . . . . . -64.59 -44.85 89.32 Favored 'General case' 0 C--O 1.242 0.693 0 CA-C-O 122.079 0.942 . . . . 28.09 110.895 -177.834 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 225' ' ' ALA . . . . . . . . . . . . . . . -63.9 -41.18 97.76 Favored 'General case' 0 CA--C 1.539 0.52 0 O-C-N 120.113 -1.617 . . . . 24.86 109.93 -179.986 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 226' ' ' GLU . . . . . . . . . . . . . 91.1 mt-10 -72.94 -10.99 60.41 Favored 'General case' 0 C--O 1.276 2.49 0 C-N-CA 120.05 -0.66 . . . . 39.97 110.121 -172.423 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 227' ' ' ARG . . . . . . . . . . . . . 77.7 mtp85 -85.25 -10.87 56.01 Favored 'General case' 0 C--O 1.241 0.634 0 CA-C-N 119.042 0.837 . . . . 50.33 111.377 179.131 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 228' ' ' VAL . . . . . . . . . . . . . 84.7 t -80.58 132.53 58.05 Favored Pre-proline 0 C--N 1.346 0.441 0 CA-C-O 121.476 0.655 . . . . 28.8 110.771 -177.621 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 229' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_exo -56.61 129.62 35.64 Favored 'Trans proline' 0 N--CA 1.449 -1.119 0 C-N-CA 121.508 1.472 . . . . 33.04 113.774 175.875 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 230' ' ' GLY . . . . . . . . . . . . . . . 99.76 -12.48 61.03 Favored Glycine 0 N--CA 1.402 -3.606 0 O-C-N 121.922 -0.486 . . . . 26.95 113.352 178.716 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 231' ' ' VAL . . . . . . . . . . . . . 76.0 t -81.67 123.52 38.03 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.341 0 CA-C-N 118.123 0.961 . . . . 30.92 109.8 178.63 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 232' ' ' ARG . . . . . . . . . . . . . 89.4 mtt180 -107.54 67.24 0.68 Allowed 'General case' 0 C--O 1.24 0.595 0 N-CA-C 107.189 -1.412 . . . . 41.36 107.189 175.933 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . 76.48 159.98 9.88 Favored Glycine 0 N--CA 1.422 -2.261 0 CA-C-O 125.756 2.865 . . . . 28.1 113.89 -179.918 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 234' ' ' VAL . . . . . . . . . . . . . 83.6 t -88.63 116.41 30.28 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.809 0 O-C-N 120.694 -1.474 . . . . 28.9 107.915 168.264 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 235' ' ' ILE . . . . . . . . . . . . . 96.5 mt -79.84 -44.02 22.95 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.637 0 O-C-N 122.174 -0.329 . . . . 28.01 111.146 179.787 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 236' ' ' HIS . . . . . . . . . . . . . 75.5 t60 -144.97 143.15 30.37 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-N 115.627 -0.715 . . . . 32.82 109.364 -176.565 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 237' ' ' LEU . . . . . . . . . . . . . 32.6 tp -143.71 118.06 9.64 Favored 'General case' 0 C--O 1.249 1.036 0 N-CA-C 107.554 -1.276 . . . . 25.55 107.554 174.278 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 238' ' ' ARG . . . . . . . . . . . . . 17.7 ttm-85 -117.87 114.62 23.51 Favored 'General case' 0 C--O 1.202 -1.444 0 N-CA-C 106.659 -1.608 . . . . 60.02 106.659 172.335 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 239' ' ' ALA . . . . . . . . . . . . . . . -116.51 144.96 43.69 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 124.333 1.02 . . . . 29.49 108.256 -179.077 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 240' ' ' ARG . . . . . 1.031 HH11 ' HG2' ' A' ' 240' ' ' ARG . 11.4 ptt180 -142.95 152.09 41.64 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 108.275 -1.009 . . . . 46.67 108.275 174.106 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 241' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -88.19 134.55 33.75 Favored 'General case' 0 C--O 1.278 2.564 0 N-CA-C 106.738 -1.578 . . . . 34.24 106.738 176.652 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 242' ' ' VAL . . . . . . . . . . . . . 65.3 t -116.91 98.27 6.49 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.164 0 N-CA-C 105.767 -1.938 . . . . 37.58 105.767 162.001 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 243' ' ' GLY . . . . . . . . . . . . . . . 63.69 -127.44 36.59 Favored Glycine 1 N--CA 1.394 -4.161 0 C-N-CA 119.742 -1.218 . . . . 30.75 111.569 -165.198 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 244' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -91.33 -3.46 56.78 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 126.276 1.83 . . . . 40.46 110.738 178.791 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 245' ' ' ASP . . . . . . . . . . . . . 79.7 m-20 -95.32 151.98 18.78 Favored 'General case' 0 C--O 1.214 -0.804 0 C-N-CA 123.844 0.858 . . . . 29.04 110.293 -175.463 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 246' ' ' ILE . . . . . . . . . . . . . 9.2 mm -103.83 134.47 44.97 Favored 'Isoleucine or valine' 0 C--O 1.265 1.903 0 C-N-CA 122.772 0.429 . . . . 28.84 110.262 171.628 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 247' ' ' TRP . . . . . . . . . . . . . 35.2 m0 -115.44 134.53 55.0 Favored 'General case' 0 N--CA 1.442 -0.844 0 N-CA-C 105.61 -1.996 . . . . 36.38 105.61 168.034 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 248' ' ' ALA . . . . . . . . . . . . . . . -144.9 151.72 39.12 Favored 'General case' 0 N--CA 1.439 -0.976 0 CA-C-O 121.955 0.883 . . . . 22.76 110.764 -173.016 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 14.7 m80 -123.66 135.14 53.74 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 106.559 -1.645 . . . . 46.3 106.559 170.387 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 250' ' ' MET . . . . . . . . . . . . . 43.6 ttm -138.18 150.41 46.75 Favored 'General case' 0 N--CA 1.497 1.91 0 C-N-CA 126.742 2.017 . . . . 25.31 108.741 -174.435 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 251' ' ' ILE . . . . . . . . . . . . . 53.4 mt -117.19 125.36 73.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 N-CA-C 107.049 -1.463 . . . . 28.17 107.049 163.148 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 252' ' ' ILE . . . . . . . . . . . . . 18.5 pt -103.38 150.84 6.61 Favored 'Isoleucine or valine' 0 C--O 1.242 0.698 0 O-C-N 123.492 0.495 . . . . 23.94 111.101 173.704 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 253' ' ' GLY . . . . . . . . . . . . . . . -80.07 147.86 29.38 Favored Glycine 0 N--CA 1.434 -1.437 0 C-N-CA 120.429 -0.891 . . . . 23.86 111.011 168.432 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 254' ' ' VAL . . . . . . . . . . . . . 27.0 m -138.86 162.91 28.11 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 N-CA-C 107.911 -1.144 . . . . 26.59 107.911 172.797 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 255' ' ' ASP . . . . . . . . . . . . . 54.0 t0 -62.24 124.92 84.3 Favored Pre-proline 0 C--N 1.317 -0.81 0 CA-C-N 114.305 -1.316 . . . . 36.78 109.083 175.009 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 256' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_exo -56.62 -24.01 51.84 Favored 'Trans proline' 0 C--O 1.208 -1.003 0 C-N-CA 122.37 2.047 . . . . 33.64 114.263 178.261 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 257' ' ' GLU . . . . . . . . . . . . . 61.5 mm-40 -88.85 0.51 56.49 Favored 'General case' 0 C--O 1.2 -1.52 0 O-C-N 121.515 -0.741 . . . . 41.6 111.602 -178.625 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 61.5 m-20 -67.48 152.09 46.27 Favored 'General case' 0 C--O 1.251 1.15 0 N-CA-C 106.33 -1.73 . . . . 35.12 106.33 171.1 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 259' ' ' THR . . . . . . . . . . . . . 62.1 p -76.21 161.59 28.66 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 119.264 -0.975 . . . . 28.69 109.144 169.541 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 260' ' ' VAL . . . . . . . . . . . . . 55.6 t -57.12 -39.07 64.29 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.454 0 CA-C-N 115.275 -0.875 . . . . 28.44 109.886 172.773 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 261' ' ' GLU . . . . . . . . . . . . . 46.4 tp10 -64.01 -43.83 94.46 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 118.623 -1.231 . . . . 39.52 111.323 177.524 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 86.1 mt-30 -59.06 -41.98 89.24 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-O 118.824 -0.608 . . . . 31.07 110.279 177.451 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 263' ' ' ALA . . . . . . . . . . . . . . . -63.24 -40.63 97.98 Favored 'General case' 0 C--O 1.238 0.448 0 N-CA-C 108.435 -0.95 . . . . 22.99 108.435 -179.742 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 264' ' ' HIS . . . . . . . . . . . . . 14.0 t60 -61.65 -41.71 97.9 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-O 122.169 0.985 . . . . 39.74 110.817 178.322 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -61.44 -42.73 99.21 Favored 'General case' 0 N--CA 1.433 -1.315 0 O-C-N 121.419 -0.801 . . . . 43.37 111.763 177.862 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 51.1 mt -64.04 -45.98 95.12 Favored 'Isoleucine or valine' 0 C--O 1.247 0.949 0 N-CA-C 108.605 -0.887 . . . . 23.36 108.605 179.083 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 267' ' ' CYS . . . . . . . . . . . . . 62.6 m -59.22 -45.24 91.64 Favored 'General case' 0 C--O 1.257 1.495 0 O-C-N 125.053 1.471 . . . . 24.0 109.127 -179.098 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 268' ' ' GLU . . . . . . . . . . . . . 60.7 mt-10 -61.2 -40.07 92.59 Favored 'General case' 0 N--CA 1.503 2.183 0 O-C-N 121.82 -0.55 . . . . 50.54 110.402 -179.59 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 269' ' ' ALA . . . . . . . . . . . . . . . -65.49 -39.11 91.53 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 111.975 0.361 . . . . 25.44 111.975 177.454 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 270' ' ' VAL . . . . . . . . . . . . . 46.6 t -61.61 -49.68 83.37 Favored 'Isoleucine or valine' 0 C--O 1.243 0.752 0 N-CA-C 108.555 -0.906 . . . . 22.54 108.555 174.416 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 271' ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -54.3 -45.39 72.56 Favored 'General case' 0 C--O 1.265 1.917 0 C-N-CA 117.275 -1.77 . . . . 47.1 110.806 -179.796 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 272' ' ' ALA . . . . . . . . . . . . . . . -64.69 -41.92 95.7 Favored 'General case' 0 C--O 1.267 1.985 0 CA-C-N 118.11 0.414 . . . . 29.54 110.952 -176.777 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 273' ' ' ALA . . . . . . . . . . . . . . . -65.07 -49.93 68.15 Favored 'General case' 0 C--O 1.244 0.8 0 O-C-N 123.92 0.763 . . . . 28.51 109.672 -175.592 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 274' ' ' VAL . . . . . . . . . . . . . 62.7 t -68.03 -48.17 75.72 Favored 'Isoleucine or valine' 0 C--O 1.242 0.668 0 O-C-N 123.794 0.684 . . . . 25.8 109.524 -173.745 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 275' ' ' CYS . . . . . . . . . . . . . 84.0 m -63.84 -31.46 72.65 Favored 'General case' 0 C--O 1.241 0.624 0 O-C-N 123.497 0.498 . . . . 35.8 111.743 179.447 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 276' ' ' GLY . . . . . . . . . . . . . . . -72.92 -27.0 69.67 Favored Glycine 0 C--N 1.343 0.918 0 CA-C-N 117.945 0.338 . . . . 36.49 112.89 177.826 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 277' ' ' LYS . . . . . . . . . . . . . 77.2 mttt -96.66 -25.13 15.68 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 121.627 -0.926 . . . . 40.86 110.965 -174.357 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 278' ' ' ILE . . . . . . . . . . . . . 7.1 mt -123.72 98.17 5.25 Favored 'Isoleucine or valine' 0 C--O 1.247 0.968 0 N-CA-C 106.838 -1.542 . . . . 28.99 106.838 -173.017 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 279' ' ' ARG . . . . . 0.45 ' HD3' ' O ' ' A' ' 536' ' ' HOH . 0.0 OUTLIER -67.61 -28.62 67.9 Favored 'General case' 0 C--O 1.242 0.662 0 CA-C-N 114.381 -1.281 . . . . 56.49 111.388 -167.783 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 19.5 ptp180 -77.54 -6.8 54.89 Favored 'General case' 0 N--CA 1.442 -0.875 0 N-CA-C 113.002 0.742 . . . . 29.87 113.002 -174.786 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 281' ' ' ILE . . . . . . . . . . . . . 97.0 mt -78.71 120.84 30.54 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 N-CA-C 108.167 -1.049 . . . . 25.68 108.167 179.544 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 68.2 mm-40 -110.92 -7.17 14.59 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 119.806 -0.758 . . . . 37.35 111.061 179.721 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 283' ' ' SER . . . . . . . . . . . . . 41.1 t -151.11 125.72 9.58 Favored 'General case' 0 C--O 1.207 -1.143 0 O-C-N 121.073 -1.017 . . . . 32.3 109.677 173.719 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 284' ' ' LEU . . . . . . . . . . . . . 63.2 tp -141.72 117.06 10.14 Favored 'General case' 0 C--O 1.274 2.37 0 C-N-CA 121.182 -0.207 . . . . 30.27 110.59 179.43 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 285' ' ' HIS . . . . . 0.663 ' ND1' ' O ' ' A' ' 503' ' ' HOH . 61.9 m170 -105.68 128.41 53.64 Favored 'General case' 0 N--CA 1.453 -0.295 0 O-C-N 123.592 0.558 . . . . 36.69 109.718 174.618 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 286' ' ' VAL . . . . . . . . . . . . . 57.6 t -123.63 122.9 66.03 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.571 0 O-C-N 125.412 1.695 . . . . 26.0 108.603 -176.679 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 287' ' ' SER . . . . . . . . . . . . . 89.4 p -118.45 170.85 8.58 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 123.332 0.653 . . . . 34.97 109.465 173.572 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 288' ' ' ALA . . . . . . . . . . . . . . . -130.67 148.29 52.44 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-O 121.618 0.723 . . . . 27.6 110.011 -171.319 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 289' ' ' GLU . . . . . . . . . . . . . 63.6 mt-10 -136.07 148.16 48.18 Favored 'General case' 0 C--O 1.209 -1.037 0 N-CA-C 108.145 -1.057 . . . . 44.9 108.145 172.508 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 290' ' ' ALA . . . . . . . . . . . . . . . -59.27 134.89 57.41 Favored 'General case' 0 C--O 1.219 -0.55 0 N-CA-C 109.2 -0.667 . . . . 34.44 109.2 174.591 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 291' ' ' ARG . . . . . . . . . . . . . 34.1 ttt180 -145.31 137.44 25.7 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.34 1.025 . . . . 60.69 109.511 174.96 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 292' ' ' GLU . . . . . 0.581 ' H ' ' CD ' ' A' ' 292' ' ' GLU . 1.0 OUTLIER . . . . . 0 N--CA 1.445 -0.682 0 C-N-CA 127.873 2.469 . . . . 64.36 109.196 -158.982 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 401' ' ' ' CU' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 402' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 403' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 404' ' ' BME . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 405' ' ' ' NA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 501' ' ' HOH . . . . . 0.492 ' O ' ' OE2' ' A' ' 215' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 503' ' ' HOH . . . . . 0.663 ' O ' ' ND1' ' A' ' 285' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 507' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 508' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 509' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 511' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 512' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 513' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 514' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 515' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 516' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 517' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 518' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 519' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 520' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 521' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 522' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 523' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 524' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 525' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 526' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 527' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 528' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 529' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 530' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 531' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 532' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 533' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 534' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 535' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 536' ' ' HOH . . . . . 0.45 ' O ' ' HD3' ' A' ' 279' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 537' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 538' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 539' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 540' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 541' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 542' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 543' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 544' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 545' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 546' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 547' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 213' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.299 3.667 0 CA-C-O 120.589 0.233 . . . . 60.210000000000001 111.02 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 214' ' ' MET . . . . . . . . . . . . . 47.6 tpp -69.29 -37.44 77.84 Favored 'General case' 0 N--CA 1.487 1.401 0 CA-C-O 118.598 -0.715 . . . . 48.770000000000003 111.697 -170.36 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 215' ' ' GLU . . . . . 0.492 ' OE2' ' O ' ' A' ' 501' ' ' HOH . 29.6 tt0 -61.97 -42.68 99.4 Favored 'General case' 0 N--CA 1.486 1.345 0 CA-C-N 119.413 1.006 . . . . 52.960000000000001 110.676 -174.979 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 216' ' ' ALA . . . . . . . . . . . . . . . -59.53 -40.22 86.47 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 115.919 -0.582 . . . . 36.700000000000003 110.374 177.414 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 217' ' ' VAL . . . . . . . . . . . . . 56.0 t -68.63 -42.33 83.25 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.0 0 CA-C-O 122.079 0.942 . . . . 34.009999999999998 110.802 179.145 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 218' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 -63.6 -38.04 89.62 Favored 'General case' 0 N--CA 1.422 -1.852 0 O-C-N 119.875 -1.766 . . . . 43.109999999999999 108.91 -178.924 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 219' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -60.48 -44.27 96.1 Favored 'General case' 0 N--CA 1.457 -0.102 0 C-N-CA 119.125 -1.03 . . . . 50.969999999999999 111.39 176.906 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 220' ' ' ARG . . . . . . . . . . . . . 74.9 mtp180 -61.77 -38.66 88.88 Favored 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 113.585 0.957 . . . . 27.02 113.585 175.627 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 221' ' ' ILE . . . . . . . . . . . . . 88.5 mt -65.04 -46.88 90.05 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.581 0 N-CA-C 107.865 -1.161 . . . . 24.989999999999998 107.865 -179.212 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 222' ' ' VAL . . . . . . . . . . . . . 41.7 t -65.44 -46.91 88.69 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.544 0 C-N-CA 119.784 -0.766 . . . . 28.52 109.086 -175.853 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 223' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -56.94 -45.75 82.55 Favored 'General case' 0 C--O 1.266 1.972 0 N-CA-C 109.155 -0.683 . . . . 43.280000000000001 109.155 -178.633 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 224' ' ' ALA . . . . . . . . . . . . . . . -64.59 -44.85 89.32 Favored 'General case' 0 C--O 1.242 0.693 0 CA-C-O 122.079 0.942 . . . . 28.09 110.895 -177.834 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 225' ' ' ALA . . . . . . . . . . . . . . . -63.9 -41.18 97.76 Favored 'General case' 0 CA--C 1.539 0.52 0 O-C-N 120.113 -1.617 . . . . 24.859999999999999 109.93 -179.986 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 226' ' ' GLU . . . . . . . . . . . . . 91.1 mt-10 -72.94 -10.99 60.41 Favored 'General case' 0 C--O 1.276 2.49 0 C-N-CA 120.05 -0.66 . . . . 39.969999999999999 110.121 -172.423 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 227' ' ' ARG . . . . . . . . . . . . . 77.7 mtp85 -85.25 -10.87 56.01 Favored 'General case' 0 C--O 1.241 0.634 0 CA-C-N 119.042 0.837 . . . . 50.329999999999998 111.377 179.131 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 228' ' ' VAL . . . . . . . . . . . . . 84.7 t -80.58 132.53 58.05 Favored Pre-proline 0 C--N 1.346 0.441 0 CA-C-O 121.476 0.655 . . . . 28.800000000000001 110.771 -177.621 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 229' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_exo -56.61 129.62 35.64 Favored 'Trans proline' 0 N--CA 1.449 -1.119 0 C-N-CA 121.508 1.472 . . . . 33.039999999999999 113.774 175.875 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 230' ' ' GLY . . . . . . . . . . . . . . . 99.76 -12.48 61.03 Favored Glycine 0 N--CA 1.402 -3.606 0 O-C-N 121.922 -0.486 . . . . 26.949999999999999 113.352 178.716 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 231' ' ' VAL . . . . . . . . . . . . . 76.0 t -81.67 123.52 38.03 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.341 0 CA-C-N 118.123 0.961 . . . . 30.920000000000002 109.8 178.63 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 232' ' ' ARG . . . . . . . . . . . . . 89.4 mtt180 -107.54 67.24 0.68 Allowed 'General case' 0 C--O 1.24 0.595 0 N-CA-C 107.189 -1.412 . . . . 41.359999999999999 107.189 175.933 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 233' ' ' GLY . . . . . . . . . . . . . . . 76.48 159.98 9.88 Favored Glycine 0 N--CA 1.422 -2.261 0 CA-C-O 125.756 2.865 . . . . 28.100000000000001 113.89 -179.918 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 234' ' ' VAL . . . . . . . . . . . . . 83.6 t -88.63 116.41 30.28 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.809 0 O-C-N 120.694 -1.474 . . . . 28.899999999999999 107.915 168.264 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 235' ' ' ILE . . . . . . . . . . . . . 96.5 mt -79.84 -44.02 22.95 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.637 0 O-C-N 122.174 -0.329 . . . . 28.010000000000002 111.146 179.787 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 236' ' ' HIS . . . . . . . . . . . . . 75.5 t60 -144.97 143.15 30.37 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-N 115.627 -0.715 . . . . 32.82 109.364 -176.565 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 237' ' ' LEU . . . . . . . . . . . . . 32.6 tp -143.71 118.06 9.64 Favored 'General case' 0 C--O 1.249 1.036 0 N-CA-C 107.554 -1.276 . . . . 25.550000000000001 107.554 174.278 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 238' ' ' ARG . . . . . . . . . . . . . 17.7 ttm-85 -117.87 114.62 23.51 Favored 'General case' 0 C--O 1.202 -1.444 0 N-CA-C 106.659 -1.608 . . . . 60.020000000000003 106.659 172.335 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 239' ' ' ALA . . . . . . . . . . . . . . . -116.51 144.96 43.69 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 124.333 1.02 . . . . 29.489999999999998 108.256 -179.077 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 240' ' ' ARG . . . . . 1.031 HH11 ' HG2' ' A' ' 240' ' ' ARG . 11.4 ptt180 -142.95 152.09 41.64 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 108.275 -1.009 . . . . 46.670000000000002 108.275 174.106 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 241' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -88.19 134.55 33.75 Favored 'General case' 0 C--O 1.278 2.564 0 N-CA-C 106.738 -1.578 . . . . 34.240000000000002 106.738 176.652 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 242' ' ' VAL . . . . . . . . . . . . . 65.3 t -116.91 98.27 6.49 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.164 0 N-CA-C 105.767 -1.938 . . . . 37.579999999999998 105.767 162.001 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 243' ' ' GLY . . . . . . . . . . . . . . . 63.69 -127.44 36.59 Favored Glycine 1 N--CA 1.394 -4.161 0 C-N-CA 119.742 -1.218 . . . . 30.75 111.569 -165.198 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 244' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -91.33 -3.46 56.78 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 126.276 1.83 . . . . 40.460000000000001 110.738 178.791 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 245' ' ' ASP . . . . . . . . . . . . . 79.7 m-20 -95.32 151.98 18.78 Favored 'General case' 0 C--O 1.214 -0.804 0 C-N-CA 123.844 0.858 . . . . 29.039999999999999 110.293 -175.463 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 246' ' ' ILE . . . . . . . . . . . . . 9.2 mm -103.83 134.47 44.97 Favored 'Isoleucine or valine' 0 C--O 1.265 1.903 0 C-N-CA 122.772 0.429 . . . . 28.84 110.262 171.628 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 247' ' ' TRP . . . . . . . . . . . . . 35.2 m0 -115.44 134.53 55.0 Favored 'General case' 0 N--CA 1.442 -0.844 0 N-CA-C 105.61 -1.996 . . . . 36.380000000000003 105.61 168.034 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 248' ' ' ALA . . . . . . . . . . . . . . . -144.9 151.72 39.12 Favored 'General case' 0 N--CA 1.439 -0.976 0 CA-C-O 121.955 0.883 . . . . 22.760000000000002 110.764 -173.016 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 249' ' ' HIS . . . . . . . . . . . . . 14.7 m80 -123.66 135.14 53.74 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 106.559 -1.645 . . . . 46.299999999999997 106.559 170.387 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 250' ' ' MET . . . . . . . . . . . . . 43.6 ttm -138.18 150.41 46.75 Favored 'General case' 0 N--CA 1.497 1.91 0 C-N-CA 126.742 2.017 . . . . 25.309999999999999 108.741 -174.435 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 251' ' ' ILE . . . . . . . . . . . . . 53.4 mt -117.19 125.36 73.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 N-CA-C 107.049 -1.463 . . . . 28.170000000000002 107.049 163.148 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 252' ' ' ILE . . . . . . . . . . . . . 18.5 pt -103.38 150.84 6.61 Favored 'Isoleucine or valine' 0 C--O 1.242 0.698 0 O-C-N 123.492 0.495 . . . . 23.940000000000001 111.101 173.704 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 253' ' ' GLY . . . . . . . . . . . . . . . -80.07 147.86 29.38 Favored Glycine 0 N--CA 1.434 -1.437 0 C-N-CA 120.429 -0.891 . . . . 23.859999999999999 111.011 168.432 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 254' ' ' VAL . . . . . . . . . . . . . 27.0 m -138.86 162.91 28.11 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 N-CA-C 107.911 -1.144 . . . . 26.59 107.911 172.797 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 255' ' ' ASP . . . . . . . . . . . . . 54.0 t0 -62.24 124.92 84.3 Favored Pre-proline 0 C--N 1.317 -0.81 0 CA-C-N 114.305 -1.316 . . . . 36.780000000000001 109.083 175.009 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 256' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_exo -56.62 -24.01 51.84 Favored 'Trans proline' 0 C--O 1.208 -1.003 0 C-N-CA 122.37 2.047 . . . . 33.640000000000001 114.263 178.261 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 257' ' ' GLU . . . . . . . . . . . . . 61.5 mm-40 -88.85 0.51 56.49 Favored 'General case' 0 C--O 1.2 -1.52 0 O-C-N 121.515 -0.741 . . . . 41.600000000000001 111.602 -178.625 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 258' ' ' ASN . . . . . . . . . . . . . 61.5 m-20 -67.48 152.09 46.27 Favored 'General case' 0 C--O 1.251 1.15 0 N-CA-C 106.33 -1.73 . . . . 35.119999999999997 106.33 171.1 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 259' ' ' THR . . . . . . . . . . . . . 62.1 p -76.21 161.59 28.66 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 119.264 -0.975 . . . . 28.690000000000001 109.144 169.541 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 260' ' ' VAL . . . . . . . . . . . . . 55.6 t -57.12 -39.07 64.29 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.454 0 CA-C-N 115.275 -0.875 . . . . 28.440000000000001 109.886 172.773 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 261' ' ' GLU . . . . . . . . . . . . . 46.4 tp10 -64.01 -43.83 94.46 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 118.623 -1.231 . . . . 39.520000000000003 111.323 177.524 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 262' ' ' GLN . . . . . . . . . . . . . 86.1 mt-30 -59.06 -41.98 89.24 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-O 118.824 -0.608 . . . . 31.07 110.279 177.451 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 263' ' ' ALA . . . . . . . . . . . . . . . -63.24 -40.63 97.98 Favored 'General case' 0 C--O 1.238 0.448 0 N-CA-C 108.435 -0.95 . . . . 22.989999999999998 108.435 -179.742 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 264' ' ' HIS . . . . . . . . . . . . . 14.0 t60 -61.65 -41.71 97.9 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-O 122.169 0.985 . . . . 39.740000000000002 110.817 178.322 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 265' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -61.44 -42.73 99.21 Favored 'General case' 0 N--CA 1.433 -1.315 0 O-C-N 121.419 -0.801 . . . . 43.369999999999997 111.763 177.862 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 266' ' ' ILE . . . . . . . . . . . . . 51.1 mt -64.04 -45.98 95.12 Favored 'Isoleucine or valine' 0 C--O 1.247 0.949 0 N-CA-C 108.605 -0.887 . . . . 23.359999999999999 108.605 179.083 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 267' ' ' CYS . . . . . . . . . . . . . 62.6 m -59.22 -45.24 91.64 Favored 'General case' 0 C--O 1.257 1.495 0 O-C-N 125.053 1.471 . . . . 24.0 109.127 -179.098 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 268' ' ' GLU . . . . . . . . . . . . . 60.7 mt-10 -61.2 -40.07 92.59 Favored 'General case' 0 N--CA 1.503 2.183 0 O-C-N 121.82 -0.55 . . . . 50.539999999999999 110.402 -179.59 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 269' ' ' ALA . . . . . . . . . . . . . . . -65.49 -39.11 91.53 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 111.975 0.361 . . . . 25.440000000000001 111.975 177.454 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 270' ' ' VAL . . . . . . . . . . . . . 46.6 t -61.61 -49.68 83.37 Favored 'Isoleucine or valine' 0 C--O 1.243 0.752 0 N-CA-C 108.555 -0.906 . . . . 22.539999999999999 108.555 174.416 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 271' ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -54.3 -45.39 72.56 Favored 'General case' 0 C--O 1.265 1.917 0 C-N-CA 117.275 -1.77 . . . . 47.100000000000001 110.806 -179.796 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 272' ' ' ALA . . . . . . . . . . . . . . . -64.69 -41.92 95.7 Favored 'General case' 0 C--O 1.267 1.985 0 CA-C-N 118.11 0.414 . . . . 29.539999999999999 110.952 -176.777 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 273' ' ' ALA . . . . . . . . . . . . . . . -65.07 -49.93 68.15 Favored 'General case' 0 C--O 1.244 0.8 0 O-C-N 123.92 0.763 . . . . 28.510000000000002 109.672 -175.592 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 274' ' ' VAL . . . . . . . . . . . . . 62.7 t -68.03 -48.17 75.72 Favored 'Isoleucine or valine' 0 C--O 1.242 0.668 0 O-C-N 123.794 0.684 . . . . 25.800000000000001 109.524 -173.745 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 275' ' ' CYS . . . . . . . . . . . . . 84.0 m -63.84 -31.46 72.65 Favored 'General case' 0 C--O 1.241 0.624 0 O-C-N 123.497 0.498 . . . . 35.799999999999997 111.743 179.447 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 276' ' ' GLY . . . . . . . . . . . . . . . -72.92 -27.0 69.67 Favored Glycine 0 C--N 1.343 0.918 0 CA-C-N 117.945 0.338 . . . . 36.490000000000002 112.89 177.826 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 277' ' ' LYS . . . . . . . . . . . . . 77.2 mttt -96.66 -25.13 15.68 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 121.627 -0.926 . . . . 40.859999999999999 110.965 -174.357 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 278' ' ' ILE . . . . . . . . . . . . . 7.1 mt -123.72 98.17 5.25 Favored 'Isoleucine or valine' 0 C--O 1.247 0.968 0 N-CA-C 106.838 -1.542 . . . . 28.989999999999998 106.838 -173.017 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 279' ' ' ARG . . . . . 0.45 ' HD3' ' O ' ' A' ' 536' ' ' HOH . 0.0 OUTLIER -67.61 -28.62 67.9 Favored 'General case' 0 C--O 1.242 0.662 0 CA-C-N 114.381 -1.281 . . . . 56.490000000000002 111.388 -167.783 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 280' ' ' ARG . . . . . . . . . . . . . 19.5 ptp180 -77.54 -6.8 54.89 Favored 'General case' 0 N--CA 1.442 -0.875 0 N-CA-C 113.002 0.742 . . . . 29.870000000000001 113.002 -174.786 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 281' ' ' ILE . . . . . . . . . . . . . 97.0 mt -78.71 120.84 30.54 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 N-CA-C 108.167 -1.049 . . . . 25.68 108.167 179.544 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 282' ' ' GLU . . . . . . . . . . . . . 68.2 mm-40 -110.92 -7.17 14.59 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 119.806 -0.758 . . . . 37.350000000000001 111.061 179.721 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 283' ' ' SER . . . . . . . . . . . . . 41.1 t -151.11 125.72 9.58 Favored 'General case' 0 C--O 1.207 -1.143 0 O-C-N 121.073 -1.017 . . . . 32.299999999999997 109.677 173.719 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 284' ' ' LEU . . . . . . . . . . . . . 63.2 tp -141.72 117.06 10.14 Favored 'General case' 0 C--O 1.274 2.37 0 C-N-CA 121.182 -0.207 . . . . 30.27 110.59 179.43 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 285' ' ' HIS . . . . . 0.663 ' ND1' ' O ' ' A' ' 503' ' ' HOH . 61.9 m170 -105.68 128.41 53.64 Favored 'General case' 0 N--CA 1.453 -0.295 0 O-C-N 123.592 0.558 . . . . 36.689999999999998 109.718 174.618 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 286' ' ' VAL . . . . . . . . . . . . . 57.6 t -123.63 122.9 66.03 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.571 0 O-C-N 125.412 1.695 . . . . 26.0 108.603 -176.679 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 287' ' ' SER . . . . . . . . . . . . . 89.4 p -118.45 170.85 8.58 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 123.332 0.653 . . . . 34.969999999999999 109.465 173.572 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 288' ' ' ALA . . . . . . . . . . . . . . . -130.67 148.29 52.44 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-O 121.618 0.723 . . . . 27.600000000000001 110.011 -171.319 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 289' ' ' GLU . . . . . . . . . . . . . 63.6 mt-10 -136.07 148.16 48.18 Favored 'General case' 0 C--O 1.209 -1.037 0 N-CA-C 108.145 -1.057 . . . . 44.899999999999999 108.145 172.508 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 290' ' ' ALA . . . . . . . . . . . . . . . -59.27 134.89 57.41 Favored 'General case' 0 C--O 1.219 -0.55 0 N-CA-C 109.2 -0.667 . . . . 34.439999999999998 109.2 174.591 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 291' ' ' ARG . . . . . . . . . . . . . 34.1 ttt180 -145.31 137.44 25.7 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.34 1.025 . . . . 60.689999999999998 109.511 174.96 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 292' ' ' GLU . . . . . 0.581 ' H ' ' CD ' ' A' ' 292' ' ' GLU . 1.0 OUTLIER . . . . . 0 N--CA 1.445 -0.682 0 C-N-CA 127.873 2.469 . . . . 64.359999999999999 109.196 -158.982 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 401' ' ' ' CU' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 402' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 403' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 404' ' ' BME . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 405' ' ' ' NA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 501' ' ' HOH . . . . . 0.492 ' O ' ' OE2' ' A' ' 215' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 503' ' ' HOH . . . . . 0.663 ' O ' ' ND1' ' A' ' 285' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 507' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 508' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 509' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 511' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 512' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 513' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 514' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 515' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 516' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 517' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 518' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 519' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 520' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 521' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 522' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 523' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 524' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 525' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 526' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 527' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 528' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 529' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 530' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 531' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 532' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 533' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 534' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 535' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 536' ' ' HOH . . . . . 0.45 ' O ' ' HD3' ' A' ' 279' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 537' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 538' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 539' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 540' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 541' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 542' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 543' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 544' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 545' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 546' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 547' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_