data_1q4v_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 1q4v _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.546 2.008 0 CA-C-O 120.909 0.172 . . . . 26.850000000000001 112.94 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' IIL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 98.3 t -87.87 -33.51 6.66 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.275 0 CA-C-N 114.88 -1.055 . . . . 34.289999999999999 110.234 -178.76 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -81.22 -31.27 33.93 Favored 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 114.589 1.329 . . . . 51.280000000000001 114.589 176.994 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 39.7 mm-40 -78.31 -51.61 9.86 Favored 'General case' 0 CA--C 1.514 -0.419 0 C-N-CA 123.379 0.672 . . . . 51.299999999999997 110.102 177.884 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 96.5 m -99.2 -14.6 19.24 Favored 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 119.991 3.33 . . . . 26.649999999999999 119.991 -175.472 -65.258 -14.317 -88.817 106.203 2.019 104.134 170.719 -90.55 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 35.1 t -112.49 -41.26 3.9 Favored 'General case' 0 N--CA 1.455 -0.186 0 CA-C-N 119.941 1.246 . . . . 38.409999999999997 110.735 176.343 173.714 62.635 103.474 107.318 2.026 106.741 -90.026 -52.215 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 96.0 m -76.78 -36.43 57.01 Favored 'General case' 0 C--N 1.34 0.162 0 CA-C-N 119.533 1.061 . . . . 46.149999999999999 110.533 179.004 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 70.8 m -118.0 172.39 7.44 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 109.349 -0.611 . . . . 42.420000000000002 109.349 176.866 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 78.3 mt -93.63 115.93 33.61 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 CA-C-O 122.896 1.331 . . . . 39.119999999999997 109.887 178.076 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.7 m -80.96 -162.21 0.46 Allowed 'General case' 0 C--O 1.235 0.29 0 CA-C-N 113.202 -1.817 . . . . 40.380000000000003 113.244 177.511 -90.55 170.719 -88.817 104.134 2.019 106.203 -14.317 -65.258 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 88.1 p -144.08 -164.18 1.83 Allowed 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 114.749 -1.114 . . . . 35.729999999999997 108.607 174.795 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 52.6 tp -73.37 -49.79 25.35 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 122.94 0.496 . . . . 41.100000000000001 110.863 177.526 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -80.41 -11.67 59.66 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 117.339 2.348 . . . . 38.219999999999999 117.339 -176.336 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 61.5 mt-30 -80.19 -24.89 39.98 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 121.638 0.732 . . . . 42.460000000000001 109.927 170.489 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 15.8 tp -82.97 -33.21 26.72 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.709 1.604 . . . . 35.240000000000002 110.712 177.354 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -71.25 -16.24 62.48 Favored 'General case' 0 C--N 1.348 0.524 0 C-N-CA 123.653 0.781 . . . . 42.049999999999997 112.141 177.208 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -66.71 -26.32 66.95 Favored 'General case' 0 C--N 1.342 0.254 0 C-N-CA 124.854 1.262 . . . . 31.890000000000001 113.049 176.81 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 78.9 m-85 -94.37 15.51 17.43 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 114.393 1.257 . . . . 25.649999999999999 114.393 -179.818 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 75.8 m -85.94 -166.38 1.51 Allowed 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.315 0.578 . . . . 42.189999999999998 110.77 175.993 -58.839 -56.069 -84.443 105.511 2.025 105.783 -58.65 -63.482 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 80.0 m-20 . . . . . 0 CA--C 1.541 0.612 0 N-CA-C 108.978 -0.749 . . . . 33.390000000000001 108.978 176.713 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 15.4 t80 . . . . . 0 N--CA 1.449 -0.479 0 N-CA-C 110.572 -0.158 . . . . 32.509999999999998 110.572 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 1.6 m -64.88 142.63 16.67 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.244 0 CA-C-O 123.874 1.797 . . . . 31.010000000000002 114.978 179.435 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 52.5 t-20 -122.06 85.37 2.4 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 101.751 -3.426 . . . . 53.640000000000001 101.751 177.694 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -169.63 174.61 5.74 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-O 123.818 1.771 . . . . 50.719999999999999 114.521 -178.597 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -89.9 107.58 19.19 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 111.799 -2.455 . . . . 48.310000000000002 108.336 174.765 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 32.5 mt -88.24 112.92 23.32 Favored 'General case' 0 CA--C 1.518 -0.253 0 C-N-CA 123.213 0.605 . . . . 36.079999999999998 109.647 -179.978 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 38.8 m -132.3 138.92 48.0 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 114.723 1.379 . . . . 34.57 114.723 -176.647 -52.215 -90.026 103.474 106.741 2.026 107.318 62.635 173.714 1 1 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 80.07 -136.11 16.28 Favored Glycine 0 C--N 1.342 0.878 0 CA-C-N 114.432 -1.258 . . . . 23.41 113.551 178.25 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 34.3 p -66.75 -16.41 64.23 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 114.271 1.211 . . . . 10.73 114.271 176.533 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 54.7 m-70 -69.25 -43.99 72.84 Favored 'General case' 0 CA--C 1.508 -0.636 0 C-N-CA 126.279 1.832 . . . . 14.609999999999999 110.878 174.893 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 43.0 tp -63.6 -35.87 81.94 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 111.042 -2.799 . . . . 35.649999999999999 111.915 175.382 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 60.1 t -79.84 -34.07 15.21 Favored 'Isoleucine or valine' 0 C--O 1.235 0.296 0 CA-C-N 118.831 0.741 . . . . 22.359999999999999 110.435 178.378 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -66.93 -40.43 87.59 Favored 'General case' 0 C--N 1.34 0.177 0 N-CA-C 114.088 1.144 . . . . 31.050000000000001 114.088 175.378 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.62 -46.42 90.33 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 123.762 0.825 . . . . 13.460000000000001 109.365 175.642 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 63.6 mt -63.81 -25.57 68.23 Favored 'General case' 0 C--N 1.343 0.289 0 C-N-CA 124.467 1.107 . . . . 29.710000000000001 113.311 175.297 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 65.5 t80 -75.86 -43.72 44.27 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 112.914 0.709 . . . . 18.93 112.914 176.886 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 40.3 tp -70.63 -47.9 57.71 Favored 'General case' 0 C--N 1.343 0.296 0 N-CA-C 114.126 1.158 . . . . 31.07 114.126 179.625 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 61.4 t -68.3 -35.66 71.91 Favored 'Isoleucine or valine' 0 C--O 1.234 0.251 0 N-CA-C 116.168 1.914 . . . . 21.510000000000002 116.168 -175.961 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 75.1 m -84.57 -44.25 13.71 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-N 118.73 0.695 . . . . 31.829999999999998 112.16 178.733 -63.482 -58.65 -84.443 105.783 2.025 105.511 -56.069 -58.839 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 67.36 -115.18 6.87 Favored Glycine 0 CA--C 1.526 0.758 0 N-CA-C 115.211 0.845 . . . . 36.630000000000003 115.211 178.328 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -66.95 -23.51 65.97 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 114.95 1.463 . . . . 38.32 114.95 -177.496 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -73.63 -40.69 63.58 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 122.667 0.387 . . . . 43.119999999999997 110.628 177.37 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 87.58 -167.98 37.6 Favored Glycine 0 C--N 1.341 0.822 0 N-CA-C 110.253 -1.139 . . . . 31.93 110.253 -176.528 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 52.8 p90 -155.44 169.11 25.01 Favored 'General case' 0 CA--C 1.513 -0.444 0 CA-C-O 122.269 1.033 . . . . 24.09 112.833 -178.134 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 37.3 p90 -116.48 120.74 39.72 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 114.055 -1.43 . . . . 33.200000000000003 107.26 170.625 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 61.6 t80 -105.88 114.3 28.37 Favored 'General case' 0 N--CA 1.441 -0.899 0 N-CA-C 106.311 -1.736 . . . . 43.079999999999998 106.311 174.968 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 21.1 p -127.87 99.25 26.11 Favored Pre-proline 0 N--CA 1.446 -0.671 0 CA-C-N 111.815 -2.448 . . . . 37.869999999999997 109.278 179.672 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 6.8 Cg_endo -78.32 15.86 1.31 Allowed 'Trans proline' 0 N--CA 1.461 -0.399 0 C-N-CA 125.041 3.827 . . . . 28.859999999999999 119.323 -170.676 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.37 138.86 58.26 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 124.079 1.895 . . . . 47.479999999999997 114.905 -179.065 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 92.4 m . . . . . 0 N--CA 1.45 -0.462 0 CA-C-N 109.814 -3.357 . . . . 52.270000000000003 112.906 -177.326 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.432 -1.58 0 N-CA-C 104.052 -3.619 . . . . 50.299999999999997 104.052 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 2' ' ' IIL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 3' ' ' VAL . . . . . . . . . . . . . 6.5 t -63.16 -33.56 61.65 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.273 0 CA-C-N 114.18 -1.373 . . . . 36.789999999999999 110.332 179.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -116.41 -12.32 11.08 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 115.723 1.749 . . . . 47.090000000000003 115.723 177.785 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 5' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -85.5 -25.81 26.63 Favored 'General case' 0 C--N 1.346 0.415 0 CA-C-N 119.691 1.132 . . . . 40.899999999999999 109.395 174.631 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 6' ' ' CYS . . . . . . . . . . . . . 83.7 m -104.42 0.62 29.19 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 114.996 1.48 . . . . 35.649999999999999 114.996 178.742 -59.327 -50.176 -89.682 104.882 2.012 103.121 146.396 -68.367 1 1 . 1 . 001 ecloud orig full ' C' C ' 7' ' ' CYS . . . . . . . . . . . . . 62.8 m -106.98 -24.59 11.95 Favored 'General case' 0 C--N 1.343 0.29 0 N-CA-C 116.776 2.139 . . . . 43.549999999999997 116.776 177.104 -73.538 -69.332 -98.977 102.413 2.022 105.981 -129.962 -179.914 1 1 . 1 . 001 ecloud orig full ' C' C ' 8' ' ' THR . . . . . . . . . . . . . 10.1 p -81.05 -57.07 3.69 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 121.029 1.74 . . . . 56.740000000000002 108.452 174.681 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 9' ' ' SER . . . . . . . . . . . . . 67.9 p -102.56 170.05 8.28 Favored 'General case' 0 C--O 1.232 0.153 0 N-CA-C 105.312 -2.107 . . . . 55.799999999999997 105.312 170.374 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 10' ' ' ILE . . . . . . . . . . . . . 1.1 pt -107.79 160.29 6.98 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.456 0 O-C-N 118.521 -2.612 . . . . 52.149999999999999 113.972 -179.137 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 11' ' ' CYS . . . . . . . . . . . . . 91.4 m -105.78 138.78 41.4 Favored 'General case' 0 N--CA 1.443 -0.776 0 CA-C-N 113.681 -1.599 . . . . 37.359999999999999 113.422 178.26 -68.367 146.396 -89.682 103.121 2.012 104.882 -50.176 -59.327 1 1 . 1 . 001 ecloud orig full ' C' C ' 12' ' ' SER . . . . . . . . . . . . . 66.8 p -77.21 177.65 7.7 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 114.255 -1.339 . . . . 31.030000000000001 110.345 175.737 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 13' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.94 -34.02 69.43 Favored 'General case' 0 C--N 1.343 0.313 0 O-C-N 121.066 -1.021 . . . . 29.670000000000002 111.53 175.694 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 14' ' ' TYR . . . . . . . . . . . . . 50.4 m-85 -71.1 -43.3 67.96 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 126.257 1.823 . . . . 38.68 115.266 -178.246 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 15' ' ' GLN . . . . . . . . . . . . . 68.3 mt-30 -69.02 -35.76 77.01 Favored 'General case' 0 C--O 1.232 0.155 0 O-C-N 121.664 -0.647 . . . . 34.460000000000001 111.371 174.467 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 16' ' ' LEU . . . . . . . . . . . . . 70.3 mt -71.05 -24.15 62.29 Favored 'General case' 0 C--N 1.344 0.352 0 N-CA-C 113.626 0.972 . . . . 22.52 113.626 176.533 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 17' ' ' GLU . . . . . . . . . . . . . 59.8 tt0 -68.37 -21.67 64.7 Favored 'General case' 0 C--N 1.342 0.265 0 C-N-CA 125.753 1.621 . . . . 37.060000000000002 113.65 -179.324 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 18' ' ' ASN . . . . . . . . . . . . . 63.8 m-20 -71.32 -19.73 62.27 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 123.753 0.821 . . . . 32.759999999999998 112.663 177.871 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 19' ' ' TYR . . . . . . . . . . . . . 91.3 m-85 -102.09 20.43 16.65 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 114.443 1.275 . . . . 48.210000000000001 114.443 -178.91 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 20' ' ' CYS . . . . . . . . . . . . . 71.8 m -101.77 150.16 23.43 Favored 'General case' 0 C--N 1.34 0.183 0 O-C-N 121.565 -0.709 . . . . 28.41 109.322 175.52 -62.184 -62.697 -78.399 105.568 2.026 104.646 -45.269 -55.096 1 1 . 1 . 001 ecloud orig full ' C' C ' 21' ' ' ASN . . . . . . . . . . . . . 8.8 m120 . . . . . 0 CA--C 1.531 0.232 0 CA-C-O 116.563 -1.684 . . . . 31.27 113.926 -176.597 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 1' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.451 -0.375 0 N-CA-C 112.64 0.608 . . . . 43.890000000000001 112.64 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 2' ' ' VAL . . . . . . . . . . . . . 21.8 t -75.36 100.18 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.341 0.236 0 N-CA-C 103.496 -2.779 . . . . 39.579999999999998 103.496 175.933 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 3' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -57.27 93.86 0.01 OUTLIER 'General case' 0 C--N 1.343 0.286 0 CA-C-O 122.855 1.312 . . . . 31.239999999999998 113.496 -174.4 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 4' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -69.7 -22.73 63.39 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 112.359 -2.2 . . . . 43.039999999999999 116.643 -176.023 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 5' ' ' HIS . . . . . . . . . . . . . 13.8 t60 -74.01 -43.44 58.0 Favored 'General case' 0 C--N 1.344 0.343 0 N-CA-C 108.603 -0.888 . . . . 30.629999999999999 108.603 176.357 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 6' ' ' LEU . . . . . . . . . . . . . 45.0 mt -72.75 -32.38 65.62 Favored 'General case' 0 C--N 1.342 0.273 0 C-N-CA 122.865 0.466 . . . . 21.620000000000001 111.707 176.77 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 7' ' ' CYS . . . . . . . . . . . . . 52.5 t -72.07 -35.01 69.16 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 109.899 -0.408 . . . . 34.310000000000002 109.899 174.667 -179.914 -129.962 -98.977 105.981 2.022 102.413 -69.332 -73.538 1 1 . 1 . 001 ecloud orig full ' D' D ' 8' ' ' GLY . . . . . . . . . . . . . . . -64.45 -37.55 94.6 Favored Glycine 0 C--N 1.34 0.786 0 C-N-CA 125.024 1.297 . . . . 19.399999999999999 113.424 179.219 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 9' ' ' SER . . . . . . . . . . . . . 49.5 m -56.57 -48.5 77.21 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 123.467 0.707 . . . . 19.949999999999999 109.672 175.033 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 10' ' ' HIS . . . . . . . . . . . . . 90.8 m-70 -71.41 -35.48 71.0 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-O 117.131 -1.414 . . . . 24.600000000000001 112.898 179.237 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 11' ' ' LEU . . . . . . . . . . . . . 68.5 mt -57.2 -50.02 74.16 Favored 'General case' 0 C--N 1.346 0.429 0 N-CA-C 114.668 1.359 . . . . 22.899999999999999 114.668 174.545 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 12' ' ' VAL . . . . . . . . . . . . . 30.4 m -71.5 -23.79 23.05 Favored 'Isoleucine or valine' 0 C--N 1.345 0.374 0 N-CA-C 114.456 1.28 . . . . 19.719999999999999 114.456 179.669 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -73.0 -35.33 66.81 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 109.137 -0.69 . . . . 16.039999999999999 109.137 172.282 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 14' ' ' ALA . . . . . . . . . . . . . . . -71.77 -43.02 66.46 Favored 'General case' 0 CA--C 1.53 0.174 0 O-C-N 121.358 -0.839 . . . . 20.079999999999998 111.862 175.166 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 15' ' ' LEU . . . . . . . . . . . . . 15.1 mt -60.81 -21.09 62.78 Favored 'General case' 0 C--N 1.344 0.341 0 C-N-CA 124.568 1.147 . . . . 26.399999999999999 113.498 175.803 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 16' ' ' TYR . . . . . . . . . . . . . 75.8 t80 -74.05 -46.22 44.6 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 123.253 0.621 . . . . 23.780000000000001 110.613 174.238 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 17' ' ' LEU . . . . . . . . . . . . . 80.9 mt -68.02 -40.5 82.92 Favored 'General case' 0 C--N 1.344 0.342 0 N-CA-C 112.397 0.517 . . . . 21.329999999999998 112.397 179.042 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 18' ' ' VAL . . . . . . . . . . . . . 58.9 t -73.11 -53.56 18.12 Favored 'Isoleucine or valine' 0 C--N 1.34 0.17 0 N-CA-C 113.742 1.016 . . . . 23.870000000000001 113.742 -178.155 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 19' ' ' CYS . . . . . . . . . . . . . 59.1 m -72.57 -30.42 64.38 Favored 'General case' 0 C--O 1.232 0.184 0 N-CA-C 115.005 1.483 . . . . 26.859999999999999 115.005 -178.193 -55.096 -45.269 -78.399 104.646 2.026 105.568 -62.697 -62.184 1 1 . 1 . 001 ecloud orig full ' D' D ' 20' ' ' GLY . . . . . . . . . . . . . . . 57.02 -111.3 2.71 Favored Glycine 0 C--N 1.342 0.881 0 C-N-CA 123.969 0.795 . . . . 39.100000000000001 113.153 179.301 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 21' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -85.72 -20.48 29.27 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 113.13 0.789 . . . . 42.890000000000001 113.13 178.208 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 22' ' ' ARG . . . . . . . . . . . . . 86.9 mtm180 -63.36 -29.38 70.7 Favored 'General case' 0 C--N 1.343 0.319 0 N-CA-C 112.797 0.665 . . . . 38.039999999999999 112.797 179.091 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.86 176.97 38.38 Favored Glycine 0 C--N 1.337 0.611 0 CA-C-O 122.141 0.856 . . . . 35.75 114.072 177.603 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 24' ' ' PHE . . . . . . . . . . . . . 34.7 p90 -156.33 166.84 32.26 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 114.194 -1.003 . . . . 29.57 112.128 179.232 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 25' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 -121.16 133.96 55.21 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 113.702 -1.59 . . . . 46.840000000000003 107.916 175.271 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 26' ' ' TYR . . . . . . . . . . . . . 65.9 t80 -106.57 130.72 54.29 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 121.703 0.763 . . . . 34.170000000000002 111.423 178.613 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 27' ' ' THR . . . . . . . . . . . . . 38.9 p -135.65 121.94 14.2 Favored Pre-proline 0 CA--C 1.538 0.488 0 C-N-CA 124.888 1.275 . . . . 43.43 112.756 -179.848 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 28' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -120.37 26.44 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 124.911 3.741 . . . . 45.960000000000001 117.52 165.8 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 29' ' ' LYS . . . . . . . . . . . . . 59.3 pttt -67.67 174.65 3.38 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 120.675 3.583 . . . . 56.0 120.675 -174.825 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 30' ' ' THR . . . . . . . . . . . . . 31.0 m . . . . . 0 CA--C 1.538 0.489 0 O-C-N 125.142 1.527 . . . . 45.200000000000003 108.976 177.27 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 200' ' ' IPH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.546 2.008 0 CA-C-O 120.909 0.172 . . . . 26.85 112.94 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' IIL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 98.3 t -87.87 -33.51 6.66 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.275 0 CA-C-N 114.88 -1.055 . . . . 34.29 110.234 -178.76 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -81.22 -31.27 33.93 Favored 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 114.589 1.329 . . . . 51.28 114.589 176.994 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 39.7 mm-40 -78.31 -51.61 9.86 Favored 'General case' 0 CA--C 1.514 -0.419 0 C-N-CA 123.379 0.672 . . . . 51.3 110.102 177.884 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 96.5 m -99.2 -14.6 19.24 Favored 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 119.991 3.33 . . . . 26.65 119.991 -175.472 -65.258 -14.317 -88.817 106.203 2.019 104.134 170.719 -90.55 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 35.1 t -112.49 -41.26 3.9 Favored 'General case' 0 N--CA 1.455 -0.186 0 CA-C-N 119.941 1.246 . . . . 38.41 110.735 176.343 173.714 62.635 103.474 107.318 2.026 106.741 -90.026 -52.215 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 96.0 m -76.78 -36.43 57.01 Favored 'General case' 0 C--N 1.34 0.162 0 CA-C-N 119.533 1.061 . . . . 46.15 110.533 179.004 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 70.8 m -118.0 172.39 7.44 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 109.349 -0.611 . . . . 42.42 109.349 176.866 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 78.3 mt -93.63 115.93 33.61 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 CA-C-O 122.896 1.331 . . . . 39.12 109.887 178.076 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.7 m -80.96 -162.21 0.46 Allowed 'General case' 0 C--O 1.235 0.29 0 CA-C-N 113.202 -1.817 . . . . 40.38 113.244 177.511 -90.55 170.719 -88.817 104.134 2.019 106.203 -14.317 -65.258 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 88.1 p -144.08 -164.18 1.83 Allowed 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 114.749 -1.114 . . . . 35.73 108.607 174.795 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 52.6 tp -73.37 -49.79 25.35 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 122.94 0.496 . . . . 41.1 110.863 177.526 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -80.41 -11.67 59.66 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 117.339 2.348 . . . . 38.22 117.339 -176.336 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 61.5 mt-30 -80.19 -24.89 39.98 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 121.638 0.732 . . . . 42.46 109.927 170.489 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 15.8 tp -82.97 -33.21 26.72 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.709 1.604 . . . . 35.24 110.712 177.354 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -71.25 -16.24 62.48 Favored 'General case' 0 C--N 1.348 0.524 0 C-N-CA 123.653 0.781 . . . . 42.05 112.141 177.208 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -66.71 -26.32 66.95 Favored 'General case' 0 C--N 1.342 0.254 0 C-N-CA 124.854 1.262 . . . . 31.89 113.049 176.81 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 78.9 m-85 -94.37 15.51 17.43 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 114.393 1.257 . . . . 25.65 114.393 -179.818 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 75.8 m -85.94 -166.38 1.51 Allowed 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.315 0.578 . . . . 42.19 110.77 175.993 -58.839 -56.069 -84.443 105.511 2.025 105.783 -58.65 -63.482 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 80.0 m-20 . . . . . 0 CA--C 1.541 0.612 0 N-CA-C 108.978 -0.749 . . . . 33.39 108.978 176.713 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 15.4 t80 . . . . . 0 N--CA 1.449 -0.479 0 N-CA-C 110.572 -0.158 . . . . 32.51 110.572 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 2' ' ' VAL . . . . . 0.42 ' HB ' ' HG2' ' B' ' 4' ' ' GLN . 1.6 m -64.88 142.63 16.67 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.244 0 CA-C-O 123.874 1.797 . . . . 31.01 114.978 179.435 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 52.5 t-20 -122.06 85.37 2.4 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 101.751 -3.426 . . . . 53.64 101.751 177.694 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 4' ' ' GLN . . . . . 0.42 ' HG2' ' HB ' ' B' ' 2' ' ' VAL . 7.2 pt20 -169.63 174.61 5.74 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-O 123.818 1.771 . . . . 50.72 114.521 -178.597 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -89.9 107.58 19.19 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 111.799 -2.455 . . . . 48.31 108.336 174.765 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 32.5 mt -88.24 112.92 23.32 Favored 'General case' 0 CA--C 1.518 -0.253 0 C-N-CA 123.213 0.605 . . . . 36.08 109.647 -179.978 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 38.8 m -132.3 138.92 48.0 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 114.723 1.379 . . . . 34.57 114.723 -176.647 -52.215 -90.026 103.474 106.741 2.026 107.318 62.635 173.714 1 1 . 1 . 001 ecloud build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 80.07 -136.11 16.28 Favored Glycine 0 C--N 1.342 0.878 0 CA-C-N 114.432 -1.258 . . . . 23.41 113.551 178.25 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 34.3 p -66.75 -16.41 64.23 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 114.271 1.211 . . . . 10.73 114.271 176.533 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 54.7 m-70 -69.25 -43.99 72.84 Favored 'General case' 0 CA--C 1.508 -0.636 0 C-N-CA 126.279 1.832 . . . . 14.61 110.878 174.893 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 43.0 tp -63.6 -35.87 81.94 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 111.042 -2.799 . . . . 35.65 111.915 175.382 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 60.1 t -79.84 -34.07 15.21 Favored 'Isoleucine or valine' 0 C--O 1.235 0.296 0 CA-C-N 118.831 0.741 . . . . 22.36 110.435 178.378 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -66.93 -40.43 87.59 Favored 'General case' 0 C--N 1.34 0.177 0 N-CA-C 114.088 1.144 . . . . 31.05 114.088 175.378 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.62 -46.42 90.33 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 123.762 0.825 . . . . 13.46 109.365 175.642 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 63.6 mt -63.81 -25.57 68.23 Favored 'General case' 0 C--N 1.343 0.289 0 C-N-CA 124.467 1.107 . . . . 29.71 113.311 175.297 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 65.5 t80 -75.86 -43.72 44.27 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 112.914 0.709 . . . . 18.93 112.914 176.886 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 40.3 tp -70.63 -47.9 57.71 Favored 'General case' 0 C--N 1.343 0.296 0 N-CA-C 114.126 1.158 . . . . 31.07 114.126 179.625 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 61.4 t -68.3 -35.66 71.91 Favored 'Isoleucine or valine' 0 C--O 1.234 0.251 0 N-CA-C 116.168 1.914 . . . . 21.51 116.168 -175.961 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 75.1 m -84.57 -44.25 13.71 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-N 118.73 0.695 . . . . 31.83 112.16 178.733 -63.482 -58.65 -84.443 105.783 2.025 105.511 -56.069 -58.839 1 1 . 1 . 001 ecloud build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 67.36 -115.18 6.87 Favored Glycine 0 CA--C 1.526 0.758 0 N-CA-C 115.211 0.845 . . . . 36.63 115.211 178.328 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -66.95 -23.51 65.97 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 114.95 1.463 . . . . 38.32 114.95 -177.496 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -73.63 -40.69 63.58 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 122.667 0.387 . . . . 43.12 110.628 177.37 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 87.58 -167.98 37.6 Favored Glycine 0 C--N 1.341 0.822 0 N-CA-C 110.253 -1.139 . . . . 31.93 110.253 -176.528 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 52.8 p90 -155.44 169.11 25.01 Favored 'General case' 0 CA--C 1.513 -0.444 0 CA-C-O 122.269 1.033 . . . . 24.09 112.833 -178.134 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 37.3 p90 -116.48 120.74 39.72 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 114.055 -1.43 . . . . 33.2 107.26 170.625 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 61.6 t80 -105.88 114.3 28.37 Favored 'General case' 0 N--CA 1.441 -0.899 0 N-CA-C 106.311 -1.736 . . . . 43.08 106.311 174.968 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 21.1 p -127.87 99.25 26.11 Favored Pre-proline 0 N--CA 1.446 -0.671 0 CA-C-N 111.815 -2.448 . . . . 37.87 109.278 179.672 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 6.8 Cg_endo -78.32 15.86 1.31 Allowed 'Trans proline' 0 N--CA 1.461 -0.399 0 C-N-CA 125.041 3.827 . . . . 28.86 119.323 -170.676 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.37 138.86 58.26 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 124.079 1.895 . . . . 47.48 114.905 -179.065 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 92.4 m . . . . . 0 N--CA 1.45 -0.462 0 CA-C-N 109.814 -3.357 . . . . 52.27 112.906 -177.326 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.432 -1.58 0 N-CA-C 104.052 -3.619 . . . . 50.3 104.052 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 2' ' ' IIL . . . . . 0.478 HG22 ' SG ' ' C' ' 6' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 3' ' ' VAL . . . . . . . . . . . . . 6.5 t -63.16 -33.56 61.65 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.273 0 CA-C-N 114.18 -1.373 . . . . 36.79 110.332 179.921 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -116.41 -12.32 11.08 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 115.723 1.749 . . . . 47.09 115.723 177.785 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 5' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -85.5 -25.81 26.63 Favored 'General case' 0 C--N 1.346 0.415 0 CA-C-N 119.691 1.132 . . . . 40.9 109.395 174.631 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 6' ' ' CYS . . . . . 0.478 ' SG ' HG22 ' C' ' 2' ' ' IIL . 83.7 m -104.42 0.62 29.19 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 114.996 1.48 . . . . 35.65 114.996 178.742 -59.327 -50.176 -89.682 104.882 2.012 103.121 146.396 -68.367 2 2 . 1 . 001 ecloud build full ' C' C ' 7' ' ' CYS . . . . . 0.483 ' SG ' HD11 ' D' ' 11' ' ' LEU . 62.8 m -106.98 -24.59 11.95 Favored 'General case' 0 C--N 1.343 0.29 0 N-CA-C 116.776 2.139 . . . . 43.55 116.776 177.104 -73.538 -69.332 -98.977 102.413 2.022 105.981 -129.962 -179.914 2 2 . 1 . 001 ecloud build full ' C' C ' 8' ' ' THR . . . . . . . . . . . . . 10.1 p -81.05 -57.07 3.69 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 121.029 1.74 . . . . 56.74 108.452 174.681 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 9' ' ' SER . . . . . . . . . . . . . 67.9 p -102.56 170.05 8.28 Favored 'General case' 0 C--O 1.232 0.153 0 N-CA-C 105.312 -2.107 . . . . 55.8 105.312 170.374 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 10' ' ' ILE . . . . . . . . . . . . . 1.1 pt -107.79 160.29 6.98 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.456 0 O-C-N 118.521 -2.612 . . . . 52.15 113.972 -179.137 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 11' ' ' CYS . . . . . 0.407 ' O ' ' H6 ' ' C' ' 200' ' ' IPH . 91.4 m -105.78 138.78 41.4 Favored 'General case' 0 N--CA 1.443 -0.776 0 CA-C-N 113.681 -1.599 . . . . 37.36 113.422 178.26 -68.367 146.396 -89.682 103.121 2.012 104.882 -50.176 -59.327 2 2 . 1 . 001 ecloud build full ' C' C ' 12' ' ' SER . . . . . . . . . . . . . 66.8 p -77.21 177.65 7.7 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 114.255 -1.339 . . . . 31.03 110.345 175.737 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 13' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.94 -34.02 69.43 Favored 'General case' 0 C--N 1.343 0.313 0 O-C-N 121.066 -1.021 . . . . 29.67 111.53 175.694 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 14' ' ' TYR . . . . . . . . . . . . . 50.4 m-85 -71.1 -43.3 67.96 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 126.257 1.823 . . . . 38.68 115.266 -178.246 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 15' ' ' GLN . . . . . . . . . . . . . 68.3 mt-30 -69.02 -35.76 77.01 Favored 'General case' 0 C--O 1.232 0.155 0 O-C-N 121.664 -0.647 . . . . 34.46 111.371 174.467 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 16' ' ' LEU . . . . . . . . . . . . . 70.3 mt -71.05 -24.15 62.29 Favored 'General case' 0 C--N 1.344 0.352 0 N-CA-C 113.626 0.972 . . . . 22.52 113.626 176.533 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 17' ' ' GLU . . . . . . . . . . . . . 59.8 tt0 -68.37 -21.67 64.7 Favored 'General case' 0 C--N 1.342 0.265 0 C-N-CA 125.753 1.621 . . . . 37.06 113.65 -179.324 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 18' ' ' ASN . . . . . . . . . . . . . 63.8 m-20 -71.32 -19.73 62.27 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 123.753 0.821 . . . . 32.76 112.663 177.871 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 19' ' ' TYR . . . . . . . . . . . . . 91.3 m-85 -102.09 20.43 16.65 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 114.443 1.275 . . . . 48.21 114.443 -178.91 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 20' ' ' CYS . . . . . . . . . . . . . 71.8 m -101.77 150.16 23.43 Favored 'General case' 0 C--N 1.34 0.183 0 O-C-N 121.565 -0.709 . . . . 28.41 109.322 175.52 -62.184 -62.697 -78.399 105.568 2.026 104.646 -45.269 -55.096 1 1 . 1 . 001 ecloud build full ' C' C ' 21' ' ' ASN . . . . . . . . . . . . . 8.8 m120 . . . . . 0 CA--C 1.531 0.232 0 CA-C-O 116.563 -1.684 . . . . 31.27 113.926 -176.597 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 1' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.451 -0.375 0 N-CA-C 112.64 0.608 . . . . 43.89 112.64 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 2' ' ' VAL . . . . . . . . . . . . . 21.8 t -75.36 100.18 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.341 0.236 0 N-CA-C 103.496 -2.779 . . . . 39.58 103.496 175.933 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 3' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -57.27 93.86 0.01 OUTLIER 'General case' 0 C--N 1.343 0.286 0 CA-C-O 122.855 1.312 . . . . 31.24 113.496 -174.4 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 4' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -69.7 -22.73 63.39 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 112.359 -2.2 . . . . 43.04 116.643 -176.023 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 5' ' ' HIS . . . . . . . . . . . . . 13.8 t60 -74.01 -43.44 58.0 Favored 'General case' 0 C--N 1.344 0.343 0 N-CA-C 108.603 -0.888 . . . . 30.63 108.603 176.357 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 6' ' ' LEU . . . . . . . . . . . . . 45.0 mt -72.75 -32.38 65.62 Favored 'General case' 0 C--N 1.342 0.273 0 C-N-CA 122.865 0.466 . . . . 21.62 111.707 176.77 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 7' ' ' CYS . . . . . . . . . . . . . 52.5 t -72.07 -35.01 69.16 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 109.899 -0.408 . . . . 34.31 109.899 174.667 -179.914 -129.962 -98.977 105.981 2.022 102.413 -69.332 -73.538 1 1 . 1 . 001 ecloud build full ' D' D ' 8' ' ' GLY . . . . . 0.45 ' HA2' HD12 ' D' ' 11' ' ' LEU . . . -64.45 -37.55 94.6 Favored Glycine 0 C--N 1.34 0.786 0 C-N-CA 125.024 1.297 . . . . 19.4 113.424 179.219 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 9' ' ' SER . . . . . . . . . . . . . 49.5 m -56.57 -48.5 77.21 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 123.467 0.707 . . . . 19.95 109.672 175.033 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 10' ' ' HIS . . . . . . . . . . . . . 90.8 m-70 -71.41 -35.48 71.0 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-O 117.131 -1.414 . . . . 24.6 112.898 179.237 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 11' ' ' LEU . . . . . 0.483 HD11 ' SG ' ' C' ' 7' ' ' CYS . 68.5 mt -57.2 -50.02 74.16 Favored 'General case' 0 C--N 1.346 0.429 0 N-CA-C 114.668 1.359 . . . . 22.9 114.668 174.545 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 12' ' ' VAL . . . . . . . . . . . . . 30.4 m -71.5 -23.79 23.05 Favored 'Isoleucine or valine' 0 C--N 1.345 0.374 0 N-CA-C 114.456 1.28 . . . . 19.72 114.456 179.669 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -73.0 -35.33 66.81 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 109.137 -0.69 . . . . 16.04 109.137 172.282 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 14' ' ' ALA . . . . . . . . . . . . . . . -71.77 -43.02 66.46 Favored 'General case' 0 CA--C 1.53 0.174 0 O-C-N 121.358 -0.839 . . . . 20.08 111.862 175.166 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 15' ' ' LEU . . . . . . . . . . . . . 15.1 mt -60.81 -21.09 62.78 Favored 'General case' 0 C--N 1.344 0.341 0 C-N-CA 124.568 1.147 . . . . 26.4 113.498 175.803 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 16' ' ' TYR . . . . . . . . . . . . . 75.8 t80 -74.05 -46.22 44.6 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 123.253 0.621 . . . . 23.78 110.613 174.238 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 17' ' ' LEU . . . . . . . . . . . . . 80.9 mt -68.02 -40.5 82.92 Favored 'General case' 0 C--N 1.344 0.342 0 N-CA-C 112.397 0.517 . . . . 21.33 112.397 179.042 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 18' ' ' VAL . . . . . . . . . . . . . 58.9 t -73.11 -53.56 18.12 Favored 'Isoleucine or valine' 0 C--N 1.34 0.17 0 N-CA-C 113.742 1.016 . . . . 23.87 113.742 -178.155 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 19' ' ' CYS . . . . . . . . . . . . . 59.1 m -72.57 -30.42 64.38 Favored 'General case' 0 C--O 1.232 0.184 0 N-CA-C 115.005 1.483 . . . . 26.86 115.005 -178.193 -55.096 -45.269 -78.399 104.646 2.026 105.568 -62.697 -62.184 1 1 . 1 . 001 ecloud build full ' D' D ' 20' ' ' GLY . . . . . . . . . . . . . . . 57.02 -111.3 2.71 Favored Glycine 0 C--N 1.342 0.881 0 C-N-CA 123.969 0.795 . . . . 39.1 113.153 179.301 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 21' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -85.72 -20.48 29.27 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 113.13 0.789 . . . . 42.89 113.13 178.208 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 22' ' ' ARG . . . . . . . . . . . . . 86.9 mtm180 -63.36 -29.38 70.7 Favored 'General case' 0 C--N 1.343 0.319 0 N-CA-C 112.797 0.665 . . . . 38.04 112.797 179.091 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.86 176.97 38.38 Favored Glycine 0 C--N 1.337 0.611 0 CA-C-O 122.141 0.856 . . . . 35.75 114.072 177.603 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 24' ' ' PHE . . . . . . . . . . . . . 34.7 p90 -156.33 166.84 32.26 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 114.194 -1.003 . . . . 29.57 112.128 179.232 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 25' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 -121.16 133.96 55.21 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 113.702 -1.59 . . . . 46.84 107.916 175.271 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 26' ' ' TYR . . . . . 0.612 ' CE2' ' HG3' ' D' ' 28' ' ' PRO . 65.9 t80 -106.57 130.72 54.29 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 121.703 0.763 . . . . 34.17 111.423 178.613 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 27' ' ' THR . . . . . . . . . . . . . 38.9 p -135.65 121.94 14.2 Favored Pre-proline 0 CA--C 1.538 0.488 0 C-N-CA 124.888 1.275 . . . . 43.43 112.756 -179.848 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 28' ' ' PRO . . . . . 0.612 ' HG3' ' CE2' ' D' ' 26' ' ' TYR . 18.3 Cg_endo -120.37 26.44 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 124.911 3.741 . . . . 45.96 117.52 165.8 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 29' ' ' LYS . . . . . . . . . . . . . 59.3 pttt -67.67 174.65 3.38 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 120.675 3.583 . . . . 56.0 120.675 -174.825 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 30' ' ' THR . . . . . . . . . . . . . 31.0 m . . . . . 0 CA--C 1.538 0.489 0 O-C-N 125.142 1.527 . . . . 45.2 108.976 177.27 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 200' ' ' IPH . . . . . 0.407 ' H6 ' ' O ' ' C' ' 11' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 22' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 23' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 24' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 25' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 26' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 27' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 28' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 29' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 30' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 31' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 32' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 33' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 34' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 35' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 36' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 37' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 38' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 39' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 40' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.546 2.008 0 CA-C-O 120.909 0.172 . . . . 26.85 112.94 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' IIL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 98.3 t -87.87 -33.51 6.66 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.275 0 CA-C-N 114.88 -1.055 . . . . 34.29 110.234 -178.76 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -81.22 -31.27 33.93 Favored 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 114.589 1.329 . . . . 51.28 114.589 176.994 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 39.7 mm-40 -78.31 -51.61 9.86 Favored 'General case' 0 CA--C 1.514 -0.419 0 C-N-CA 123.379 0.672 . . . . 51.3 110.102 177.884 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 96.5 m -99.2 -14.6 19.24 Favored 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 119.991 3.33 . . . . 26.65 119.991 -175.472 -65.258 -14.317 -88.817 106.203 2.019 104.134 170.719 -90.55 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 35.1 t -112.49 -41.26 3.9 Favored 'General case' 0 N--CA 1.455 -0.186 0 CA-C-N 119.941 1.246 . . . . 38.41 110.735 176.343 173.714 62.635 103.474 107.318 2.026 106.741 -90.026 -52.215 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 96.0 m -76.78 -36.43 57.01 Favored 'General case' 0 C--N 1.34 0.162 0 CA-C-N 119.533 1.061 . . . . 46.15 110.533 179.004 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 70.8 m -118.0 172.39 7.44 Favored 'General case' 0 N--CA 1.453 -0.324 0 N-CA-C 109.349 -0.611 . . . . 42.42 109.349 176.866 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 78.3 mt -93.63 115.93 33.61 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 CA-C-O 122.896 1.331 . . . . 39.12 109.887 178.076 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.7 m -80.96 -162.21 0.46 Allowed 'General case' 0 C--O 1.235 0.29 0 CA-C-N 113.202 -1.817 . . . . 40.38 113.244 177.511 -90.55 170.719 -88.817 104.134 2.019 106.203 -14.317 -65.258 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 88.1 p -144.08 -164.18 1.83 Allowed 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 114.749 -1.114 . . . . 35.73 108.607 174.795 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 52.6 tp -73.37 -49.79 25.35 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 122.94 0.496 . . . . 41.1 110.863 177.526 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -80.41 -11.67 59.66 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 117.339 2.348 . . . . 38.22 117.339 -176.336 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 61.5 mt-30 -80.19 -24.89 39.98 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 121.638 0.732 . . . . 42.46 109.927 170.489 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 15.8 tp -82.97 -33.21 26.72 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.709 1.604 . . . . 35.24 110.712 177.354 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -71.25 -16.24 62.48 Favored 'General case' 0 C--N 1.348 0.524 0 C-N-CA 123.653 0.781 . . . . 42.05 112.141 177.208 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -66.71 -26.32 66.95 Favored 'General case' 0 C--N 1.342 0.254 0 C-N-CA 124.854 1.262 . . . . 31.89 113.049 176.81 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 78.9 m-85 -94.37 15.51 17.43 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 114.393 1.257 . . . . 25.65 114.393 -179.818 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 75.8 m -85.94 -166.38 1.51 Allowed 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.315 0.578 . . . . 42.19 110.77 175.993 -58.839 -56.069 -84.443 105.511 2.025 105.783 -58.65 -63.482 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 80.0 m-20 . . . . . 0 CA--C 1.541 0.612 0 N-CA-C 108.978 -0.749 . . . . 33.39 108.978 176.713 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 15.4 t80 . . . . . 0 N--CA 1.449 -0.479 0 N-CA-C 110.572 -0.158 . . . . 32.51 110.572 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 2' ' ' VAL . . . . . 0.42 ' HB ' ' HG2' ' B' ' 4' ' ' GLN . 1.6 m -64.88 142.63 16.67 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.244 0 CA-C-O 123.874 1.797 . . . . 31.01 114.978 179.435 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 52.5 t-20 -122.06 85.37 2.4 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 101.751 -3.426 . . . . 53.64 101.751 177.694 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' GLN . . . . . 0.42 ' HG2' ' HB ' ' B' ' 2' ' ' VAL . 7.2 pt20 -169.63 174.61 5.74 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-O 123.818 1.771 . . . . 50.72 114.521 -178.597 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -89.9 107.58 19.19 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 111.799 -2.455 . . . . 48.31 108.336 174.765 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 32.5 mt -88.24 112.92 23.32 Favored 'General case' 0 CA--C 1.518 -0.253 0 C-N-CA 123.213 0.605 . . . . 36.08 109.647 -179.978 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 38.8 m -132.3 138.92 48.0 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 114.723 1.379 . . . . 34.57 114.723 -176.647 -52.215 -90.026 103.474 106.741 2.026 107.318 62.635 173.714 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 80.07 -136.11 16.28 Favored Glycine 0 C--N 1.342 0.878 0 CA-C-N 114.432 -1.258 . . . . 23.41 113.551 178.25 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 34.3 p -66.75 -16.41 64.23 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 114.271 1.211 . . . . 10.73 114.271 176.533 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 54.7 m-70 -69.25 -43.99 72.84 Favored 'General case' 0 CA--C 1.508 -0.636 0 C-N-CA 126.279 1.832 . . . . 14.61 110.878 174.893 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 43.0 tp -63.6 -35.87 81.94 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 111.042 -2.799 . . . . 35.65 111.915 175.382 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 60.1 t -79.84 -34.07 15.21 Favored 'Isoleucine or valine' 0 C--O 1.235 0.296 0 CA-C-N 118.831 0.741 . . . . 22.36 110.435 178.378 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -66.93 -40.43 87.59 Favored 'General case' 0 C--N 1.34 0.177 0 N-CA-C 114.088 1.144 . . . . 31.05 114.088 175.378 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.62 -46.42 90.33 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 123.762 0.825 . . . . 13.46 109.365 175.642 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 63.6 mt -63.81 -25.57 68.23 Favored 'General case' 0 C--N 1.343 0.289 0 C-N-CA 124.467 1.107 . . . . 29.71 113.311 175.297 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 65.5 t80 -75.86 -43.72 44.27 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 112.914 0.709 . . . . 18.93 112.914 176.886 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 40.3 tp -70.63 -47.9 57.71 Favored 'General case' 0 C--N 1.343 0.296 0 N-CA-C 114.126 1.158 . . . . 31.07 114.126 179.625 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 61.4 t -68.3 -35.66 71.91 Favored 'Isoleucine or valine' 0 C--O 1.234 0.251 0 N-CA-C 116.168 1.914 . . . . 21.51 116.168 -175.961 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 75.1 m -84.57 -44.25 13.71 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-N 118.73 0.695 . . . . 31.83 112.16 178.733 -63.482 -58.65 -84.443 105.783 2.025 105.511 -56.069 -58.839 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 67.36 -115.18 6.87 Favored Glycine 0 CA--C 1.526 0.758 0 N-CA-C 115.211 0.845 . . . . 36.63 115.211 178.328 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -66.95 -23.51 65.97 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 114.95 1.463 . . . . 38.32 114.95 -177.496 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -73.63 -40.69 63.58 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 122.667 0.387 . . . . 43.12 110.628 177.37 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 87.58 -167.98 37.6 Favored Glycine 0 C--N 1.341 0.822 0 N-CA-C 110.253 -1.139 . . . . 31.93 110.253 -176.528 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 52.8 p90 -155.44 169.11 25.01 Favored 'General case' 0 CA--C 1.513 -0.444 0 CA-C-O 122.269 1.033 . . . . 24.09 112.833 -178.134 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 37.3 p90 -116.48 120.74 39.72 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 114.055 -1.43 . . . . 33.2 107.26 170.625 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 61.6 t80 -105.88 114.3 28.37 Favored 'General case' 0 N--CA 1.441 -0.899 0 N-CA-C 106.311 -1.736 . . . . 43.08 106.311 174.968 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 21.1 p -127.87 99.25 26.11 Favored Pre-proline 0 N--CA 1.446 -0.671 0 CA-C-N 111.815 -2.448 . . . . 37.87 109.278 179.672 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 6.8 Cg_endo -78.32 15.86 1.31 Allowed 'Trans proline' 0 N--CA 1.461 -0.399 0 C-N-CA 125.041 3.827 . . . . 28.86 119.323 -170.676 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.37 138.86 58.26 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 124.079 1.895 . . . . 47.48 114.905 -179.065 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 92.4 m . . . . . 0 N--CA 1.45 -0.462 0 CA-C-N 109.814 -3.357 . . . . 52.27 112.906 -177.326 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.432 -1.58 0 N-CA-C 104.052 -3.619 . . . . 50.3 104.052 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 2' ' ' IIL . . . . . 0.478 HG22 ' SG ' ' C' ' 6' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 3' ' ' VAL . . . . . . . . . . . . . 6.5 t -63.16 -33.56 61.65 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.273 0 CA-C-N 114.18 -1.373 . . . . 36.79 110.332 179.921 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -116.41 -12.32 11.08 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 115.723 1.749 . . . . 47.09 115.723 177.785 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 5' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -85.5 -25.81 26.63 Favored 'General case' 0 C--N 1.346 0.415 0 CA-C-N 119.691 1.132 . . . . 40.9 109.395 174.631 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 6' ' ' CYS . . . . . 0.478 ' SG ' HG22 ' C' ' 2' ' ' IIL . 83.7 m -104.42 0.62 29.19 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 114.996 1.48 . . . . 35.65 114.996 178.742 -59.327 -50.176 -89.682 104.882 2.012 103.121 146.396 -68.367 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 7' ' ' CYS . . . . . 0.483 ' SG ' HD11 ' D' ' 11' ' ' LEU . 62.8 m -106.98 -24.59 11.95 Favored 'General case' 0 C--N 1.343 0.29 0 N-CA-C 116.776 2.139 . . . . 43.55 116.776 177.104 -73.538 -69.332 -98.977 102.413 2.022 105.981 -129.962 -179.914 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 8' ' ' THR . . . . . . . . . . . . . 10.1 p -81.05 -57.07 3.69 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 121.029 1.74 . . . . 56.74 108.452 174.681 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 9' ' ' SER . . . . . . . . . . . . . 67.9 p -102.56 170.05 8.28 Favored 'General case' 0 C--O 1.232 0.153 0 N-CA-C 105.312 -2.107 . . . . 55.8 105.312 170.374 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 10' ' ' ILE . . . . . . . . . . . . . 1.1 pt -107.79 160.29 6.98 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.456 0 O-C-N 118.521 -2.612 . . . . 52.15 113.972 -179.137 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 11' ' ' CYS . . . . . 0.407 ' O ' ' H6 ' ' C' ' 200' ' ' IPH . 91.4 m -105.78 138.78 41.4 Favored 'General case' 0 N--CA 1.443 -0.776 0 CA-C-N 113.681 -1.599 . . . . 37.36 113.422 178.26 -68.367 146.396 -89.682 103.121 2.012 104.882 -50.176 -59.327 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 12' ' ' SER . . . . . . . . . . . . . 66.8 p -77.21 177.65 7.7 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 114.255 -1.339 . . . . 31.03 110.345 175.737 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 13' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.94 -34.02 69.43 Favored 'General case' 0 C--N 1.343 0.313 0 O-C-N 121.066 -1.021 . . . . 29.67 111.53 175.694 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 14' ' ' TYR . . . . . . . . . . . . . 50.4 m-85 -71.1 -43.3 67.96 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 126.257 1.823 . . . . 38.68 115.266 -178.246 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 15' ' ' GLN . . . . . . . . . . . . . 68.3 mt-30 -69.02 -35.76 77.01 Favored 'General case' 0 C--O 1.232 0.155 0 O-C-N 121.664 -0.647 . . . . 34.46 111.371 174.467 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 16' ' ' LEU . . . . . . . . . . . . . 70.3 mt -71.05 -24.15 62.29 Favored 'General case' 0 C--N 1.344 0.352 0 N-CA-C 113.626 0.972 . . . . 22.52 113.626 176.533 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 17' ' ' GLU . . . . . . . . . . . . . 59.8 tt0 -68.37 -21.67 64.7 Favored 'General case' 0 C--N 1.342 0.265 0 C-N-CA 125.753 1.621 . . . . 37.06 113.65 -179.324 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 18' ' ' ASN . . . . . . . . . . . . . 63.8 m-20 -71.32 -19.73 62.27 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 123.753 0.821 . . . . 32.76 112.663 177.871 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 19' ' ' TYR . . . . . . . . . . . . . 91.3 m-85 -102.09 20.43 16.65 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 114.443 1.275 . . . . 48.21 114.443 -178.91 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 20' ' ' CYS . . . . . . . . . . . . . 71.8 m -101.77 150.16 23.43 Favored 'General case' 0 C--N 1.34 0.183 0 O-C-N 121.565 -0.709 . . . . 28.41 109.322 175.52 -62.184 -62.697 -78.399 105.568 2.026 104.646 -45.269 -55.096 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 21' ' ' ASN . . . . . . . . . . . . . 8.8 m120 . . . . . 0 CA--C 1.531 0.232 0 CA-C-O 116.563 -1.684 . . . . 31.27 113.926 -176.597 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 1' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.451 -0.375 0 N-CA-C 112.64 0.608 . . . . 43.89 112.64 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 2' ' ' VAL . . . . . . . . . . . . . 21.8 t -75.36 100.18 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.341 0.236 0 N-CA-C 103.496 -2.779 . . . . 39.58 103.496 175.933 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 3' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -57.27 93.86 0.01 OUTLIER 'General case' 0 C--N 1.343 0.286 0 CA-C-O 122.855 1.312 . . . . 31.24 113.496 -174.4 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 4' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -69.7 -22.73 63.39 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 112.359 -2.2 . . . . 43.04 116.643 -176.023 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 5' ' ' HIS . . . . . . . . . . . . . 13.8 t60 -74.01 -43.44 58.0 Favored 'General case' 0 C--N 1.344 0.343 0 N-CA-C 108.603 -0.888 . . . . 30.63 108.603 176.357 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 6' ' ' LEU . . . . . . . . . . . . . 45.0 mt -72.75 -32.38 65.62 Favored 'General case' 0 C--N 1.342 0.273 0 C-N-CA 122.865 0.466 . . . . 21.62 111.707 176.77 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 7' ' ' CYS . . . . . . . . . . . . . 52.5 t -72.07 -35.01 69.16 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 109.899 -0.408 . . . . 34.31 109.899 174.667 -179.914 -129.962 -98.977 105.981 2.022 102.413 -69.332 -73.538 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 8' ' ' GLY . . . . . 0.45 ' HA2' HD12 ' D' ' 11' ' ' LEU . . . -64.45 -37.55 94.6 Favored Glycine 0 C--N 1.34 0.786 0 C-N-CA 125.024 1.297 . . . . 19.4 113.424 179.219 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 9' ' ' SER . . . . . . . . . . . . . 49.5 m -56.57 -48.5 77.21 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 123.467 0.707 . . . . 19.95 109.672 175.033 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 10' ' ' HIS . . . . . . . . . . . . . 90.8 m-70 -71.41 -35.48 71.0 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-O 117.131 -1.414 . . . . 24.6 112.898 179.237 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 11' ' ' LEU . . . . . 0.483 HD11 ' SG ' ' C' ' 7' ' ' CYS . 68.5 mt -57.2 -50.02 74.16 Favored 'General case' 0 C--N 1.346 0.429 0 N-CA-C 114.668 1.359 . . . . 22.9 114.668 174.545 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 12' ' ' VAL . . . . . . . . . . . . . 30.4 m -71.5 -23.79 23.05 Favored 'Isoleucine or valine' 0 C--N 1.345 0.374 0 N-CA-C 114.456 1.28 . . . . 19.72 114.456 179.669 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -73.0 -35.33 66.81 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 109.137 -0.69 . . . . 16.04 109.137 172.282 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 14' ' ' ALA . . . . . . . . . . . . . . . -71.77 -43.02 66.46 Favored 'General case' 0 CA--C 1.53 0.174 0 O-C-N 121.358 -0.839 . . . . 20.08 111.862 175.166 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 15' ' ' LEU . . . . . . . . . . . . . 15.1 mt -60.81 -21.09 62.78 Favored 'General case' 0 C--N 1.344 0.341 0 C-N-CA 124.568 1.147 . . . . 26.4 113.498 175.803 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 16' ' ' TYR . . . . . . . . . . . . . 75.8 t80 -74.05 -46.22 44.6 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 123.253 0.621 . . . . 23.78 110.613 174.238 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 17' ' ' LEU . . . . . . . . . . . . . 80.9 mt -68.02 -40.5 82.92 Favored 'General case' 0 C--N 1.344 0.342 0 N-CA-C 112.397 0.517 . . . . 21.33 112.397 179.042 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 18' ' ' VAL . . . . . . . . . . . . . 58.9 t -73.11 -53.56 18.12 Favored 'Isoleucine or valine' 0 C--N 1.34 0.17 0 N-CA-C 113.742 1.016 . . . . 23.87 113.742 -178.155 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 19' ' ' CYS . . . . . . . . . . . . . 59.1 m -72.57 -30.42 64.38 Favored 'General case' 0 C--O 1.232 0.184 0 N-CA-C 115.005 1.483 . . . . 26.86 115.005 -178.193 -55.096 -45.269 -78.399 104.646 2.026 105.568 -62.697 -62.184 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 20' ' ' GLY . . . . . . . . . . . . . . . 57.02 -111.3 2.71 Favored Glycine 0 C--N 1.342 0.881 0 C-N-CA 123.969 0.795 . . . . 39.1 113.153 179.301 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 21' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -85.72 -20.48 29.27 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 113.13 0.789 . . . . 42.89 113.13 178.208 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 22' ' ' ARG . . . . . . . . . . . . . 86.9 mtm180 -63.36 -29.38 70.7 Favored 'General case' 0 C--N 1.343 0.319 0 N-CA-C 112.797 0.665 . . . . 38.04 112.797 179.091 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 23' ' ' GLY . . . . . . . . . . . . . . . 74.86 176.97 38.38 Favored Glycine 0 C--N 1.337 0.611 0 CA-C-O 122.141 0.856 . . . . 35.75 114.072 177.603 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 24' ' ' PHE . . . . . . . . . . . . . 34.7 p90 -156.33 166.84 32.26 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 114.194 -1.003 . . . . 29.57 112.128 179.232 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 25' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 -121.16 133.96 55.21 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 113.702 -1.59 . . . . 46.84 107.916 175.271 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 26' ' ' TYR . . . . . 0.612 ' CE2' ' HG3' ' D' ' 28' ' ' PRO . 65.9 t80 -106.57 130.72 54.29 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 121.703 0.763 . . . . 34.17 111.423 178.613 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 27' ' ' THR . . . . . . . . . . . . . 38.9 p -135.65 121.94 14.2 Favored Pre-proline 0 CA--C 1.538 0.488 0 C-N-CA 124.888 1.275 . . . . 43.43 112.756 -179.848 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 28' ' ' PRO . . . . . 0.612 ' HG3' ' CE2' ' D' ' 26' ' ' TYR . 18.3 Cg_endo -120.37 26.44 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 124.911 3.741 . . . . 45.96 117.52 165.8 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 29' ' ' LYS . . . . . . . . . . . . . 59.3 pttt -67.67 174.65 3.38 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 120.675 3.583 . . . . 56.0 120.675 -174.825 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 30' ' ' THR . . . . . . . . . . . . . 31.0 m . . . . . 0 CA--C 1.538 0.489 0 O-C-N 125.142 1.527 . . . . 45.2 108.976 177.27 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 200' ' ' IPH . . . . . 0.407 ' H6 ' ' O ' ' C' ' 11' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_