data_1cm4_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 1cm4 _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 ' 4' ' ' LEU . . . . . . . . . . . . . 1.6 tp . . . . . 0 N--CA 1.448 -0.534 0 CA-C-O 121.012 0.434 . . . . 51.1 109.906 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 10.7 p -67.71 157.24 35.08 Favored 'General case' 0 N--CA 1.462 0.131 0 C-N-CA 123.383 0.673 . . . . 48.6 112.476 179.342 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -63.32 -38.53 91.53 Favored 'General case' 0 C--N 1.349 0.545 0 C-N-CA 123.909 0.883 . . . . 46.6 112.594 -179.004 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.66 -23.98 58.74 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 114.131 -1.395 . . . . 43.8 113.931 178.053 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 43.2 mt-30 -73.61 -35.06 65.32 Favored 'General case' 0 C--N 1.345 0.373 0 CA-C-N 118.455 0.571 . . . . 41.6 111.806 178.651 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 78.4 mt -66.84 -31.53 53.9 Favored 'Isoleucine or valine' 0 C--N 1.343 0.287 0 N-CA-C 108.335 -0.987 . . . . 25.6 108.335 176.902 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.36 -31.63 65.77 Favored 'General case' 0 C--N 1.348 0.527 0 N-CA-C 115.186 1.551 . . . . 23.5 115.186 179.085 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -67.25 -39.87 86.19 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 119.438 1.017 . . . . 24.4 109.172 174.904 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 20.4 m-30 -74.91 -24.41 58.51 Favored 'General case' 0 C--N 1.347 0.485 0 N-CA-C 116.081 1.882 . . . . 22.4 116.081 -176.747 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 16.5 mtmm -74.84 -27.86 60.45 Favored 'General case' 0 C--N 1.349 0.566 0 N-CA-C 108.201 -1.037 . . . . 29.9 108.201 176.933 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 21.8 tp10 -77.53 -42.53 35.12 Favored 'General case' 0 N--CA 1.448 -0.574 0 O-C-N 124.559 1.162 . . . . 28.9 113.293 178.773 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.08 -35.36 80.3 Favored 'General case' 0 C--N 1.341 0.225 0 O-C-N 121.507 -0.745 . . . . 22.5 112.033 175.693 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 70.4 t80 -61.82 -42.87 99.57 Favored 'General case' 0 C--N 1.344 0.348 0 N-CA-C 109.196 -0.668 . . . . 19.5 109.196 175.317 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 51.7 m -64.55 -22.2 66.9 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 117.393 2.368 . . . . 24.0 117.393 -178.307 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 83.0 mt -88.2 -43.05 11.89 Favored 'General case' 0 C--N 1.346 0.45 0 N-CA-C 114.227 1.195 . . . . 23.2 114.227 -179.857 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 71.0 m-85 -67.38 -42.61 83.12 Favored 'General case' 0 C--N 1.343 0.324 0 CA-C-O 122.084 0.945 . . . . 24.6 112.705 176.009 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -78.02 85.28 4.25 Favored 'General case' 0 N--CA 1.456 -0.156 0 N-CA-C 119.856 3.28 . . . . 35.5 119.856 -173.439 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt -58.9 -62.02 2.19 Favored 'General case' 0 N--CA 1.465 0.278 1 N-CA-C 124.751 5.093 . . . . 42.0 124.751 177.64 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 23.3 p-10 -83.16 113.02 20.36 Favored 'General case' 0 C--N 1.348 0.531 0 N-CA-C 114.716 1.376 . . . . 45.5 114.716 -179.573 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -64.42 82.63 0.06 OUTLIER Glycine 0 N--CA 1.44 -1.087 0 N-CA-C 106.55 -2.62 . . . . 39.0 106.55 -173.758 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -125.34 10.36 7.98 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 120.082 3.364 . . . . 33.6 120.082 -178.265 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 85.46 -28.61 4.72 Favored Glycine 0 C--N 1.347 1.151 0 N-CA-C 117.767 1.867 . . . . 24.1 117.767 174.582 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 45.9 p -106.88 122.22 45.98 Favored 'General case' 0 C--N 1.345 0.378 0 CA-C-N 118.769 1.285 . . . . 16.0 112.253 179.279 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 78.4 mt -86.64 129.77 37.84 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.174 0 O-C-N 120.037 -1.664 . . . . 14.0 110.829 178.953 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 43.4 p -99.03 171.81 7.8 Favored 'General case' 0 C--O 1.233 0.195 0 O-C-N 121.713 -0.617 . . . . 13.5 112.195 -179.462 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 25.2 p -62.65 -33.34 74.84 Favored 'General case' 0 C--N 1.341 0.232 0 O-C-N 121.245 -0.909 . . . . 14.2 110.122 172.517 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 56.8 mttp -67.75 -34.77 77.47 Favored 'General case' 0 CA--C 1.509 -0.611 0 CA-C-O 118.186 -0.912 . . . . 25.1 111.977 177.352 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -73.16 -39.14 65.89 Favored 'General case' 0 C--N 1.341 0.219 0 CA-C-N 119.476 1.034 . . . . 24.9 111.907 178.948 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 10.3 mt -59.94 -47.14 87.01 Favored 'General case' 0 C--O 1.222 -0.393 0 N-CA-C 109.576 -0.528 . . . . 18.1 109.576 171.925 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -66.52 -44.35 90.25 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 114.641 0.617 . . . . 16.0 114.641 -176.523 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 46.4 m -63.82 -32.74 74.35 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 124.96 1.304 . . . . 17.3 111.229 -178.013 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 92.3 t -72.95 -48.27 45.26 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 C-N-CA 123.214 0.606 . . . . 19.6 110.947 179.62 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 70.0 mtm -60.96 -38.18 85.02 Favored 'General case' 0 C--N 1.341 0.223 0 O-C-N 120.854 -1.154 . . . . 23.4 111.798 177.224 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 78.9 mtm-85 -72.19 -25.62 61.74 Favored 'General case' 0 C--N 1.343 0.317 0 CA-C-N 118.994 0.816 . . . . 27.8 112.776 176.629 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 83.6 p -78.19 -14.37 59.48 Favored 'General case' 0 C--N 1.352 0.71 0 CA-C-N 118.9 0.773 . . . . 31.2 111.371 175.344 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 90.0 mt -93.4 -7.73 43.79 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-O 121.603 0.715 . . . . 35.8 109.984 174.347 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 105.3 0.69 40.94 Favored Glycine 0 C--N 1.344 1.003 0 N-CA-C 116.555 1.382 . . . . 36.0 116.555 175.3 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 26.5 tp60 -92.09 171.2 9.25 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 108.677 -0.861 . . . . 37.0 108.677 178.554 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -138.87 69.67 43.2 Favored Pre-proline 0 N--CA 1.449 -0.511 0 O-C-N 121.003 -1.06 . . . . 51.1 111.906 177.73 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_endo -76.57 119.58 5.25 Favored 'Trans proline' 0 N--CA 1.449 -1.089 0 C-N-CA 123.665 2.91 . . . . 37.4 113.937 176.463 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 4.3 p -72.09 154.73 40.93 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.095 -1.411 . . . . 33.9 109.533 175.224 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.05 -29.51 65.44 Favored 'General case' 0 C--N 1.342 0.281 0 N-CA-C 114.654 1.353 . . . . 37.2 114.654 179.97 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.91 -47.83 67.67 Favored 'General case' 0 C--N 1.347 0.465 0 C-N-CA 123.89 0.876 . . . . 31.4 110.77 178.748 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -62.2 -37.67 86.21 Favored 'General case' 0 C--N 1.343 0.301 0 N-CA-C 114.475 1.287 . . . . 34.5 114.475 178.008 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 22.6 mt -66.74 -40.55 88.39 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 107.726 -1.212 . . . . 27.9 107.726 173.26 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.2 tp60 -71.18 -36.15 71.87 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 114.209 -1.359 . . . . 41.2 111.897 177.929 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 83.5 m-20 -72.56 -16.32 61.75 Favored 'General case' 0 C--N 1.35 0.624 0 CA-C-N 118.612 0.642 . . . . 32.8 110.365 174.471 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 17.4 mtt -84.79 -46.81 11.02 Favored 'General case' 0 C--N 1.348 0.536 0 N-CA-C 116.251 1.945 . . . . 36.0 116.251 179.473 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 26.8 mm -67.58 -35.68 73.82 Favored 'Isoleucine or valine' 0 C--N 1.345 0.406 0 N-CA-C 114.628 1.344 . . . . 37.0 114.628 -179.444 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -53.26 -30.02 36.11 Favored 'General case' 0 C--N 1.344 0.333 0 N-CA-C 116.688 2.107 . . . . 43.7 116.688 -179.914 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -63.29 -53.42 53.12 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 114.872 -1.058 . . . . 49.5 109.471 175.213 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -93.23 12.98 2.64 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 CA-C-N 115.065 -0.97 . . . . 51.4 110.667 -178.932 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 38.5 t0 -67.31 -22.2 65.64 Favored 'General case' 0 C--N 1.347 0.467 0 CA-C-O 115.489 -2.196 . . . . 46.9 114.854 -174.446 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . 25.41 -69.84 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 122.255 2.298 . . . . 45.4 115.001 -175.438 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -80.73 13.81 2.43 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 118.03 2.604 . . . . 45.8 118.03 -176.628 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 78.8 -25.78 2.48 Favored Glycine 0 C--N 1.339 0.723 0 N-CA-C 109.428 -1.469 . . . . 42.0 109.428 -174.989 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -48.24 -37.24 15.62 Favored 'General case' 0 CA--C 1.535 0.403 1 N-CA-C 122.279 4.178 . . . . 38.7 122.279 178.869 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 115.65 -12.13 18.36 Favored Glycine 0 CA--C 1.529 0.963 0 N-CA-C 118.822 2.289 . . . . 29.5 118.822 174.604 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 61.4 p -118.08 169.69 9.47 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 120.907 2.353 . . . . 23.5 110.724 179.518 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 8.0 mt -109.13 141.89 23.16 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.406 0 CA-C-O 123.049 1.404 . . . . 21.1 111.994 179.117 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 8.3 p30 -117.95 177.44 4.78 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 112.534 -2.121 . . . . 24.1 109.599 176.085 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -70.18 -43.15 18.03 Favored Pre-proline 0 C--N 1.346 0.421 0 CA-C-O 114.43 -2.7 . . . . 27.1 116.076 -177.97 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_exo -46.57 -38.09 21.18 Favored 'Trans proline' 0 C--N 1.355 0.907 0 C-N-CA 124.733 3.622 . . . . 25.0 114.323 170.08 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 76.3 mt-10 -72.25 -42.65 65.4 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 114.513 1.301 . . . . 24.0 114.513 178.253 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 53.1 t80 -60.1 -29.52 68.65 Favored 'General case' 0 C--O 1.222 -0.375 0 O-C-N 124.425 1.078 . . . . 21.3 108.799 178.399 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 56.9 tp -76.14 -39.67 54.51 Favored 'General case' 0 N--CA 1.444 -0.743 0 C-N-CA 125.086 1.354 . . . . 24.3 111.097 178.916 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.1 m -63.38 -44.27 95.24 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 119.378 0.99 . . . . 35.5 110.482 179.958 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 19.1 tmm? -52.54 -52.07 56.56 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 123.871 0.868 . . . . 47.1 111.385 179.45 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 30.2 mmm -66.87 -30.9 71.19 Favored 'General case' 0 C--N 1.342 0.256 0 N-CA-C 114.907 1.447 . . . . 45.8 114.907 -178.347 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.08 -30.96 68.32 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 108.391 -0.966 . . . . 50.3 108.391 175.455 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -84.33 150.99 25.02 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 124.657 2.17 . . . . 61.8 109.014 178.279 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 39.5 mttp -110.48 141.68 43.27 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 111.066 -2.788 . . . . 57.1 109.738 -179.874 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -118.29 120.5 37.83 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 108.631 -0.877 . . . . 60.3 108.631 169.972 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . . . -70.91 170.83 11.85 Favored 'General case' 0 N--CA 1.464 0.233 0 O-C-N 120.961 -1.087 . . . . 59.9 113.139 179.295 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -67.92 100.05 0.92 Allowed 'General case' 0 C--O 1.232 0.181 0 N-CA-C 115.289 1.588 . . . . 63.6 115.289 -179.179 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 45.3 p -60.19 -82.19 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 114.663 -1.153 . . . . 55.4 108.245 176.484 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -78.17 -40.18 38.61 Favored 'General case' 0 C--O 1.239 0.545 0 CA-C-N 122.682 2.492 . . . . 51.0 114.646 179.356 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 7.1 t -130.93 147.16 52.53 Favored 'General case' 0 N--CA 1.452 -0.35 0 O-C-N 121.214 -0.929 . . . . 50.3 111.703 -179.106 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -59.48 -46.02 90.0 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 122.905 0.482 . . . . 52.5 111.734 177.343 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.37 76.42 6.72 Favored 'General case' 0 C--N 1.344 0.337 0 CA-C-O 123.751 1.739 . . . . 52.5 114.41 -178.694 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 48.3 tt0 -76.0 -22.4 55.87 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 113.364 -1.744 . . . . 39.3 112.881 179.32 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 84.1 mt -62.94 -36.81 77.3 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 CA-C-O 117.917 -1.04 . . . . 34.6 110.301 177.096 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 16.5 tpp180 -62.75 -40.36 97.0 Favored 'General case' 0 C--N 1.347 0.487 0 CA-C-N 120.814 1.643 . . . . 31.2 110.239 174.98 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -67.69 -36.66 81.07 Favored 'General case' 0 C--N 1.344 0.352 0 CA-C-N 118.833 0.742 . . . . 27.1 112.128 -179.971 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.2 -33.06 73.74 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 123.628 0.58 . . . . 13.2 110.326 178.886 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -70.76 -32.88 70.18 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 123.472 0.709 . . . . 14.3 111.776 177.759 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 1.1 mtp180 -72.28 -13.95 61.64 Favored 'General case' 0 N--CA 1.449 -0.524 0 O-C-N 125.067 1.48 . . . . 39.7 110.311 178.216 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 47.4 t -74.93 -36.16 38.04 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 N-CA-C 109.607 -0.516 . . . . 17.0 109.607 178.703 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' PHE . . . . . . . . . . . . . 39.0 m-85 -84.36 -42.74 15.43 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 119.36 0.982 . . . . 17.3 113.475 178.897 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -86.74 74.31 9.84 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 125.451 1.5 . . . . 26.0 111.916 177.93 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 8.9 mtmp? -63.3 -14.7 52.53 Favored 'General case' 0 CA--C 1.507 -0.706 0 C-N-CA 123.997 0.919 . . . . 40.0 109.968 -174.142 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -111.23 1.45 17.2 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 101.548 -3.501 . . . . 40.3 101.548 172.341 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 72.38 11.83 76.37 Favored Glycine 0 N--CA 1.447 -0.592 0 CA-C-N 111.872 -2.422 . . . . 29.9 115.669 -177.125 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 32.3 p-10 -76.97 0.41 21.23 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 119.059 1.429 . . . . 26.4 109.792 176.589 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 84.56 13.38 73.2 Favored Glycine 0 C--N 1.345 1.069 0 CA-C-O 119.265 -0.742 . . . . 21.8 113.707 179.308 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 69.4 m-85 -144.22 138.51 28.09 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-N 120.617 2.209 . . . . 20.9 111.289 -178.522 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 42.2 mt -99.13 126.0 52.5 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.231 0 N-CA-C 107.38 -1.341 . . . . 10.9 107.38 174.623 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 97.7 p -95.26 164.89 12.66 Favored 'General case' 0 C--O 1.237 0.434 0 N-CA-C 107.768 -1.197 . . . . 12.0 107.768 176.994 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -56.88 -34.46 67.9 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-O 121.14 0.495 . . . . 16.2 110.131 -179.269 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -69.15 -45.02 71.1 Favored 'General case' 0 N--CA 1.45 -0.446 0 O-C-N 126.253 2.221 . . . . 19.3 112.635 178.237 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -63.68 -38.77 92.38 Favored 'General case' 0 CA--C 1.514 -0.409 0 N-CA-C 113.601 0.963 . . . . 21.6 113.601 178.434 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 28.9 tp -67.65 -40.62 84.52 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 108.803 -0.814 . . . . 25.2 108.803 176.402 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 39.7 ttm180 -65.87 -26.71 67.76 Favored 'General case' 0 CA--C 1.529 0.154 0 CA-C-O 118.42 -0.8 . . . . 37.8 109.578 175.67 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 20.0 m-70 -72.99 -38.63 66.56 Favored 'General case' 0 C--N 1.35 0.627 0 CA-C-N 119.581 1.082 . . . . 41.6 110.415 176.497 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 39.9 t -70.03 -38.29 74.78 Favored 'Isoleucine or valine' 0 C--N 1.345 0.404 0 N-CA-C 113.196 0.813 . . . . 34.3 113.196 -179.536 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' MET . . . . . . . . . . . . . 2.8 mmt -71.78 -34.72 69.65 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-O 118.747 -0.644 . . . . 36.0 112.459 -176.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 90.6 m -62.09 -45.32 94.0 Favored 'General case' 0 C--N 1.342 0.258 0 CA-C-N 119.384 0.993 . . . . 35.3 110.289 179.275 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 4.7 t30 -75.86 -30.68 58.98 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 118.887 0.767 . . . . 47.1 111.135 176.441 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 88.2 mt -75.63 -3.03 32.2 Favored 'General case' 0 C--N 1.345 0.386 0 C-N-CA 122.928 0.491 . . . . 44.5 111.938 174.739 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 91.38 68.5 1.17 Allowed Glycine 0 C--N 1.338 0.656 0 N-CA-C 116.011 1.164 . . . . 47.6 116.011 176.255 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 -145.61 155.91 43.33 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 116.119 1.896 . . . . 60.9 116.119 -178.976 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . . . -133.47 93.37 3.13 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 104.892 -2.262 . . . . 49.2 104.892 174.704 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -115.09 144.57 43.44 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 115.2 1.556 . . . . 46.7 115.2 -178.441 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 11.3 m -79.81 158.09 26.88 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 123.547 0.739 . . . . 49.5 111.606 -177.951 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -60.89 -33.52 73.24 Favored 'General case' 0 C--N 1.344 0.329 0 CA-C-O 121.826 0.822 . . . . 47.8 110.876 176.7 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -70.46 -33.78 71.67 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 113.898 -1.501 . . . . 45.3 110.175 173.811 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 85.5 mt-10 -69.36 -36.8 77.21 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.866 -0.607 . . . . 38.6 112.507 178.236 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 94.1 t -72.42 -37.33 57.37 Favored 'Isoleucine or valine' 0 C--N 1.349 0.546 0 N-CA-C 109.293 -0.632 . . . . 32.3 109.293 178.69 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -61.46 -36.84 81.55 Favored 'General case' 0 N--CA 1.444 -0.772 0 C-N-CA 119.099 -1.04 . . . . 36.4 113.449 178.752 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -71.54 -38.8 71.0 Favored 'General case' 0 C--N 1.344 0.367 0 N-CA-C 107.157 -1.423 . . . . 35.5 107.157 177.876 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 55.4 mtm -60.07 -39.46 86.11 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 113.37 0.878 . . . . 31.1 113.37 177.895 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 21.2 mm -63.92 -49.03 83.52 Favored 'Isoleucine or valine' 0 C--N 1.345 0.41 0 CA-C-N 118.247 0.476 . . . . 27.8 109.749 177.964 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 45.3 mtt180 -57.93 -43.22 86.15 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 114.19 1.182 . . . . 47.5 114.19 -179.455 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 69.3 mm-40 -69.03 -19.31 64.1 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 108.669 -0.863 . . . . 32.0 108.669 175.897 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -96.0 -20.33 18.79 Favored 'General case' 0 C--N 1.346 0.431 0 N-CA-C 117.236 2.31 . . . . 15.6 117.236 -178.26 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 43.8 t0 -84.56 130.63 34.72 Favored 'General case' 0 CA--C 1.535 0.376 0 O-C-N 121.647 -0.658 . . . . 11.3 112.29 -178.925 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 70.6 mt -107.4 -49.06 8.11 Favored 'Isoleucine or valine' 0 C--N 1.343 0.305 0 O-C-N 120.887 -1.133 . . . . 10.1 113.906 -179.252 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 57.7 p30 -80.82 -20.77 41.73 Favored 'General case' 0 C--N 1.344 0.353 0 N-CA-C 115.641 1.719 . . . . 9.8 115.641 -174.867 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 85.38 30.61 24.38 Favored Glycine 0 C--N 1.343 0.954 0 CA-C-O 118.932 -0.927 . . . . 7.0 114.446 177.905 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 33.0 p-10 -93.84 5.05 52.93 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 120.63 2.215 . . . . 14.5 114.529 -179.92 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 79.89 10.14 85.98 Favored Glycine 0 C--N 1.342 0.867 0 C-N-CA 123.774 0.702 . . . . 14.6 114.733 175.859 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 -130.7 176.38 8.24 Favored 'General case' 0 CA--C 1.516 -0.355 0 N-CA-C 107.319 -1.363 . . . . 15.0 107.319 -177.854 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 97.6 t -120.88 106.24 18.22 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 CA-C-N 119.575 1.08 . . . . 16.8 109.049 179.009 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 -82.97 -172.9 4.39 Favored 'General case' 0 C--O 1.234 0.276 0 O-C-N 121.242 -0.911 . . . . 19.3 112.378 175.275 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 69.3 t80 -68.93 -40.86 78.76 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 114.823 1.416 . . . . 29.7 114.823 -178.556 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 31.0 mp0 -61.39 -40.53 94.7 Favored 'General case' 0 N--CA 1.45 -0.451 0 O-C-N 121.693 -0.629 . . . . 36.5 112.659 -176.545 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -74.71 -28.46 60.81 Favored 'General case' 0 CA--C 1.515 -0.376 0 C-N-CA 123.901 0.881 . . . . 30.0 111.933 175.324 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 61.8 t80 -68.77 -42.98 76.68 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.525 0.73 . . . . 25.0 110.442 175.2 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 55.6 t -65.65 -43.54 93.8 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.449 0 N-CA-C 107.957 -1.127 . . . . 27.7 107.957 178.959 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -54.92 -49.91 70.13 Favored 'General case' 0 N--CA 1.442 -0.865 0 N-CA-C 113.261 0.837 . . . . 37.0 113.261 -176.674 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' MET . . . . . . . . . . . . . 21.7 ttp -58.11 -31.94 67.63 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 119.556 1.071 . . . . 35.6 109.947 178.932 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 68.4 mmm -96.13 -17.54 20.8 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 115.529 -0.759 . . . . 43.6 110.999 172.936 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 77.3 p . . . . . 0 C--N 1.34 0.152 0 CA-C-O 117.828 -1.082 . . . . 47.8 112.283 -178.187 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 293' ' ' PHE . . . . . . . . . . . . . 44.7 t80 . . . . . 0 C--O 1.234 0.243 0 CA-C-O 122.139 0.971 . . . . 48.2 111.795 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 294' ' ' ASN . . . . . . . . . . . . . 18.8 t-20 -121.12 101.88 7.95 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 105.172 -2.159 . . . . 38.4 105.172 176.077 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 295' ' ' ALA . . . . . . . . . . . . . . . -75.36 -32.57 60.89 Favored 'General case' 0 CA--C 1.517 -0.313 0 N-CA-C 116.573 2.064 . . . . 31.0 116.573 -177.833 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 296' ' ' ARG . . . . . . . . . . . . . 7.0 ttm-85 -76.36 -11.08 59.84 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 118.456 0.571 . . . . 30.6 112.201 -179.773 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 297' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -79.12 -42.07 27.12 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 116.157 1.91 . . . . 34.0 116.157 179.188 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 298' ' ' LYS . . . . . . . . . . . . . 22.0 mmtm -70.46 -32.19 69.64 Favored 'General case' 0 C--O 1.222 -0.354 0 N-CA-C 108.181 -1.044 . . . . 30.6 108.181 170.719 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 299' ' ' LEU . . . . . . . . . . . . . 48.7 tp -71.89 -52.99 14.58 Favored 'General case' 0 N--CA 1.464 0.252 0 C-N-CA 123.64 0.776 . . . . 18.3 113.059 177.691 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 300' ' ' LYS . . . . . . . . . . . . . 34.3 mttm -66.21 -25.03 66.73 Favored 'General case' 0 C--N 1.348 0.524 0 CA-C-O 117.99 -1.005 . . . . 24.2 112.959 176.633 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 301' ' ' GLY . . . . . . . . . . . . . . . -77.41 -40.56 23.12 Favored Glycine 0 C--N 1.343 0.935 0 O-C-N 123.864 0.728 . . . . 9.2 112.745 179.84 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 302' ' ' ALA . . . . . . . . . . . . . . . -71.46 -32.05 67.86 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-O 118.588 -0.72 . . . . 7.9 111.224 177.57 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 303' ' ' ILE . . . . . . . . . . . . . 61.3 mt -66.19 -47.28 85.12 Favored 'Isoleucine or valine' 0 C--N 1.351 0.633 0 CA-C-N 120.146 1.339 . . . . 8.3 110.47 176.673 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 304' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.33 -38.0 85.31 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-O 117.546 -1.216 . . . . 8.2 112.384 177.538 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 305' ' ' THR . . . . . . . . . . . . . 23.7 m -59.85 -40.97 90.35 Favored 'General case' 0 C--N 1.348 0.541 0 CA-C-N 120.32 1.418 . . . . 9.6 110.36 177.469 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 306' ' ' THR . . . . . . . . . . . . . 44.8 m -75.24 -31.12 60.73 Favored 'General case' 0 C--N 1.349 0.563 0 C-N-CA 123.453 0.701 . . . . 7.5 109.782 176.681 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 307' ' ' MET . . . . . . . . . . . . . 73.4 mtp -62.31 -46.19 89.84 Favored 'General case' 0 C--N 1.345 0.386 0 N-CA-C 112.863 0.69 . . . . 19.8 112.863 176.615 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 308' ' ' LEU . . . . . . . . . . . . . 44.6 mt -65.91 -43.16 88.98 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 121.187 0.517 . . . . 19.4 109.671 177.99 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 309' ' ' ALA . . . . . . . . . . . . . . . -74.49 -19.4 60.39 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 113.354 0.872 . . . . 26.2 113.354 177.18 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 310' ' ' THR . . . . . . . . . . . . . 26.2 m . . . . . 0 C--N 1.347 0.463 0 C-N-CA 123.717 0.807 . . . . 31.7 112.796 179.139 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 401' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 402' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 403' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 404' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 405' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 406' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 407' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 408' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 409' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 410' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 411' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 412' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 413' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 414' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 415' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 416' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 417' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 507' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 508' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 509' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 511' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 512' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 513' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 514' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 515' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 516' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 517' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 518' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 519' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 520' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 521' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 522' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 523' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 524' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 525' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 526' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 527' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 528' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 529' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 530' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 531' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 532' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 533' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 534' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 535' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 536' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 537' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 538' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 539' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 540' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 541' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 542' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 543' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 544' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 545' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 546' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 547' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 548' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 549' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 550' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 551' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 552' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 553' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 554' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 401' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 402' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 403' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 404' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.6 tp . . . . . 0 N--CA 1.448 -0.534 0 CA-C-O 121.012 0.434 . . . . 51.1 109.906 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 10.7 p -67.71 157.24 35.08 Favored 'General case' 0 N--CA 1.462 0.131 0 C-N-CA 123.383 0.673 . . . . 48.6 112.476 179.342 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -63.32 -38.53 91.53 Favored 'General case' 0 C--N 1.349 0.545 0 C-N-CA 123.909 0.883 . . . . 46.6 112.594 -179.004 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' GLU . . . . . 0.499 ' HB2' ' NH2' ' B' ' 297' ' ' ARG . 0.0 OUTLIER -74.66 -23.98 58.74 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 114.131 -1.395 . . . . 43.8 113.931 178.053 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 43.2 mt-30 -73.61 -35.06 65.32 Favored 'General case' 0 C--N 1.345 0.373 0 CA-C-N 118.455 0.571 . . . . 41.6 111.806 178.651 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 78.4 mt -66.84 -31.53 53.9 Favored 'Isoleucine or valine' 0 C--N 1.343 0.287 0 N-CA-C 108.335 -0.987 . . . . 33.9 108.335 176.902 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.36 -31.63 65.77 Favored 'General case' 0 C--N 1.348 0.527 0 N-CA-C 115.186 1.551 . . . . 31.7 115.186 179.085 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -67.25 -39.87 86.19 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 119.438 1.017 . . . . 30.9 109.172 174.904 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 20.4 m-30 -74.91 -24.41 58.51 Favored 'General case' 0 C--N 1.347 0.485 0 N-CA-C 116.081 1.882 . . . . 34.9 116.081 -176.747 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 16.5 mtmm -74.84 -27.86 60.45 Favored 'General case' 0 C--N 1.349 0.566 0 N-CA-C 108.201 -1.037 . . . . 40.5 108.201 176.933 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' GLU . . . . . 0.437 ' HG2' ' HA ' ' B' ' 298' ' ' LYS . 21.8 tp10 -77.53 -42.53 35.12 Favored 'General case' 0 N--CA 1.448 -0.574 0 O-C-N 124.559 1.162 . . . . 41.0 113.293 178.773 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.08 -35.36 80.3 Favored 'General case' 0 C--N 1.341 0.225 0 O-C-N 121.507 -0.745 . . . . 32.9 112.033 175.693 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' PHE . . . . . 0.411 ' HZ ' ' O ' ' A' ' 25' ' ' GLY . 70.4 t80 -61.82 -42.87 99.57 Favored 'General case' 0 C--N 1.344 0.348 0 N-CA-C 109.196 -0.668 . . . . 30.0 109.196 175.317 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 51.7 m -64.55 -22.2 66.9 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 117.393 2.368 . . . . 35.5 117.393 -178.307 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 83.0 mt -88.2 -43.05 11.89 Favored 'General case' 0 C--N 1.346 0.45 0 N-CA-C 114.227 1.195 . . . . 28.7 114.227 -179.857 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' PHE . . . . . 0.424 ' O ' ' HB3' ' A' ' 31' ' ' GLU . 71.0 m-85 -67.38 -42.61 83.12 Favored 'General case' 0 C--N 1.343 0.324 0 CA-C-O 122.084 0.945 . . . . 24.6 112.705 176.009 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -78.02 85.28 4.25 Favored 'General case' 0 N--CA 1.456 -0.156 0 N-CA-C 119.856 3.28 . . . . 35.5 119.856 -173.439 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' LYS . . . . . 0.602 ' HE2' HG22 ' A' ' 35' ' ' VAL . 73.4 mmtt -58.9 -62.02 2.19 Favored 'General case' 0 N--CA 1.465 0.278 1 N-CA-C 124.751 5.093 . . . . 42.0 124.751 177.64 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 23.3 p-10 -83.16 113.02 20.36 Favored 'General case' 0 C--N 1.348 0.531 0 N-CA-C 114.716 1.376 . . . . 45.5 114.716 -179.573 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -64.42 82.63 0.06 OUTLIER Glycine 0 N--CA 1.44 -1.087 0 N-CA-C 106.55 -2.62 . . . . 39.0 106.55 -173.758 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -125.34 10.36 7.98 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 120.082 3.364 . . . . 33.6 120.082 -178.265 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 25' ' ' GLY . . . . . 0.411 ' O ' ' HZ ' ' A' ' 16' ' ' PHE . . . 85.46 -28.61 4.72 Favored Glycine 0 C--N 1.347 1.151 0 N-CA-C 117.767 1.867 . . . . 26.3 117.767 174.582 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 26' ' ' THR . . . . . 0.565 ' HB ' ' HB ' ' A' ' 62' ' ' THR . 45.9 p -106.88 122.22 45.98 Favored 'General case' 0 C--N 1.345 0.378 0 CA-C-N 118.769 1.285 . . . . 21.0 112.253 179.279 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 78.4 mt -86.64 129.77 37.84 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.174 0 O-C-N 120.037 -1.664 . . . . 14.0 110.829 178.953 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' THR . . . . . 0.557 HG22 HG22 ' A' ' 62' ' ' THR . 43.4 p -99.03 171.81 7.8 Favored 'General case' 0 C--O 1.233 0.195 0 O-C-N 121.713 -0.617 . . . . 13.5 112.195 -179.462 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 25.2 p -62.65 -33.34 74.84 Favored 'General case' 0 C--N 1.341 0.232 0 O-C-N 121.245 -0.909 . . . . 14.7 110.122 172.517 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 56.8 mttp -67.75 -34.77 77.47 Favored 'General case' 0 CA--C 1.509 -0.611 0 CA-C-O 118.186 -0.912 . . . . 25.1 111.977 177.352 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' GLU . . . . . 0.424 ' HB3' ' O ' ' A' ' 19' ' ' PHE . 48.5 mt-10 -73.16 -39.14 65.89 Favored 'General case' 0 C--N 1.341 0.219 0 CA-C-N 119.476 1.034 . . . . 24.9 111.907 178.948 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 32' ' ' LEU . . . . . 0.459 HD13 ' SD ' ' A' ' 51' ' ' MET . 10.3 mt -59.94 -47.14 87.01 Favored 'General case' 0 C--O 1.222 -0.393 0 N-CA-C 109.576 -0.528 . . . . 18.1 109.576 171.925 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -66.52 -44.35 90.25 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 114.641 0.617 . . . . 16.0 114.641 -176.523 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 46.4 m -63.82 -32.74 74.35 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 124.96 1.304 . . . . 17.3 111.229 -178.013 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' VAL . . . . . 0.602 HG22 ' HE2' ' A' ' 21' ' ' LYS . 92.3 t -72.95 -48.27 45.26 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 C-N-CA 123.214 0.606 . . . . 19.6 110.947 179.62 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 36' ' ' MET . . . . . 0.441 ' SD ' ' HG3' ' A' ' 43' ' ' PRO . 70.0 mtm -60.96 -38.18 85.02 Favored 'General case' 0 C--N 1.341 0.223 0 O-C-N 120.854 -1.154 . . . . 25.2 111.798 177.224 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ARG . . . . . 0.505 ' HD3' ' O ' ' A' ' 536' ' ' HOH . 78.9 mtm-85 -72.19 -25.62 61.74 Favored 'General case' 0 C--N 1.343 0.317 0 CA-C-N 118.994 0.816 . . . . 27.8 112.776 176.629 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 83.6 p -78.19 -14.37 59.48 Favored 'General case' 0 C--N 1.352 0.71 0 CA-C-N 118.9 0.773 . . . . 31.2 111.371 175.344 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 90.0 mt -93.4 -7.73 43.79 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-O 121.603 0.715 . . . . 35.8 109.984 174.347 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 105.3 0.69 40.94 Favored Glycine 0 C--N 1.344 1.003 0 N-CA-C 116.555 1.382 . . . . 36.0 116.555 175.3 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' GLN . . . . . 0.473 ' HG3' ' HD3' ' A' ' 43' ' ' PRO . 26.5 tp60 -92.09 171.2 9.25 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 108.677 -0.861 . . . . 42.5 108.677 178.554 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -138.87 69.67 43.2 Favored Pre-proline 0 N--CA 1.449 -0.511 0 O-C-N 121.003 -1.06 . . . . 54.2 111.906 177.73 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 43' ' ' PRO . . . . . 0.473 ' HD3' ' HG3' ' A' ' 41' ' ' GLN . 62.5 Cg_endo -76.57 119.58 5.25 Favored 'Trans proline' 0 N--CA 1.449 -1.089 0 C-N-CA 123.665 2.91 . . . . 44.3 113.937 176.463 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 4.3 p -72.09 154.73 40.93 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.095 -1.411 . . . . 47.1 109.533 175.224 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.05 -29.51 65.44 Favored 'General case' 0 C--N 1.342 0.281 0 N-CA-C 114.654 1.353 . . . . 49.7 114.654 179.97 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.91 -47.83 67.67 Favored 'General case' 0 C--N 1.347 0.465 0 C-N-CA 123.89 0.876 . . . . 45.1 110.77 178.748 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -62.2 -37.67 86.21 Favored 'General case' 0 C--N 1.343 0.301 0 N-CA-C 114.475 1.287 . . . . 44.1 114.475 178.008 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 22.6 mt -66.74 -40.55 88.39 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 107.726 -1.212 . . . . 39.9 107.726 173.26 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.6 tp-100 -71.18 -36.15 71.87 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 114.209 -1.359 . . . . 49.9 111.897 177.929 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 83.5 m-20 -72.56 -16.32 61.75 Favored 'General case' 0 C--N 1.35 0.624 0 CA-C-N 118.612 0.642 . . . . 40.7 110.365 174.471 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' MET . . . . . 0.459 ' SD ' HD13 ' A' ' 32' ' ' LEU . 17.4 mtt -84.79 -46.81 11.02 Favored 'General case' 0 C--N 1.348 0.536 0 N-CA-C 116.251 1.945 . . . . 43.9 116.251 179.473 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ILE . . . . . 0.528 HG23 HG13 ' A' ' 63' ' ' ILE . 26.8 mm -67.58 -35.68 73.82 Favored 'Isoleucine or valine' 0 C--N 1.345 0.406 0 N-CA-C 114.628 1.344 . . . . 39.9 114.628 -179.444 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ASN . . . . . 0.512 ' HA ' ' HB2' ' A' ' 56' ' ' ASP . 0.3 OUTLIER -53.26 -30.02 36.11 Favored 'General case' 0 C--N 1.344 0.333 0 N-CA-C 116.688 2.107 . . . . 43.7 116.688 -179.914 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -63.29 -53.42 53.12 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 114.872 -1.058 . . . . 49.5 109.471 175.213 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' VAL . . . . . 0.564 HG11 ' HB2' ' A' ' 71' ' ' MET . 0.7 OUTLIER -93.23 12.98 2.64 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 CA-C-N 115.065 -0.97 . . . . 51.4 110.667 -178.932 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ASP . . . . . 0.512 ' HB2' ' HA ' ' A' ' 53' ' ' ASN . 38.5 t0 -67.31 -22.2 65.64 Favored 'General case' 0 C--N 1.347 0.467 0 CA-C-O 115.489 -2.196 . . . . 49.9 114.854 -174.446 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . 25.41 -69.84 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 122.255 2.298 . . . . 47.8 115.001 -175.438 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -80.73 13.81 2.43 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 118.03 2.604 . . . . 45.8 118.03 -176.628 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 78.8 -25.78 2.48 Favored Glycine 0 C--N 1.339 0.723 0 N-CA-C 109.428 -1.469 . . . . 42.0 109.428 -174.989 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -48.24 -37.24 15.62 Favored 'General case' 0 CA--C 1.535 0.403 1 N-CA-C 122.279 4.178 . . . . 38.7 122.279 178.869 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 61' ' ' GLY . . . . . 0.508 ' O ' HG21 ' A' ' 52' ' ' ILE . . . 115.65 -12.13 18.36 Favored Glycine 0 CA--C 1.529 0.963 0 N-CA-C 118.822 2.289 . . . . 29.5 118.822 174.604 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 62' ' ' THR . . . . . 0.565 ' HB ' ' HB ' ' A' ' 26' ' ' THR . 61.4 p -118.08 169.69 9.47 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 120.907 2.353 . . . . 24.2 110.724 179.518 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 63' ' ' ILE . . . . . 0.528 HG13 HG23 ' A' ' 52' ' ' ILE . 8.0 mt -109.13 141.89 23.16 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.406 0 CA-C-O 123.049 1.404 . . . . 22.7 111.994 179.117 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 8.3 p30 -117.95 177.44 4.78 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 112.534 -2.121 . . . . 24.1 109.599 176.085 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' PHE . . . . . 0.403 ' O ' HD12 ' A' ' 69' ' ' LEU . 59.8 t80 -70.18 -43.15 18.03 Favored Pre-proline 0 C--N 1.346 0.421 0 CA-C-O 114.43 -2.7 . . . . 27.1 116.076 -177.97 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_exo -46.57 -38.09 21.18 Favored 'Trans proline' 0 C--N 1.355 0.907 0 C-N-CA 124.733 3.622 . . . . 25.7 114.323 170.08 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLU . . . . . 0.466 ' OE1' ' HA ' ' A' ' 63' ' ' ILE . 76.3 mt-10 -72.25 -42.65 65.4 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 114.513 1.301 . . . . 24.9 114.513 178.253 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 53.1 t80 -60.1 -29.52 68.65 Favored 'General case' 0 C--O 1.222 -0.375 0 O-C-N 124.425 1.078 . . . . 26.4 108.799 178.399 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' LEU . . . . . 0.403 HD12 ' O ' ' A' ' 65' ' ' PHE . 56.9 tp -76.14 -39.67 54.51 Favored 'General case' 0 N--CA 1.444 -0.743 0 C-N-CA 125.086 1.354 . . . . 24.3 111.097 178.916 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.1 m -63.38 -44.27 95.24 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 119.378 0.99 . . . . 35.5 110.482 179.958 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' MET . . . . . 0.564 ' HB2' HG11 ' A' ' 55' ' ' VAL . 19.1 tmm? -52.54 -52.07 56.56 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 123.871 0.868 . . . . 47.1 111.385 179.45 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 30.2 mmm -66.87 -30.9 71.19 Favored 'General case' 0 C--N 1.342 0.256 0 N-CA-C 114.907 1.447 . . . . 45.8 114.907 -178.347 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.08 -30.96 68.32 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 108.391 -0.966 . . . . 50.3 108.391 175.455 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -84.33 150.99 25.02 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 124.657 2.17 . . . . 61.8 109.014 178.279 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 75' ' ' LYS . . . . . 0.401 ' HG2' ' O ' ' A' ' 521' ' ' HOH . 39.5 mttp -110.48 141.68 43.27 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 111.066 -2.788 . . . . 57.1 109.738 -179.874 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -118.29 120.5 37.83 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 108.631 -0.877 . . . . 60.3 108.631 169.972 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . . . -70.91 170.83 11.85 Favored 'General case' 0 N--CA 1.464 0.233 0 O-C-N 120.961 -1.087 . . . . 59.9 113.139 179.295 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' ASP . . . . . 0.461 ' HA ' ' HA ' ' A' ' 82' ' ' GLU . 6.4 p-10 -67.92 100.05 0.92 Allowed 'General case' 0 C--O 1.232 0.181 0 N-CA-C 115.289 1.588 . . . . 63.6 115.289 -179.179 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 45.3 p -60.19 -82.19 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 114.663 -1.153 . . . . 58.9 108.245 176.484 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -78.17 -40.18 38.61 Favored 'General case' 0 C--O 1.239 0.545 0 CA-C-N 122.682 2.492 . . . . 60.4 114.646 179.356 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 7.1 t -130.93 147.16 52.53 Favored 'General case' 0 N--CA 1.452 -0.35 0 O-C-N 121.214 -0.929 . . . . 63.0 111.703 -179.106 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' GLU . . . . . 0.461 ' HA ' ' HA ' ' A' ' 78' ' ' ASP . 1.5 tm-20 -59.48 -46.02 90.0 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 122.905 0.482 . . . . 61.3 111.734 177.343 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.37 76.42 6.72 Favored 'General case' 0 C--N 1.344 0.337 0 CA-C-O 123.751 1.739 . . . . 58.2 114.41 -178.694 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 48.3 tt0 -76.0 -22.4 55.87 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 113.364 -1.744 . . . . 53.7 112.881 179.32 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 84.1 mt -62.94 -36.81 77.3 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 CA-C-O 117.917 -1.04 . . . . 49.8 110.301 177.096 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 16.5 tpp180 -62.75 -40.36 97.0 Favored 'General case' 0 C--N 1.347 0.487 0 CA-C-N 120.814 1.643 . . . . 46.3 110.239 174.98 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' GLU . . . . . 0.481 ' O ' HG23 ' A' ' 91' ' ' VAL . 29.5 mt-10 -67.69 -36.66 81.07 Favored 'General case' 0 C--N 1.344 0.352 0 CA-C-N 118.833 0.742 . . . . 39.9 112.128 -179.971 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.2 -33.06 73.74 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 123.628 0.58 . . . . 33.5 110.326 178.886 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -70.76 -32.88 70.18 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 123.472 0.709 . . . . 28.9 111.776 177.759 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 1.1 mtp180 -72.28 -13.95 61.64 Favored 'General case' 0 N--CA 1.449 -0.524 0 O-C-N 125.067 1.48 . . . . 46.7 110.311 178.216 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' VAL . . . . . 0.481 HG23 ' O ' ' A' ' 87' ' ' GLU . 47.4 t -74.93 -36.16 38.04 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 N-CA-C 109.607 -0.516 . . . . 30.4 109.607 178.703 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 92' ' ' PHE . . . . . 0.562 ' HA ' HG21 ' A' ' 108' ' ' VAL . 39.0 m-85 -84.36 -42.74 15.43 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 119.36 0.982 . . . . 27.2 113.475 178.897 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -86.74 74.31 9.84 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 125.451 1.5 . . . . 26.0 111.916 177.93 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' LYS . . . . . 0.515 ' HE3' ' HG2' ' A' ' 104' ' ' GLU . 8.9 mtmp? -63.3 -14.7 52.53 Favored 'General case' 0 CA--C 1.507 -0.706 0 C-N-CA 123.997 0.919 . . . . 45.9 109.968 -174.142 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -111.23 1.45 17.2 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 101.548 -3.501 . . . . 40.3 101.548 172.341 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 72.38 11.83 76.37 Favored Glycine 0 N--CA 1.447 -0.592 0 CA-C-N 111.872 -2.422 . . . . 29.9 115.669 -177.125 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 32.3 p-10 -76.97 0.41 21.23 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 119.059 1.429 . . . . 26.4 109.792 176.589 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 84.56 13.38 73.2 Favored Glycine 0 C--N 1.345 1.069 0 CA-C-O 119.265 -0.742 . . . . 21.8 113.707 179.308 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 69.4 m-85 -144.22 138.51 28.09 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-N 120.617 2.209 . . . . 20.9 111.289 -178.522 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' ILE . . . . . 0.44 ' HB ' ' HB ' ' A' ' 136' ' ' VAL . 42.2 mt -99.13 126.0 52.5 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.231 0 N-CA-C 107.38 -1.341 . . . . 11.1 107.38 174.623 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 97.7 p -95.26 164.89 12.66 Favored 'General case' 0 C--O 1.237 0.434 0 N-CA-C 107.768 -1.197 . . . . 16.3 107.768 176.994 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' ALA . . . . . 0.43 ' O ' HG11 ' A' ' 121' ' ' VAL . . . -56.88 -34.46 67.9 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-O 121.14 0.495 . . . . 20.7 110.131 -179.269 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -69.15 -45.02 71.1 Favored 'General case' 0 N--CA 1.45 -0.446 0 O-C-N 126.253 2.221 . . . . 23.8 112.635 178.237 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' GLU . . . . . 0.515 ' HG2' ' HE3' ' A' ' 94' ' ' LYS . 38.3 mt-10 -63.68 -38.77 92.38 Favored 'General case' 0 CA--C 1.514 -0.409 0 N-CA-C 113.601 0.963 . . . . 25.1 113.601 178.434 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 105' ' ' LEU . . . . . 0.434 ' O ' ' HG2' ' A' ' 109' ' ' MET . 28.9 tp -67.65 -40.62 84.52 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 108.803 -0.814 . . . . 25.2 108.803 176.402 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 39.7 ttm180 -65.87 -26.71 67.76 Favored 'General case' 0 CA--C 1.529 0.154 0 CA-C-O 118.42 -0.8 . . . . 42.5 109.578 175.67 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 40.5 m80 -72.99 -38.63 66.56 Favored 'General case' 0 C--N 1.35 0.627 0 CA-C-N 119.581 1.082 . . . . 41.6 110.415 176.497 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' VAL . . . . . 0.562 HG21 ' HA ' ' A' ' 92' ' ' PHE . 39.9 t -70.03 -38.29 74.78 Favored 'Isoleucine or valine' 0 C--N 1.345 0.404 0 N-CA-C 113.196 0.813 . . . . 34.3 113.196 -179.536 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 109' ' ' MET . . . . . 0.434 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 2.8 mmt -71.78 -34.72 69.65 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-O 118.747 -0.644 . . . . 36.0 112.459 -176.921 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 90.6 m -62.09 -45.32 94.0 Favored 'General case' 0 C--N 1.342 0.258 0 CA-C-N 119.384 0.993 . . . . 35.3 110.289 179.275 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 4.7 t30 -75.86 -30.68 58.98 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 118.887 0.767 . . . . 47.1 111.135 176.441 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' LEU . . . . . 0.41 ' HA ' ' O ' ' A' ' 540' ' ' HOH . 88.2 mt -75.63 -3.03 32.2 Favored 'General case' 0 C--N 1.345 0.386 0 C-N-CA 122.928 0.491 . . . . 44.5 111.938 174.739 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 91.38 68.5 1.17 Allowed Glycine 0 C--N 1.338 0.656 0 N-CA-C 116.011 1.164 . . . . 47.6 116.011 176.255 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 -145.61 155.91 43.33 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 116.119 1.896 . . . . 60.9 116.119 -178.976 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . . . -133.47 93.37 3.13 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 104.892 -2.262 . . . . 49.2 104.892 174.704 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -115.09 144.57 43.44 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 115.2 1.556 . . . . 46.7 115.2 -178.441 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 11.3 m -79.81 158.09 26.88 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 123.547 0.739 . . . . 49.5 111.606 -177.951 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' ASP . . . . . 0.476 ' O ' ' HB2' ' A' ' 122' ' ' ASP . 9.6 m-20 -60.89 -33.52 73.24 Favored 'General case' 0 C--N 1.344 0.329 0 CA-C-O 121.826 0.822 . . . . 47.8 110.876 176.7 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -70.46 -33.78 71.67 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 113.898 -1.501 . . . . 45.3 110.175 173.811 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 85.5 mt-10 -69.36 -36.8 77.21 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.866 -0.607 . . . . 38.6 112.507 178.236 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' VAL . . . . . 0.439 ' HA ' ' HE3' ' A' ' 124' ' ' MET . 94.1 t -72.42 -37.33 57.37 Favored 'Isoleucine or valine' 0 C--N 1.349 0.546 0 N-CA-C 109.293 -0.632 . . . . 32.3 109.293 178.69 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 122' ' ' ASP . . . . . 0.476 ' HB2' ' O ' ' A' ' 118' ' ' ASP . 0.3 OUTLIER -61.46 -36.84 81.55 Favored 'General case' 0 N--CA 1.444 -0.772 0 C-N-CA 119.099 -1.04 . . . . 36.4 113.449 178.752 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 123' ' ' GLU . . . . . 0.543 ' HG2' HH21 ' A' ' 126' ' ' ARG . 20.7 tt0 -71.54 -38.8 71.0 Favored 'General case' 0 C--N 1.344 0.367 0 N-CA-C 107.157 -1.423 . . . . 35.5 107.157 177.876 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 124' ' ' MET . . . . . 0.439 ' HE3' ' HA ' ' A' ' 121' ' ' VAL . 55.4 mtm -60.07 -39.46 86.11 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 113.37 0.878 . . . . 31.1 113.37 177.895 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 21.2 mm -63.92 -49.03 83.52 Favored 'Isoleucine or valine' 0 C--N 1.345 0.41 0 CA-C-N 118.247 0.476 . . . . 27.8 109.749 177.964 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' ARG . . . . . 0.543 HH21 ' HG2' ' A' ' 123' ' ' GLU . 45.3 mtt180 -57.93 -43.22 86.15 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 114.19 1.182 . . . . 47.5 114.19 -179.455 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 127' ' ' GLU . . . . . 0.529 ' HG2' ' O ' ' A' ' 123' ' ' GLU . 69.3 mm-40 -69.03 -19.31 64.1 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 108.669 -0.863 . . . . 32.0 108.669 175.897 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 128' ' ' ALA . . . . . 0.752 ' HB2' HD21 ' B' ' 299' ' ' LEU . . . -96.0 -20.33 18.79 Favored 'General case' 0 C--N 1.346 0.431 0 N-CA-C 117.236 2.31 . . . . 21.4 117.236 -178.26 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 43.8 t0 -84.56 130.63 34.72 Favored 'General case' 0 CA--C 1.535 0.376 0 O-C-N 121.647 -0.658 . . . . 19.9 112.29 -178.925 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' ILE . . . . . 0.569 HD11 ' HG2' ' A' ' 143' ' ' GLN . 70.6 mt -107.4 -49.06 8.11 Favored 'Isoleucine or valine' 0 C--N 1.343 0.305 0 O-C-N 120.887 -1.133 . . . . 18.8 113.906 -179.252 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 57.7 p30 -80.82 -20.77 41.73 Favored 'General case' 0 C--N 1.344 0.353 0 N-CA-C 115.641 1.719 . . . . 17.9 115.641 -174.867 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 85.38 30.61 24.38 Favored Glycine 0 C--N 1.343 0.954 0 CA-C-O 118.932 -0.927 . . . . 18.9 114.446 177.905 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 33.0 p-10 -93.84 5.05 52.93 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 120.63 2.215 . . . . 23.1 114.529 -179.92 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 79.89 10.14 85.98 Favored Glycine 0 C--N 1.342 0.867 0 C-N-CA 123.774 0.702 . . . . 19.7 114.733 175.859 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -130.7 176.38 8.24 Favored 'General case' 0 CA--C 1.516 -0.355 0 N-CA-C 107.319 -1.363 . . . . 20.3 107.319 -177.854 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 136' ' ' VAL . . . . . 0.44 ' HB ' ' HB ' ' A' ' 100' ' ' ILE . 97.6 t -120.88 106.24 18.22 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 CA-C-N 119.575 1.08 . . . . 16.8 109.049 179.009 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 -82.97 -172.9 4.39 Favored 'General case' 0 C--O 1.234 0.276 0 O-C-N 121.242 -0.911 . . . . 19.3 112.378 175.275 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 69.3 t80 -68.93 -40.86 78.76 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 114.823 1.416 . . . . 29.7 114.823 -178.556 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 31.0 mp0 -61.39 -40.53 94.7 Favored 'General case' 0 N--CA 1.45 -0.451 0 O-C-N 121.693 -0.629 . . . . 36.5 112.659 -176.545 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 140' ' ' GLU . . . . . 0.486 ' HG2' ' HB ' ' A' ' 130' ' ' ILE . 30.6 mt-10 -74.71 -28.46 60.81 Favored 'General case' 0 CA--C 1.515 -0.376 0 C-N-CA 123.901 0.881 . . . . 30.0 111.933 175.324 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 61.8 t80 -68.77 -42.98 76.68 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.525 0.73 . . . . 25.0 110.442 175.2 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 55.6 t -65.65 -43.54 93.8 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.449 0 N-CA-C 107.957 -1.127 . . . . 27.7 107.957 178.959 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 143' ' ' GLN . . . . . 0.569 ' HG2' HD11 ' A' ' 130' ' ' ILE . 0.8 OUTLIER -54.92 -49.91 70.13 Favored 'General case' 0 N--CA 1.442 -0.865 0 N-CA-C 113.261 0.837 . . . . 37.0 113.261 -176.674 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 144' ' ' MET . . . . . 0.586 ' SD ' ' HG ' ' B' ' 299' ' ' LEU . 21.7 ttp -58.11 -31.94 67.63 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 119.556 1.071 . . . . 35.6 109.947 178.932 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 68.4 mmm -96.13 -17.54 20.8 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 115.529 -0.759 . . . . 43.6 110.999 172.936 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 77.3 p . . . . . 0 C--N 1.34 0.152 0 CA-C-O 117.828 -1.082 . . . . 47.8 112.283 -178.187 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 293' ' ' PHE . . . . . . . . . . . . . 44.7 t80 . . . . . 0 C--O 1.234 0.243 0 CA-C-O 122.139 0.971 . . . . 57.2 111.795 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 294' ' ' ASN . . . . . 0.539 HD21 HH21 ' B' ' 297' ' ' ARG . 18.8 t-20 -121.12 101.88 7.95 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 105.172 -2.159 . . . . 48.0 105.172 176.077 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 295' ' ' ALA . . . . . . . . . . . . . . . -75.36 -32.57 60.89 Favored 'General case' 0 CA--C 1.517 -0.313 0 N-CA-C 116.573 2.064 . . . . 40.2 116.573 -177.833 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 296' ' ' ARG . . . . . . . . . . . . . 7.0 ttm-85 -76.36 -11.08 59.84 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 118.456 0.571 . . . . 48.7 112.201 -179.773 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 297' ' ' ARG . . . . . 0.539 HH21 HD21 ' B' ' 294' ' ' ASN . 0.6 OUTLIER -79.12 -42.07 27.12 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 116.157 1.91 . . . . 46.9 116.157 179.188 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 298' ' ' LYS . . . . . 0.437 ' HA ' ' HG2' ' A' ' 14' ' ' GLU . 22.0 mmtm -70.46 -32.19 69.64 Favored 'General case' 0 C--O 1.222 -0.354 0 N-CA-C 108.181 -1.044 . . . . 32.5 108.181 170.719 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 299' ' ' LEU . . . . . 0.752 HD21 ' HB2' ' A' ' 128' ' ' ALA . 48.7 tp -71.89 -52.99 14.58 Favored 'General case' 0 N--CA 1.464 0.252 0 C-N-CA 123.64 0.776 . . . . 29.1 113.059 177.691 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 300' ' ' LYS . . . . . 0.571 ' HE2' ' O ' ' A' ' 144' ' ' MET . 34.3 mttm -66.21 -25.03 66.73 Favored 'General case' 0 C--N 1.348 0.524 0 CA-C-O 117.99 -1.005 . . . . 38.4 112.959 176.633 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 301' ' ' GLY . . . . . . . . . . . . . . . -77.41 -40.56 23.12 Favored Glycine 0 C--N 1.343 0.935 0 O-C-N 123.864 0.728 . . . . 26.0 112.745 179.84 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 302' ' ' ALA . . . . . . . . . . . . . . . -71.46 -32.05 67.86 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-O 118.588 -0.72 . . . . 25.6 111.224 177.57 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 303' ' ' ILE . . . . . 0.416 ' O ' ' HG3' ' B' ' 307' ' ' MET . 61.3 mt -66.19 -47.28 85.12 Favored 'Isoleucine or valine' 0 C--N 1.351 0.633 0 CA-C-N 120.146 1.339 . . . . 25.0 110.47 176.673 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 304' ' ' LEU . . . . . 0.409 ' HB2' ' O ' ' B' ' 300' ' ' LYS . 0.4 OUTLIER -61.33 -38.0 85.31 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-O 117.546 -1.216 . . . . 23.7 112.384 177.538 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 305' ' ' THR . . . . . . . . . . . . . 23.7 m -59.85 -40.97 90.35 Favored 'General case' 0 C--N 1.348 0.541 0 CA-C-N 120.32 1.418 . . . . 22.9 110.36 177.469 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 306' ' ' THR . . . . . . . . . . . . . 44.8 m -75.24 -31.12 60.73 Favored 'General case' 0 C--N 1.349 0.563 0 C-N-CA 123.453 0.701 . . . . 26.3 109.782 176.681 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 307' ' ' MET . . . . . 0.416 ' HG3' ' O ' ' B' ' 303' ' ' ILE . 73.4 mtp -62.31 -46.19 89.84 Favored 'General case' 0 C--N 1.345 0.386 0 N-CA-C 112.863 0.69 . . . . 30.9 112.863 176.615 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 308' ' ' LEU . . . . . . . . . . . . . 44.6 mt -65.91 -43.16 88.98 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 121.187 0.517 . . . . 20.6 109.671 177.99 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 309' ' ' ALA . . . . . . . . . . . . . . . -74.49 -19.4 60.39 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 113.354 0.872 . . . . 26.2 113.354 177.18 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 310' ' ' THR . . . . . . . . . . . . . 26.2 m . . . . . 0 C--N 1.347 0.463 0 C-N-CA 123.717 0.807 . . . . 31.7 112.796 179.139 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 401' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 402' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 403' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 404' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 405' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 406' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 407' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 408' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 409' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 410' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 411' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 412' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 413' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 414' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 415' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 416' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 417' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 507' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 508' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 509' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 511' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 512' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 513' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 514' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 515' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 516' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 517' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 518' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 519' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 520' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 521' ' ' HOH . . . . . 0.401 ' O ' ' HG2' ' A' ' 75' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 522' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 523' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 524' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 525' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 526' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 527' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 528' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 529' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 530' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 531' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 532' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 533' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 534' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 535' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 536' ' ' HOH . . . . . 0.505 ' O ' ' HD3' ' A' ' 37' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 537' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 538' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 539' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 540' ' ' HOH . . . . . 0.41 ' O ' ' HA ' ' A' ' 112' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 541' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 542' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 543' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 544' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 545' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 546' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 547' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 548' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 549' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 550' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 551' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 552' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 553' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 554' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 401' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 402' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 403' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 404' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.6 tp . . . . . 0 N--CA 1.448 -0.534 0 CA-C-O 121.012 0.434 . . . . 51.1 109.906 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 10.7 p -67.71 157.24 35.08 Favored 'General case' 0 N--CA 1.462 0.131 0 C-N-CA 123.383 0.673 . . . . 48.6 112.476 179.342 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -63.32 -38.53 91.53 Favored 'General case' 0 C--N 1.349 0.545 0 C-N-CA 123.909 0.883 . . . . 46.6 112.594 -179.004 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.499 ' HB2' ' NH2' ' B' ' 297' ' ' ARG . 0.0 OUTLIER -74.66 -23.98 58.74 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 114.131 -1.395 . . . . 43.8 113.931 178.053 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 43.2 mt-30 -73.61 -35.06 65.32 Favored 'General case' 0 C--N 1.345 0.373 0 CA-C-N 118.455 0.571 . . . . 41.6 111.806 178.651 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 78.4 mt -66.84 -31.53 53.9 Favored 'Isoleucine or valine' 0 C--N 1.343 0.287 0 N-CA-C 108.335 -0.987 . . . . 33.9 108.335 176.902 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.36 -31.63 65.77 Favored 'General case' 0 C--N 1.348 0.527 0 N-CA-C 115.186 1.551 . . . . 31.7 115.186 179.085 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -67.25 -39.87 86.19 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 119.438 1.017 . . . . 30.9 109.172 174.904 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 20.4 m-30 -74.91 -24.41 58.51 Favored 'General case' 0 C--N 1.347 0.485 0 N-CA-C 116.081 1.882 . . . . 34.9 116.081 -176.747 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 16.5 mtmm -74.84 -27.86 60.45 Favored 'General case' 0 C--N 1.349 0.566 0 N-CA-C 108.201 -1.037 . . . . 40.5 108.201 176.933 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.437 ' HG2' ' HA ' ' B' ' 298' ' ' LYS . 21.8 tp10 -77.53 -42.53 35.12 Favored 'General case' 0 N--CA 1.448 -0.574 0 O-C-N 124.559 1.162 . . . . 41.0 113.293 178.773 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.08 -35.36 80.3 Favored 'General case' 0 C--N 1.341 0.225 0 O-C-N 121.507 -0.745 . . . . 32.9 112.033 175.693 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.411 ' HZ ' ' O ' ' A' ' 25' ' ' GLY . 70.4 t80 -61.82 -42.87 99.57 Favored 'General case' 0 C--N 1.344 0.348 0 N-CA-C 109.196 -0.668 . . . . 30.0 109.196 175.317 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 51.7 m -64.55 -22.2 66.9 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 117.393 2.368 . . . . 35.5 117.393 -178.307 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 83.0 mt -88.2 -43.05 11.89 Favored 'General case' 0 C--N 1.346 0.45 0 N-CA-C 114.227 1.195 . . . . 28.7 114.227 -179.857 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.424 ' O ' ' HB3' ' A' ' 31' ' ' GLU . 71.0 m-85 -67.38 -42.61 83.12 Favored 'General case' 0 C--N 1.343 0.324 0 CA-C-O 122.084 0.945 . . . . 24.6 112.705 176.009 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -78.02 85.28 4.25 Favored 'General case' 0 N--CA 1.456 -0.156 0 N-CA-C 119.856 3.28 . . . . 35.5 119.856 -173.439 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.602 ' HE2' HG22 ' A' ' 35' ' ' VAL . 73.4 mmtt -58.9 -62.02 2.19 Favored 'General case' 0 N--CA 1.465 0.278 1 N-CA-C 124.751 5.093 . . . . 42.0 124.751 177.64 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 23.3 p-10 -83.16 113.02 20.36 Favored 'General case' 0 C--N 1.348 0.531 0 N-CA-C 114.716 1.376 . . . . 45.5 114.716 -179.573 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -64.42 82.63 0.06 OUTLIER Glycine 0 N--CA 1.44 -1.087 0 N-CA-C 106.55 -2.62 . . . . 39.0 106.55 -173.758 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -125.34 10.36 7.98 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 120.082 3.364 . . . . 33.6 120.082 -178.265 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.411 ' O ' ' HZ ' ' A' ' 16' ' ' PHE . . . 85.46 -28.61 4.72 Favored Glycine 0 C--N 1.347 1.151 0 N-CA-C 117.767 1.867 . . . . 26.3 117.767 174.582 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' THR . . . . . 0.565 ' HB ' ' HB ' ' A' ' 62' ' ' THR . 45.9 p -106.88 122.22 45.98 Favored 'General case' 0 C--N 1.345 0.378 0 CA-C-N 118.769 1.285 . . . . 21.0 112.253 179.279 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 78.4 mt -86.64 129.77 37.84 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.174 0 O-C-N 120.037 -1.664 . . . . 14.0 110.829 178.953 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' THR . . . . . 0.557 HG22 HG22 ' A' ' 62' ' ' THR . 43.4 p -99.03 171.81 7.8 Favored 'General case' 0 C--O 1.233 0.195 0 O-C-N 121.713 -0.617 . . . . 13.5 112.195 -179.462 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 25.2 p -62.65 -33.34 74.84 Favored 'General case' 0 C--N 1.341 0.232 0 O-C-N 121.245 -0.909 . . . . 14.7 110.122 172.517 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 56.8 mttp -67.75 -34.77 77.47 Favored 'General case' 0 CA--C 1.509 -0.611 0 CA-C-O 118.186 -0.912 . . . . 25.1 111.977 177.352 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.424 ' HB3' ' O ' ' A' ' 19' ' ' PHE . 48.5 mt-10 -73.16 -39.14 65.89 Favored 'General case' 0 C--N 1.341 0.219 0 CA-C-N 119.476 1.034 . . . . 24.9 111.907 178.948 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.459 HD13 ' SD ' ' A' ' 51' ' ' MET . 10.3 mt -59.94 -47.14 87.01 Favored 'General case' 0 C--O 1.222 -0.393 0 N-CA-C 109.576 -0.528 . . . . 18.1 109.576 171.925 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -66.52 -44.35 90.25 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 114.641 0.617 . . . . 16.0 114.641 -176.523 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 46.4 m -63.82 -32.74 74.35 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 124.96 1.304 . . . . 17.3 111.229 -178.013 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.602 HG22 ' HE2' ' A' ' 21' ' ' LYS . 92.3 t -72.95 -48.27 45.26 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 C-N-CA 123.214 0.606 . . . . 19.6 110.947 179.62 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' MET . . . . . 0.441 ' SD ' ' HG3' ' A' ' 43' ' ' PRO . 70.0 mtm -60.96 -38.18 85.02 Favored 'General case' 0 C--N 1.341 0.223 0 O-C-N 120.854 -1.154 . . . . 25.2 111.798 177.224 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.505 ' HD3' ' O ' ' A' ' 536' ' ' HOH . 78.9 mtm-85 -72.19 -25.62 61.74 Favored 'General case' 0 C--N 1.343 0.317 0 CA-C-N 118.994 0.816 . . . . 27.8 112.776 176.629 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 83.6 p -78.19 -14.37 59.48 Favored 'General case' 0 C--N 1.352 0.71 0 CA-C-N 118.9 0.773 . . . . 31.2 111.371 175.344 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 90.0 mt -93.4 -7.73 43.79 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-O 121.603 0.715 . . . . 35.8 109.984 174.347 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 105.3 0.69 40.94 Favored Glycine 0 C--N 1.344 1.003 0 N-CA-C 116.555 1.382 . . . . 36.0 116.555 175.3 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.473 ' HG3' ' HD3' ' A' ' 43' ' ' PRO . 26.5 tp60 -92.09 171.2 9.25 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 108.677 -0.861 . . . . 42.5 108.677 178.554 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -138.87 69.67 43.2 Favored Pre-proline 0 N--CA 1.449 -0.511 0 O-C-N 121.003 -1.06 . . . . 54.2 111.906 177.73 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.473 ' HD3' ' HG3' ' A' ' 41' ' ' GLN . 62.5 Cg_endo -76.57 119.58 5.25 Favored 'Trans proline' 0 N--CA 1.449 -1.089 0 C-N-CA 123.665 2.91 . . . . 44.3 113.937 176.463 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 4.3 p -72.09 154.73 40.93 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.095 -1.411 . . . . 47.1 109.533 175.224 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.05 -29.51 65.44 Favored 'General case' 0 C--N 1.342 0.281 0 N-CA-C 114.654 1.353 . . . . 49.7 114.654 179.97 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.91 -47.83 67.67 Favored 'General case' 0 C--N 1.347 0.465 0 C-N-CA 123.89 0.876 . . . . 45.1 110.77 178.748 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -62.2 -37.67 86.21 Favored 'General case' 0 C--N 1.343 0.301 0 N-CA-C 114.475 1.287 . . . . 44.1 114.475 178.008 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 22.6 mt -66.74 -40.55 88.39 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 107.726 -1.212 . . . . 39.9 107.726 173.26 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.2 tp60 -71.18 -36.15 71.87 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 114.209 -1.359 . . . . 49.9 111.897 177.929 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 83.5 m-20 -72.56 -16.32 61.75 Favored 'General case' 0 C--N 1.35 0.624 0 CA-C-N 118.612 0.642 . . . . 40.7 110.365 174.471 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' MET . . . . . 0.459 ' SD ' HD13 ' A' ' 32' ' ' LEU . 17.4 mtt -84.79 -46.81 11.02 Favored 'General case' 0 C--N 1.348 0.536 0 N-CA-C 116.251 1.945 . . . . 43.9 116.251 179.473 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.528 HG23 HG13 ' A' ' 63' ' ' ILE . 26.8 mm -67.58 -35.68 73.82 Favored 'Isoleucine or valine' 0 C--N 1.345 0.406 0 N-CA-C 114.628 1.344 . . . . 39.9 114.628 -179.444 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.512 ' HA ' ' HB2' ' A' ' 56' ' ' ASP . 0.3 OUTLIER -53.26 -30.02 36.11 Favored 'General case' 0 C--N 1.344 0.333 0 N-CA-C 116.688 2.107 . . . . 43.7 116.688 -179.914 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -63.29 -53.42 53.12 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 114.872 -1.058 . . . . 49.5 109.471 175.213 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.564 HG11 ' HB2' ' A' ' 71' ' ' MET . 0.7 OUTLIER -93.23 12.98 2.64 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 CA-C-N 115.065 -0.97 . . . . 51.4 110.667 -178.932 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.512 ' HB2' ' HA ' ' A' ' 53' ' ' ASN . 38.5 t0 -67.31 -22.2 65.64 Favored 'General case' 0 C--N 1.347 0.467 0 CA-C-O 115.489 -2.196 . . . . 49.9 114.854 -174.446 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . 25.41 -69.84 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 122.255 2.298 . . . . 47.8 115.001 -175.438 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -80.73 13.81 2.43 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 118.03 2.604 . . . . 45.8 118.03 -176.628 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 78.8 -25.78 2.48 Favored Glycine 0 C--N 1.339 0.723 0 N-CA-C 109.428 -1.469 . . . . 42.0 109.428 -174.989 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -48.24 -37.24 15.62 Favored 'General case' 0 CA--C 1.535 0.403 1 N-CA-C 122.279 4.178 . . . . 38.7 122.279 178.869 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' GLY . . . . . 0.508 ' O ' HG21 ' A' ' 52' ' ' ILE . . . 115.65 -12.13 18.36 Favored Glycine 0 CA--C 1.529 0.963 0 N-CA-C 118.822 2.289 . . . . 29.5 118.822 174.604 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' THR . . . . . 0.565 ' HB ' ' HB ' ' A' ' 26' ' ' THR . 61.4 p -118.08 169.69 9.47 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-N 120.907 2.353 . . . . 24.2 110.724 179.518 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.528 HG13 HG23 ' A' ' 52' ' ' ILE . 8.0 mt -109.13 141.89 23.16 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.406 0 CA-C-O 123.049 1.404 . . . . 22.7 111.994 179.117 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 8.3 p30 -117.95 177.44 4.78 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 112.534 -2.121 . . . . 24.1 109.599 176.085 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.403 ' O ' HD12 ' A' ' 69' ' ' LEU . 59.8 t80 -70.18 -43.15 18.03 Favored Pre-proline 0 C--N 1.346 0.421 0 CA-C-O 114.43 -2.7 . . . . 27.1 116.076 -177.97 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_exo -46.57 -38.09 21.18 Favored 'Trans proline' 0 C--N 1.355 0.907 0 C-N-CA 124.733 3.622 . . . . 25.7 114.323 170.08 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.466 ' OE1' ' HA ' ' A' ' 63' ' ' ILE . 76.3 mt-10 -72.25 -42.65 65.4 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 114.513 1.301 . . . . 24.9 114.513 178.253 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 53.1 t80 -60.1 -29.52 68.65 Favored 'General case' 0 C--O 1.222 -0.375 0 O-C-N 124.425 1.078 . . . . 26.4 108.799 178.399 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.403 HD12 ' O ' ' A' ' 65' ' ' PHE . 56.9 tp -76.14 -39.67 54.51 Favored 'General case' 0 N--CA 1.444 -0.743 0 C-N-CA 125.086 1.354 . . . . 24.3 111.097 178.916 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.1 m -63.38 -44.27 95.24 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 119.378 0.99 . . . . 35.5 110.482 179.958 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' MET . . . . . 0.564 ' HB2' HG11 ' A' ' 55' ' ' VAL . 19.1 tmm? -52.54 -52.07 56.56 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 123.871 0.868 . . . . 47.1 111.385 179.45 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 30.2 mmm -66.87 -30.9 71.19 Favored 'General case' 0 C--N 1.342 0.256 0 N-CA-C 114.907 1.447 . . . . 45.8 114.907 -178.347 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.08 -30.96 68.32 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 108.391 -0.966 . . . . 50.3 108.391 175.455 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -84.33 150.99 25.02 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 124.657 2.17 . . . . 61.8 109.014 178.279 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.401 ' HG2' ' O ' ' A' ' 521' ' ' HOH . 39.5 mttp -110.48 141.68 43.27 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 111.066 -2.788 . . . . 57.1 109.738 -179.874 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -118.29 120.5 37.83 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 108.631 -0.877 . . . . 60.3 108.631 169.972 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . . . -70.91 170.83 11.85 Favored 'General case' 0 N--CA 1.464 0.233 0 O-C-N 120.961 -1.087 . . . . 59.9 113.139 179.295 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.461 ' HA ' ' HA ' ' A' ' 82' ' ' GLU . 6.4 p-10 -67.92 100.05 0.92 Allowed 'General case' 0 C--O 1.232 0.181 0 N-CA-C 115.289 1.588 . . . . 63.6 115.289 -179.179 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 45.3 p -60.19 -82.19 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 114.663 -1.153 . . . . 58.9 108.245 176.484 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -78.17 -40.18 38.61 Favored 'General case' 0 C--O 1.239 0.545 0 CA-C-N 122.682 2.492 . . . . 60.4 114.646 179.356 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 7.1 t -130.93 147.16 52.53 Favored 'General case' 0 N--CA 1.452 -0.35 0 O-C-N 121.214 -0.929 . . . . 63.0 111.703 -179.106 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.461 ' HA ' ' HA ' ' A' ' 78' ' ' ASP . 1.5 tm-20 -59.48 -46.02 90.0 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 122.905 0.482 . . . . 61.3 111.734 177.343 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.37 76.42 6.72 Favored 'General case' 0 C--N 1.344 0.337 0 CA-C-O 123.751 1.739 . . . . 58.2 114.41 -178.694 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 48.3 tt0 -76.0 -22.4 55.87 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 113.364 -1.744 . . . . 53.7 112.881 179.32 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 84.1 mt -62.94 -36.81 77.3 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 CA-C-O 117.917 -1.04 . . . . 49.8 110.301 177.096 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 16.5 tpp180 -62.75 -40.36 97.0 Favored 'General case' 0 C--N 1.347 0.487 0 CA-C-N 120.814 1.643 . . . . 46.3 110.239 174.98 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.481 ' O ' HG23 ' A' ' 91' ' ' VAL . 29.5 mt-10 -67.69 -36.66 81.07 Favored 'General case' 0 C--N 1.344 0.352 0 CA-C-N 118.833 0.742 . . . . 39.9 112.128 -179.971 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -68.2 -33.06 73.74 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 123.628 0.58 . . . . 33.5 110.326 178.886 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -70.76 -32.88 70.18 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 123.472 0.709 . . . . 28.9 111.776 177.759 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 1.1 mtp180 -72.28 -13.95 61.64 Favored 'General case' 0 N--CA 1.449 -0.524 0 O-C-N 125.067 1.48 . . . . 46.7 110.311 178.216 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.481 HG23 ' O ' ' A' ' 87' ' ' GLU . 47.4 t -74.93 -36.16 38.04 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 N-CA-C 109.607 -0.516 . . . . 30.4 109.607 178.703 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.562 ' HA ' HG21 ' A' ' 108' ' ' VAL . 39.0 m-85 -84.36 -42.74 15.43 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 119.36 0.982 . . . . 27.2 113.475 178.897 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -86.74 74.31 9.84 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 125.451 1.5 . . . . 26.0 111.916 177.93 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.515 ' HE3' ' HG2' ' A' ' 104' ' ' GLU . 8.9 mtmp? -63.3 -14.7 52.53 Favored 'General case' 0 CA--C 1.507 -0.706 0 C-N-CA 123.997 0.919 . . . . 45.9 109.968 -174.142 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -111.23 1.45 17.2 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 101.548 -3.501 . . . . 40.3 101.548 172.341 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 72.38 11.83 76.37 Favored Glycine 0 N--CA 1.447 -0.592 0 CA-C-N 111.872 -2.422 . . . . 29.9 115.669 -177.125 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 32.3 p-10 -76.97 0.41 21.23 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 119.059 1.429 . . . . 26.4 109.792 176.589 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 84.56 13.38 73.2 Favored Glycine 0 C--N 1.345 1.069 0 CA-C-O 119.265 -0.742 . . . . 21.8 113.707 179.308 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 69.4 m-85 -144.22 138.51 28.09 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-N 120.617 2.209 . . . . 20.9 111.289 -178.522 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.44 ' HB ' ' HB ' ' A' ' 136' ' ' VAL . 42.2 mt -99.13 126.0 52.5 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.231 0 N-CA-C 107.38 -1.341 . . . . 11.1 107.38 174.623 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 97.7 p -95.26 164.89 12.66 Favored 'General case' 0 C--O 1.237 0.434 0 N-CA-C 107.768 -1.197 . . . . 16.3 107.768 176.994 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.43 ' O ' HG11 ' A' ' 121' ' ' VAL . . . -56.88 -34.46 67.9 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-O 121.14 0.495 . . . . 20.7 110.131 -179.269 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -69.15 -45.02 71.1 Favored 'General case' 0 N--CA 1.45 -0.446 0 O-C-N 126.253 2.221 . . . . 23.8 112.635 178.237 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.515 ' HG2' ' HE3' ' A' ' 94' ' ' LYS . 38.3 mt-10 -63.68 -38.77 92.38 Favored 'General case' 0 CA--C 1.514 -0.409 0 N-CA-C 113.601 0.963 . . . . 25.1 113.601 178.434 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.434 ' O ' ' HG2' ' A' ' 109' ' ' MET . 28.9 tp -67.65 -40.62 84.52 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 108.803 -0.814 . . . . 25.2 108.803 176.402 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 39.7 ttm180 -65.87 -26.71 67.76 Favored 'General case' 0 CA--C 1.529 0.154 0 CA-C-O 118.42 -0.8 . . . . 42.5 109.578 175.67 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 20.0 m-70 -72.99 -38.63 66.56 Favored 'General case' 0 C--N 1.35 0.627 0 CA-C-N 119.581 1.082 . . . . 41.6 110.415 176.497 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.562 HG21 ' HA ' ' A' ' 92' ' ' PHE . 39.9 t -70.03 -38.29 74.78 Favored 'Isoleucine or valine' 0 C--N 1.345 0.404 0 N-CA-C 113.196 0.813 . . . . 34.3 113.196 -179.536 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' MET . . . . . 0.434 ' HG2' ' O ' ' A' ' 105' ' ' LEU . 2.8 mmt -71.78 -34.72 69.65 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-O 118.747 -0.644 . . . . 36.0 112.459 -176.921 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 90.6 m -62.09 -45.32 94.0 Favored 'General case' 0 C--N 1.342 0.258 0 CA-C-N 119.384 0.993 . . . . 35.3 110.289 179.275 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 4.7 t30 -75.86 -30.68 58.98 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 118.887 0.767 . . . . 47.1 111.135 176.441 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.41 ' HA ' ' O ' ' A' ' 540' ' ' HOH . 88.2 mt -75.63 -3.03 32.2 Favored 'General case' 0 C--N 1.345 0.386 0 C-N-CA 122.928 0.491 . . . . 44.5 111.938 174.739 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 91.38 68.5 1.17 Allowed Glycine 0 C--N 1.338 0.656 0 N-CA-C 116.011 1.164 . . . . 47.6 116.011 176.255 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 -145.61 155.91 43.33 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 116.119 1.896 . . . . 60.9 116.119 -178.976 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . . . -133.47 93.37 3.13 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 104.892 -2.262 . . . . 49.2 104.892 174.704 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -115.09 144.57 43.44 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 115.2 1.556 . . . . 46.7 115.2 -178.441 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 11.3 m -79.81 158.09 26.88 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 123.547 0.739 . . . . 49.5 111.606 -177.951 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' ASP . . . . . 0.476 ' O ' ' HB2' ' A' ' 122' ' ' ASP . 9.6 m-20 -60.89 -33.52 73.24 Favored 'General case' 0 C--N 1.344 0.329 0 CA-C-O 121.826 0.822 . . . . 47.8 110.876 176.7 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -70.46 -33.78 71.67 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 113.898 -1.501 . . . . 45.3 110.175 173.811 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 85.5 mt-10 -69.36 -36.8 77.21 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.866 -0.607 . . . . 38.6 112.507 178.236 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.439 ' HA ' ' HE3' ' A' ' 124' ' ' MET . 94.1 t -72.42 -37.33 57.37 Favored 'Isoleucine or valine' 0 C--N 1.349 0.546 0 N-CA-C 109.293 -0.632 . . . . 32.3 109.293 178.69 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.476 ' HB2' ' O ' ' A' ' 118' ' ' ASP . 0.3 OUTLIER -61.46 -36.84 81.55 Favored 'General case' 0 N--CA 1.444 -0.772 0 C-N-CA 119.099 -1.04 . . . . 36.4 113.449 178.752 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.543 ' HG2' HH21 ' A' ' 126' ' ' ARG . 20.7 tt0 -71.54 -38.8 71.0 Favored 'General case' 0 C--N 1.344 0.367 0 N-CA-C 107.157 -1.423 . . . . 35.5 107.157 177.876 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' MET . . . . . 0.439 ' HE3' ' HA ' ' A' ' 121' ' ' VAL . 55.4 mtm -60.07 -39.46 86.11 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 113.37 0.878 . . . . 31.1 113.37 177.895 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 21.2 mm -63.92 -49.03 83.52 Favored 'Isoleucine or valine' 0 C--N 1.345 0.41 0 CA-C-N 118.247 0.476 . . . . 27.8 109.749 177.964 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.543 HH21 ' HG2' ' A' ' 123' ' ' GLU . 45.3 mtt180 -57.93 -43.22 86.15 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 114.19 1.182 . . . . 47.5 114.19 -179.455 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' GLU . . . . . 0.529 ' HG2' ' O ' ' A' ' 123' ' ' GLU . 69.3 mm-40 -69.03 -19.31 64.1 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 108.669 -0.863 . . . . 32.0 108.669 175.897 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.752 ' HB2' HD21 ' B' ' 299' ' ' LEU . . . -96.0 -20.33 18.79 Favored 'General case' 0 C--N 1.346 0.431 0 N-CA-C 117.236 2.31 . . . . 21.4 117.236 -178.26 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 43.8 t0 -84.56 130.63 34.72 Favored 'General case' 0 CA--C 1.535 0.376 0 O-C-N 121.647 -0.658 . . . . 19.9 112.29 -178.925 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' ILE . . . . . 0.569 HD11 ' HG2' ' A' ' 143' ' ' GLN . 70.6 mt -107.4 -49.06 8.11 Favored 'Isoleucine or valine' 0 C--N 1.343 0.305 0 O-C-N 120.887 -1.133 . . . . 18.8 113.906 -179.252 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' ASP . . . . . . . . . . . . . 57.7 p30 -80.82 -20.77 41.73 Favored 'General case' 0 C--N 1.344 0.353 0 N-CA-C 115.641 1.719 . . . . 17.9 115.641 -174.867 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 85.38 30.61 24.38 Favored Glycine 0 C--N 1.343 0.954 0 CA-C-O 118.932 -0.927 . . . . 18.9 114.446 177.905 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 33.0 p-10 -93.84 5.05 52.93 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 120.63 2.215 . . . . 23.1 114.529 -179.92 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 79.89 10.14 85.98 Favored Glycine 0 C--N 1.342 0.867 0 C-N-CA 123.774 0.702 . . . . 19.7 114.733 175.859 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 -130.7 176.38 8.24 Favored 'General case' 0 CA--C 1.516 -0.355 0 N-CA-C 107.319 -1.363 . . . . 20.3 107.319 -177.854 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' VAL . . . . . 0.44 ' HB ' ' HB ' ' A' ' 100' ' ' ILE . 97.6 t -120.88 106.24 18.22 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 CA-C-N 119.575 1.08 . . . . 16.8 109.049 179.009 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 -82.97 -172.9 4.39 Favored 'General case' 0 C--O 1.234 0.276 0 O-C-N 121.242 -0.911 . . . . 19.3 112.378 175.275 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 69.3 t80 -68.93 -40.86 78.76 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 114.823 1.416 . . . . 29.7 114.823 -178.556 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 31.0 mp0 -61.39 -40.53 94.7 Favored 'General case' 0 N--CA 1.45 -0.451 0 O-C-N 121.693 -0.629 . . . . 36.5 112.659 -176.545 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.486 ' HG2' ' HB ' ' A' ' 130' ' ' ILE . 30.6 mt-10 -74.71 -28.46 60.81 Favored 'General case' 0 CA--C 1.515 -0.376 0 C-N-CA 123.901 0.881 . . . . 30.0 111.933 175.324 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' PHE . . . . . . . . . . . . . 61.8 t80 -68.77 -42.98 76.68 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.525 0.73 . . . . 25.0 110.442 175.2 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 55.6 t -65.65 -43.54 93.8 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.449 0 N-CA-C 107.957 -1.127 . . . . 27.7 107.957 178.959 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' GLN . . . . . 0.569 ' HG2' HD11 ' A' ' 130' ' ' ILE . 0.2 OUTLIER -54.92 -49.91 70.13 Favored 'General case' 0 N--CA 1.442 -0.865 0 N-CA-C 113.261 0.837 . . . . 37.0 113.261 -176.674 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' MET . . . . . 0.586 ' SD ' ' HG ' ' B' ' 299' ' ' LEU . 21.7 ttp -58.11 -31.94 67.63 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 119.556 1.071 . . . . 35.6 109.947 178.932 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 68.4 mmm -96.13 -17.54 20.8 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 115.529 -0.759 . . . . 43.6 110.999 172.936 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 77.3 p . . . . . 0 C--N 1.34 0.152 0 CA-C-O 117.828 -1.082 . . . . 47.8 112.283 -178.187 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 293' ' ' PHE . . . . . . . . . . . . . 44.7 t80 . . . . . 0 C--O 1.234 0.243 0 CA-C-O 122.139 0.971 . . . . 57.2 111.795 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 294' ' ' ASN . . . . . 0.539 HD21 HH21 ' B' ' 297' ' ' ARG . 18.8 t-20 -121.12 101.88 7.95 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 105.172 -2.159 . . . . 48.0 105.172 176.077 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 295' ' ' ALA . . . . . . . . . . . . . . . -75.36 -32.57 60.89 Favored 'General case' 0 CA--C 1.517 -0.313 0 N-CA-C 116.573 2.064 . . . . 40.2 116.573 -177.833 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 296' ' ' ARG . . . . . . . . . . . . . 7.0 ttm-85 -76.36 -11.08 59.84 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 118.456 0.571 . . . . 48.7 112.201 -179.773 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 297' ' ' ARG . . . . . 0.539 HH21 HD21 ' B' ' 294' ' ' ASN . 0.6 OUTLIER -79.12 -42.07 27.12 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 116.157 1.91 . . . . 46.9 116.157 179.188 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 298' ' ' LYS . . . . . 0.437 ' HA ' ' HG2' ' A' ' 14' ' ' GLU . 22.0 mmtm -70.46 -32.19 69.64 Favored 'General case' 0 C--O 1.222 -0.354 0 N-CA-C 108.181 -1.044 . . . . 32.5 108.181 170.719 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 299' ' ' LEU . . . . . 0.752 HD21 ' HB2' ' A' ' 128' ' ' ALA . 48.7 tp -71.89 -52.99 14.58 Favored 'General case' 0 N--CA 1.464 0.252 0 C-N-CA 123.64 0.776 . . . . 29.1 113.059 177.691 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 300' ' ' LYS . . . . . 0.571 ' HE2' ' O ' ' A' ' 144' ' ' MET . 34.3 mttm -66.21 -25.03 66.73 Favored 'General case' 0 C--N 1.348 0.524 0 CA-C-O 117.99 -1.005 . . . . 38.4 112.959 176.633 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 301' ' ' GLY . . . . . . . . . . . . . . . -77.41 -40.56 23.12 Favored Glycine 0 C--N 1.343 0.935 0 O-C-N 123.864 0.728 . . . . 26.0 112.745 179.84 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 302' ' ' ALA . . . . . . . . . . . . . . . -71.46 -32.05 67.86 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-O 118.588 -0.72 . . . . 25.6 111.224 177.57 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 303' ' ' ILE . . . . . 0.416 ' O ' ' HG3' ' B' ' 307' ' ' MET . 61.3 mt -66.19 -47.28 85.12 Favored 'Isoleucine or valine' 0 C--N 1.351 0.633 0 CA-C-N 120.146 1.339 . . . . 25.0 110.47 176.673 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 304' ' ' LEU . . . . . 0.409 ' HB2' ' O ' ' B' ' 300' ' ' LYS . 0.4 OUTLIER -61.33 -38.0 85.31 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-O 117.546 -1.216 . . . . 23.7 112.384 177.538 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 305' ' ' THR . . . . . . . . . . . . . 23.7 m -59.85 -40.97 90.35 Favored 'General case' 0 C--N 1.348 0.541 0 CA-C-N 120.32 1.418 . . . . 22.9 110.36 177.469 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 306' ' ' THR . . . . . . . . . . . . . 44.8 m -75.24 -31.12 60.73 Favored 'General case' 0 C--N 1.349 0.563 0 C-N-CA 123.453 0.701 . . . . 26.3 109.782 176.681 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 307' ' ' MET . . . . . 0.416 ' HG3' ' O ' ' B' ' 303' ' ' ILE . 73.4 mtp -62.31 -46.19 89.84 Favored 'General case' 0 C--N 1.345 0.386 0 N-CA-C 112.863 0.69 . . . . 30.9 112.863 176.615 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 308' ' ' LEU . . . . . . . . . . . . . 44.6 mt -65.91 -43.16 88.98 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 121.187 0.517 . . . . 20.6 109.671 177.99 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 309' ' ' ALA . . . . . . . . . . . . . . . -74.49 -19.4 60.39 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 113.354 0.872 . . . . 26.2 113.354 177.18 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 310' ' ' THR . . . . . . . . . . . . . 26.2 m . . . . . 0 C--N 1.347 0.463 0 C-N-CA 123.717 0.807 . . . . 31.7 112.796 179.139 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 401' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 402' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 403' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 404' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 405' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 406' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 407' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 408' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 409' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 410' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 411' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 412' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 413' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 414' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 415' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 416' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 417' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 507' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 508' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 509' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 511' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 512' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 513' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 514' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 515' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 516' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 517' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 518' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 519' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 520' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 521' ' ' HOH . . . . . 0.401 ' O ' ' HG2' ' A' ' 75' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 522' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 523' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 524' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 525' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 526' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 527' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 528' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 529' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 530' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 531' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 532' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 533' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 534' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 535' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 536' ' ' HOH . . . . . 0.505 ' O ' ' HD3' ' A' ' 37' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 537' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 538' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 539' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 540' ' ' HOH . . . . . 0.41 ' O ' ' HA ' ' A' ' 112' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 541' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 542' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 543' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 544' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 545' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 546' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 547' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 548' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 549' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 550' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 551' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 552' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 553' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 554' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 401' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 402' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 403' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 404' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_