data_1ehc_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 1ehc _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 ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.87 0 CA-C-O 126.613 3.101 . . . . 34.17 116.124 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.9 t0 -76.64 126.25 30.66 Favored 'General case' 0 C--O 1.258 1.539 1 C-N-CA 136.678 5.991 . . . . 33.68 113.677 179.942 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.54 -15.54 61.11 Favored 'General case' 0 C--O 1.269 2.116 0 N-CA-C 115.393 1.627 . . . . 28.04 115.393 -179.862 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' GLU . . . . . 0.511 ' O ' ' ND2' ' A' ' 32' ' ' ASN 0.255 39.8 mm-40 -95.22 11.7 31.51 Favored 'General case' 0 C--O 1.238 0.498 0 O-C-N 124.355 1.034 . . . . 24.37 112.75 -178.694 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 11.7 tp -59.88 121.18 11.11 Favored 'General case' 0 C--O 1.249 1.062 0 N-CA-C 105.794 -1.928 . . . . 17.4 105.794 177.037 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . 0.274 19.9 tttt -81.71 116.18 21.3 Favored 'General case' 0 N--CA 1.49 1.566 0 N-CA-C 118.354 2.724 . . . . 18.71 118.354 179.956 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 68.1 m-85 -89.35 154.63 19.92 Favored 'General case' 0 C--N 1.298 -1.638 0 CA-C-O 125.893 2.759 . . . . 11.29 115.073 -179.474 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 53.4 tp -125.93 113.57 17.36 Favored 'General case' 0 C--O 1.211 -0.952 0 N-CA-C 102.672 -3.085 . . . . 10.05 102.672 174.74 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 98.7 t -103.46 111.08 31.83 Favored 'Isoleucine or valine' 0 C--O 1.247 0.963 0 CA-C-O 123.857 1.789 . . . . 8.6 108.166 177.802 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 8.7 t -108.64 114.57 47.1 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.983 0 O-C-N 118.772 -2.455 . . . . 8.58 110.909 -176.581 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . 0.298 13.8 t0 -153.17 150.44 29.05 Favored 'General case' 0 N--CA 1.491 1.576 0 CA-C-O 115.27 -2.3 . . . . 15.14 108.157 -179.33 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -80.16 -11.88 59.71 Favored 'General case' 0 C--O 1.257 1.455 0 CA-C-N 120.602 1.546 . . . . 17.03 112.926 179.57 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -115.22 128.72 56.34 Favored 'General case' 0 C--N 1.299 -1.597 0 O-C-N 118.963 -2.336 . . . . 12.98 108.605 177.854 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 85.8 p -58.5 -36.85 74.42 Favored 'General case' 0 C--O 1.251 1.165 0 CA-C-N 110.119 -3.219 . . . . 16.42 108.683 -179.465 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 54.5 m -64.68 -37.62 88.2 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 117.436 -1.269 . . . . 13.75 111.354 -179.646 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 16.3 tpt -68.45 -44.12 75.59 Favored 'General case' 0 C--O 1.262 1.711 0 O-C-N 127.615 3.072 . . . . 14.34 107.475 -179.691 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ARG . . . . . 0.487 ' NH1' ' O ' ' A' ' 285' ' ' HOH . 59.2 mtm-85 -60.29 -34.84 74.34 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 114.642 -2.599 . . . . 15.44 113.879 177.472 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -68.37 -45.14 73.58 Favored 'General case' 0 C--N 1.297 -1.713 1 C-N-CA 131.748 4.019 . . . . 14.13 107.914 178.771 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 70.8 mt -59.76 -52.68 58.2 Favored 'Isoleucine or valine' 0 C--O 1.281 2.749 0 CA-C-O 116.645 -1.645 . . . . 9.35 110.19 176.977 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 82.7 t -61.45 -38.14 79.37 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.381 0 CA-C-O 128.423 3.963 . . . . 8.59 115.852 179.671 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 16.6 ttm-85 -65.32 -43.44 90.98 Favored 'General case' 0 C--O 1.246 0.918 0 N-CA-C 101.864 -3.384 . . . . 22.58 101.864 179.542 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . 0.275 2.4 m-80 -63.05 -41.57 99.52 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 121.81 2.096 . . . . 12.15 113.707 178.902 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 92.2 mt -65.29 -36.55 84.41 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-O 112.473 -3.632 . . . . 9.88 109.384 178.866 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 35.3 mt -68.31 -42.38 79.51 Favored 'General case' 0 CA--C 1.51 -0.593 0 O-C-N 126.726 2.517 . . . . 11.39 112.262 179.992 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' LYS . . . . . 0.459 ' CE ' ' O ' ' A' ' 211' ' ' HOH . 0.6 OUTLIER -56.53 -54.29 47.55 Favored 'General case' 0 C--N 1.304 -1.371 0 C-N-CA 125.978 1.711 . . . . 20.8 107.047 178.479 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -55.33 -21.31 14.45 Favored 'General case' 0 C--N 1.314 -0.967 0 N-CA-C 114.964 1.468 . . . . 15.43 114.964 -179.636 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 25.7 mt -90.88 -19.54 23.24 Favored 'General case' 0 CA--C 1.56 1.34 1 C-N-CA 131.806 4.043 . . . . 11.46 111.529 177.462 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 107.4 15.4 15.73 Favored Glycine 0 C--O 1.224 -0.489 0 O-C-N 125.713 1.883 . . . . 8.31 113.714 -179.614 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 70.4 m-85 -110.3 102.37 11.04 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-O 124.413 2.054 . . . . 9.54 106.856 179.951 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 61.5 m-80 -110.07 -5.86 15.28 Favored 'General case' 0 C--O 1.262 1.744 0 CA-C-O 113.08 -3.343 . . . . 13.92 117.563 -177.217 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ASN . . . . . 0.511 ' ND2' ' O ' ' A' ' 5' ' ' GLU . 35.8 t-20 -97.79 85.42 3.55 Favored 'General case' 0 C--N 1.292 -1.929 0 O-C-N 127.701 3.126 . . . . 10.02 106.398 -179.919 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 40.7 t -126.09 140.63 48.09 Favored 'Isoleucine or valine' 0 C--O 1.189 -2.107 0 O-C-N 126.674 2.484 . . . . 11.44 105.11 -178.803 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 75.5 mm-40 -126.8 151.41 48.32 Favored 'General case' 0 C--N 1.286 -2.192 1 C-N-CA 136.645 5.978 . . . . 23.3 104.355 176.366 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -127.31 154.61 44.71 Favored 'General case' 0 C--N 1.308 -1.234 0 C-N-CA 128.567 2.747 . . . . 16.28 115.355 -178.406 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -142.4 152.48 42.87 Favored 'General case' 0 N--CA 1.508 2.47 0 CA-C-O 114.353 -2.736 . . . . 10.21 108.498 -179.877 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' GLU . . . . . 0.684 ' OE1' ' O ' ' A' ' 285' ' ' HOH . 20.7 pt-20 -99.97 -12.84 19.42 Favored 'General case' 0 N--CA 1.475 0.825 0 N-CA-C 117.187 2.291 . . . . 11.98 117.187 -178.059 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 33.8 p30 -160.73 171.89 18.05 Favored 'General case' 0 CA--C 1.549 0.924 0 CA-C-O 114.441 -2.695 . . . . 10.67 106.309 178.145 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -50.02 -47.11 41.25 Favored Glycine 0 N--CA 1.433 -1.56 1 O-C-N 131.32 5.388 . . . . 8.85 116.056 179.955 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 92.6 t -63.15 -49.07 84.74 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.281 0 C-N-CA 129.337 3.055 . . . . 12.42 110.853 178.359 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 15.2 t0 -58.49 -38.0 76.73 Favored 'General case' 0 C--O 1.263 1.81 0 CA-C-O 124.933 2.302 . . . . 14.56 111.277 178.081 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.99 -43.08 83.9 Favored 'General case' 0 C--O 1.269 2.105 0 CA-C-O 111.807 -3.949 . . . . 11.86 110.874 -178.957 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' LEU . . . . . 0.505 ' O ' ' CG ' ' A' ' 47' ' ' GLN . 83.3 mt -68.14 -29.69 68.66 Favored 'General case' 0 N--CA 1.48 1.034 0 O-C-N 128.208 3.443 . . . . 13.64 111.325 -178.909 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 22.3 m-20 -58.55 -54.34 48.1 Favored 'General case' 0 C--O 1.244 0.781 0 N-CA-C 102.445 -3.169 . . . . 16.88 102.445 179.43 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 8.0 mttt -76.79 -36.76 56.77 Favored 'General case' 0 N--CA 1.491 1.597 1 CA-C-O 111.567 -4.063 . . . . 24.67 112.96 -177.851 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 31.1 mt -55.68 -30.57 61.28 Favored 'General case' 0 C--N 1.296 -1.757 0 O-C-N 128.017 3.323 . . . . 19.93 110.52 -177.4 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' GLN . . . . . 0.505 ' CG ' ' O ' ' A' ' 43' ' ' LEU . 0.2 OUTLIER -59.79 -38.64 82.46 Favored 'General case' 0 C--O 1.252 1.225 0 CA-C-N 110.429 -3.078 . . . . 29.66 108.111 -178.234 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -57.8 -30.43 65.7 Favored 'General case' 0 C--O 1.27 2.141 0 O-C-N 126.202 2.189 . . . . 25.47 109.397 179.627 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 87.57 174.45 48.39 Favored Glycine 0 CA--C 1.543 1.787 1 CA-C-O 129.599 4.999 . . . . 22.9 110.049 -177.882 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 82.18 -2.68 83.77 Favored Glycine 0 N--CA 1.43 -1.741 1 C-N-CA 131.314 4.292 . . . . 18.84 116.547 -179.778 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 85.9 m-85 -67.37 151.69 47.0 Favored 'General case' 0 C--O 1.267 2.007 0 CA-C-N 120.216 2.008 . . . . 13.52 114.227 -178.994 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -119.26 -16.37 5.24 Favored Glycine 0 C--O 1.264 1.98 0 O-C-N 126.845 2.59 . . . . 9.32 119.57 -178.802 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . 0.297 4.0 t80 -164.43 140.72 6.18 Favored 'General case' 0 C--N 1.297 -1.707 0 CA-C-O 116.863 -1.541 . . . . 7.8 106.892 -176.311 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 54.7 t -119.82 133.41 66.66 Favored 'Isoleucine or valine' 0 C--O 1.259 1.562 0 N-CA-C 106.37 -1.715 . . . . 8.06 106.37 176.432 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 97.2 mt -119.4 116.07 49.67 Favored 'Isoleucine or valine' 0 C--O 1.251 1.172 0 O-C-N 128.655 3.722 . . . . 8.45 101.04 179.719 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' SER . . . . . 0.516 ' O ' ' N ' ' A' ' 86' ' ' VAL . 0.1 OUTLIER -143.31 149.68 38.16 Favored 'General case' 0 C--N 1.313 -0.983 1 CA-C-O 132.909 6.1 . . . . 8.75 117.113 -177.755 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 27.3 t0 -72.79 133.46 44.5 Favored 'General case' 0 C--N 1.291 -1.937 0 CA-C-N 108.903 -3.771 . . . . 17.44 111.08 178.915 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 71.5 t-105 -63.99 -46.91 82.47 Favored 'General case' 0 C--N 1.299 -1.625 0 CA-C-O 125.594 2.616 . . . . 12.03 111.542 179.204 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 23.0 t30 -105.36 108.3 19.74 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 112.745 -2.025 . . . . 17.78 115.807 -178.531 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 35.7 mtm -142.74 149.53 50.44 Favored Pre-proline 0 C--N 1.315 -0.932 0 N-CA-C 102.91 -2.996 . . . . 10.32 102.91 179.643 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -74.14 165.4 32.04 Favored 'Trans proline' 0 C--N 1.305 -1.756 0 C-N-CA 123.204 2.603 . . . . 9.08 111.208 178.746 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 64.5 m-20 63.53 -61.42 0.15 Allowed 'General case' 0 C--O 1.243 0.747 0 CA-C-O 113.153 -3.308 . . . . 11.92 112.317 178.064 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 2.9 ttm -136.68 108.53 7.09 Favored 'General case' 0 C--O 1.27 2.174 0 CA-C-N 124.282 3.219 . . . . 19.05 103.306 -178.918 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 26.7 p30 -82.54 177.78 8.55 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 125.939 2.024 . . . . 12.96 116.393 -179.764 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -49.9 -55.87 13.58 Favored Glycine 0 N--CA 1.435 -1.421 0 CA-C-N 114.63 -1.168 . . . . 9.66 114.546 -179.183 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 19.0 tp -65.75 -34.54 78.42 Favored 'General case' 0 C--O 1.271 2.196 0 O-C-N 119.001 -2.47 . . . . 10.74 110.162 -179.244 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLU . . . . . 0.832 ' OE1' ' O ' ' A' ' 212' ' ' HOH . 1.5 tt0 -69.52 -41.9 75.41 Favored 'General case' 0 CA--C 1.501 -0.912 0 CA-C-O 124.753 2.216 . . . . 18.43 113.025 178.736 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 15.8 tp -67.58 -43.1 81.39 Favored 'General case' 0 C--N 1.31 -1.126 0 O-C-N 118.309 -2.744 . . . . 7.25 109.223 177.787 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 7.5 tp -59.82 -43.47 94.53 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-O 124.588 2.137 . . . . 7.59 111.69 -178.822 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 35.9 mttt -63.69 -38.84 92.61 Favored 'General case' 0 C--N 1.285 -2.208 0 O-C-N 118.067 -2.895 . . . . 15.78 109.041 -179.881 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 33.4 m -65.46 -35.86 82.16 Favored 'General case' 0 C--O 1.255 1.372 0 C-N-CA 116.217 -2.193 . . . . 12.8 106.769 179.169 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 31.5 mt -67.42 -47.31 81.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 123.555 2.889 . . . . 13.0 113.738 -177.115 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 68.4 mmt-85 -57.91 -32.19 67.51 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 109.588 -3.46 . . . . 17.27 113.636 177.781 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -87.77 -15.71 36.2 Favored 'General case' 0 C--N 1.312 -1.059 0 O-C-N 117.958 -2.964 . . . . 21.61 115.739 179.779 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ASP . . . . . 0.627 ' OD1' ' C ' ' A' ' 75' ' ' ASP . 20.5 t0 -87.81 116.05 25.69 Favored 'General case' 0 C--O 1.248 1.006 0 CA-C-O 124.304 2.002 . . . . 23.04 110.703 -178.926 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -33.35 -58.16 0.54 Allowed Glycine 0 C--N 1.304 -1.245 0 CA-C-O 125.444 2.691 . . . . 25.4 116.492 178.252 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -61.11 -53.85 51.89 Favored 'General case' 0 C--N 1.304 -1.393 0 C-N-CA 127.602 2.361 . . . . 26.47 116.472 179.086 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 7.6 mtm -94.43 -3.05 50.83 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 118.015 2.598 . . . . 28.2 118.015 -177.839 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 54.0 p -50.2 -23.29 2.12 Favored 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 117.877 2.547 . . . . 20.27 117.877 -175.338 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -97.35 -12.93 22.24 Favored 'General case' 0 C--O 1.282 2.784 0 CA-C-O 122.276 1.036 . . . . 18.75 113.574 -177.684 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . 0.275 3.7 tp -48.13 125.44 11.42 Favored Pre-proline 0 C--O 1.25 1.099 0 N-CA-C 116.24 1.941 . . . . 15.96 116.24 177.971 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -65.55 134.27 37.68 Favored 'Trans proline' 0 N--CA 1.498 1.77 0 N-CA-C 106.789 -2.043 . . . . 12.01 106.789 175.431 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 47.7 t -128.13 114.14 33.38 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.307 0 C-N-CA 129.78 3.232 . . . . 8.08 111.366 -179.287 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 37.3 tp -103.45 125.16 49.87 Favored 'General case' 0 C--O 1.248 0.976 0 N-CA-C 104.508 -2.405 . . . . 5.7 104.508 178.411 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 2.0 tpp -93.69 137.27 33.11 Favored 'General case' 0 C--O 1.256 1.41 0 O-C-N 124.827 1.329 . . . . 11.78 111.45 -179.27 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' VAL . . . . . 0.516 ' N ' ' O ' ' A' ' 56' ' ' SER . 48.8 t -118.65 131.28 71.88 Favored 'Isoleucine or valine' 0 C--O 1.245 0.855 0 CA-C-O 126.257 2.932 . . . . 11.98 108.017 -179.591 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 15.2 t -142.28 158.99 43.11 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-O 126.008 2.814 . . . . 13.63 112.371 -179.195 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -85.17 -27.24 26.3 Favored 'General case' 0 C--O 1.254 1.316 0 C-N-CA 128.717 2.807 . . . . 16.55 114.062 176.382 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -154.33 124.59 6.89 Favored 'General case' 0 C--N 1.292 -1.91 0 CA-C-O 114.526 -2.654 . . . . 29.0 106.217 -178.096 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -78.65 131.91 36.85 Favored 'General case' 0 C--N 1.307 -1.28 1 O-C-N 130.748 5.03 . . . . 20.1 110.471 179.815 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 21.1 mttt -126.73 135.76 51.53 Favored 'General case' 0 C--O 1.218 -0.591 0 N-CA-C 101.065 -3.68 . . . . 24.66 101.065 179.998 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 6.2 tttt -53.44 -46.05 69.68 Favored 'General case' 0 C--N 1.296 -1.729 0 O-C-N 127.537 3.023 . . . . 22.91 114.322 -177.45 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' GLU . . . . . 0.435 ' N ' ' CD ' ' A' ' 93' ' ' GLU . 9.3 mp0 -70.01 -29.32 66.35 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 112.673 -3.537 . . . . 29.09 111.042 178.701 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' ASN . . . . . 0.575 ' ND2' ' O ' ' A' ' 247' ' ' HOH . 71.7 m-20 -65.92 -46.1 79.51 Favored 'General case' 0 C--O 1.279 2.616 0 CA-C-O 126.872 3.225 . . . . 16.85 111.107 177.72 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 24.2 mt -61.28 -42.32 93.08 Favored 'Isoleucine or valine' 0 C--O 1.252 1.189 0 C-N-CA 129.502 3.121 . . . . 14.48 107.305 177.778 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 64.6 mt -72.13 -51.82 28.16 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.842 0 CA-C-O 125.7 2.667 . . . . 12.63 109.49 179.844 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -48.71 -53.68 17.89 Favored 'General case' 0 C--O 1.256 1.397 0 O-C-N 117.821 -3.05 . . . . 11.3 108.412 -179.673 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -58.15 -54.89 41.91 Favored 'General case' 0 C--N 1.303 -1.436 0 C-N-CA 127.9 2.48 . . . . 10.34 112.717 -179.14 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -53.07 -51.33 62.17 Favored 'General case' 0 C--O 1.262 1.759 0 CA-C-O 122.539 1.161 . . . . 10.1 109.381 179.474 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 58.4 mt-30 -62.83 -33.76 75.91 Favored 'General case' 0 N--CA 1.493 1.7 0 CA-C-N 113.524 -1.671 . . . . 11.84 114.158 -178.764 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -83.87 -6.1 59.35 Favored 'General case' 0 C--O 1.281 2.715 0 C-N-CA 127.792 2.437 . . . . 13.46 110.121 175.762 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 112.46 4.32 25.19 Favored Glycine 0 C--N 1.359 1.848 1 N-CA-C 130.331 6.892 . . . . 12.83 130.331 178.394 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -56.99 141.85 44.04 Favored 'General case' 0 C--O 1.264 1.832 1 C-N-CA 133.773 4.829 . . . . 10.45 106.453 179.689 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -90.47 -20.42 22.75 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 125.59 1.806 . . . . 9.89 106.722 -177.808 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -174.63 -177.15 43.54 Favored Glycine 0 C--O 1.259 1.694 0 CA-C-O 124.814 2.341 . . . . 10.98 109.576 179.743 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' TYR . . . . . 0.609 ' OH ' ' O ' ' A' ' 247' ' ' HOH . 1.2 p90 -152.53 145.52 24.51 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 104.534 -2.395 . . . . 13.3 104.534 -178.123 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 4.1 p -139.08 141.42 36.25 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.032 0 O-C-N 126.133 2.145 . . . . 12.4 107.376 -179.484 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 5.1 t -97.42 140.34 17.93 Favored 'Isoleucine or valine' 0 C--O 1.248 0.974 0 N-CA-C 104.242 -2.503 . . . . 9.77 104.242 178.28 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 30.5 pttt -103.0 147.27 33.86 Favored Pre-proline 0 C--N 1.286 -2.178 0 C-N-CA 126.701 2.0 . . . . 17.56 109.653 -179.913 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -71.95 153.88 97.74 Favored 'Cis proline' 0 N--CA 1.454 -0.816 0 CA-C-O 116.721 -1.45 . . . . 10.29 115.174 -0.038 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 29.0 p90 -138.65 160.83 38.66 Favored 'General case' 0 C--O 1.239 0.517 0 O-C-N 126.139 2.149 . . . . 10.66 106.297 179.286 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 36.0 p -102.42 -178.06 3.58 Favored 'General case' 0 C--N 1.302 -1.474 0 C-N-CA 127.997 2.519 . . . . 10.57 110.252 179.365 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -77.35 -35.85 54.24 Favored 'General case' 0 C--O 1.268 2.03 0 CA-C-O 115.342 -2.266 . . . . 10.97 110.135 -179.846 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -58.09 -31.45 67.13 Favored 'General case' 0 C--N 1.308 -1.236 0 O-C-N 125.144 1.528 . . . . 8.59 114.538 178.314 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 82.5 m -77.89 -41.83 35.36 Favored 'General case' 0 C--N 1.3 -1.57 0 CA-C-O 117.409 -1.281 . . . . 8.66 108.206 -178.232 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 11.4 tp -68.09 -39.58 82.83 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 125.741 1.9 . . . . 10.01 106.764 179.543 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -55.14 -38.47 68.28 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 123.281 1.515 . . . . 18.47 113.624 179.301 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -70.73 -41.99 71.12 Favored 'General case' 0 C--O 1.248 1.008 0 CA-C-N 112.914 -1.948 . . . . 26.27 111.688 -179.902 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' LYS . . . . . 0.707 ' NZ ' ' O ' ' A' ' 226' ' ' HOH . 27.9 mmmt -65.95 -44.13 85.93 Favored 'General case' 0 CA--C 1.545 0.781 0 O-C-N 125.464 1.728 . . . . 16.45 106.917 176.966 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 73.8 mt -58.76 -54.63 44.95 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 106.923 -1.51 . . . . 15.37 106.923 -179.969 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -52.17 -43.67 64.24 Favored 'General case' 0 C--O 1.256 1.401 0 CA-C-O 116.585 -1.674 . . . . 17.79 111.508 179.102 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 56.6 tttt -66.51 -40.65 89.31 Favored 'General case' 0 C--O 1.269 2.083 0 O-C-N 126.409 2.318 . . . . 21.05 110.541 -179.833 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 45.7 mt -67.93 -42.14 85.34 Favored 'Isoleucine or valine' 0 C--O 1.257 1.45 0 CA-C-N 121.351 1.887 . . . . 15.15 112.276 179.721 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . 0.278 23.1 m-85 -59.11 -47.34 85.63 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-O 113.574 -3.108 . . . . 17.51 104.443 -178.611 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.02 -38.39 85.84 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-N 124.088 3.131 . . . . 24.44 116.885 177.498 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 6.0 ttpt -64.97 -37.36 87.4 Favored 'General case' 0 C--O 1.263 1.806 1 O-C-N 115.199 -4.688 . . . . 21.43 107.658 178.204 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 3.9 mp -84.46 -5.1 59.26 Favored 'General case' 0 N--CA 1.48 1.034 0 O-C-N 120.519 -1.363 . . . . 24.68 111.956 -178.581 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 60.75 42.26 99.36 Favored Glycine 0 N--CA 1.476 1.34 0 O-C-N 128.015 3.322 . . . . 28.61 107.81 -179.343 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 1.4 mtt . . . . . 0 C--N 1.297 -1.68 0 C-N-CA 129.528 3.131 . . . . 34.89 107.895 -179.284 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 401' ' ' SO4 . . . . . 0.403 ' O2 ' ' NZ ' ' A' ' 119' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 211' ' ' HOH . . . . . 0.459 ' O ' ' CE ' ' A' ' 26' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 212' ' ' HOH . . . . . 0.832 ' O ' ' OE1' ' A' ' 67' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 226' ' ' HOH . . . . . 0.707 ' O ' ' NZ ' ' A' ' 119' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 234' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 235' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 236' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 237' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 238' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 239' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 240' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 241' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 242' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 243' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 244' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 245' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 246' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 247' ' ' HOH . . . . . 0.609 ' O ' ' OH ' ' A' ' 106' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 248' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 249' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 250' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 251' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 252' ' ' HOH . . . . . 0.594 ' O ' ' CE ' ' A' ' 119' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 253' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 254' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 255' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 256' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 257' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 258' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 259' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 260' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 261' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 262' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 263' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 264' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 265' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 266' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 267' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 268' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 269' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 270' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 271' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 272' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 273' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 274' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 275' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 276' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 277' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 278' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 279' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 280' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 281' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 282' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 283' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 284' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 285' ' ' HOH . . . . . 0.684 ' O ' ' OE1' ' A' ' 37' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 286' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 287' ' ' HOH . . . . . 0.408 ' O ' ' NE2' ' A' ' 47' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 288' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 289' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 290' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 291' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 292' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 293' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 294' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 295' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 296' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 297' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 298' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 299' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 300' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.87 0 CA-C-O 126.613 3.101 . . . . 34.17 116.124 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.9 t0 -76.64 126.25 30.66 Favored 'General case' 0 C--O 1.258 1.539 1 C-N-CA 136.678 5.991 . . . . 33.68 113.677 179.942 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.54 -15.54 61.11 Favored 'General case' 0 C--O 1.269 2.116 0 N-CA-C 115.393 1.627 . . . . 28.04 115.393 -179.862 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . 0.255 39.8 mm-40 -95.22 11.7 31.51 Favored 'General case' 0 C--O 1.238 0.498 0 O-C-N 124.355 1.034 . . . . 24.37 112.75 -178.694 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 11.7 tp -59.88 121.18 11.11 Favored 'General case' 0 C--O 1.249 1.062 0 N-CA-C 105.794 -1.928 . . . . 17.4 105.794 177.037 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . 0.274 19.9 tttt -81.71 116.18 21.3 Favored 'General case' 0 N--CA 1.49 1.566 0 N-CA-C 118.354 2.724 . . . . 18.71 118.354 179.956 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 68.1 m-85 -89.35 154.63 19.92 Favored 'General case' 0 C--N 1.298 -1.638 0 CA-C-O 125.893 2.759 . . . . 11.29 115.073 -179.474 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 53.4 tp -125.93 113.57 17.36 Favored 'General case' 0 C--O 1.211 -0.952 0 N-CA-C 102.672 -3.085 . . . . 10.05 102.672 174.74 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 98.7 t -103.46 111.08 31.83 Favored 'Isoleucine or valine' 0 C--O 1.247 0.963 0 CA-C-O 123.857 1.789 . . . . 8.6 108.166 177.802 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' VAL . . . . . 0.422 HG12 ' SD ' ' A' ' 60' ' ' MET . 8.7 t -108.64 114.57 47.1 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.983 0 O-C-N 118.772 -2.455 . . . . 8.58 110.909 -176.581 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ASP . . . . . 0.443 ' HB3' ' HG2' ' A' ' 18' ' ' ARG 0.298 13.8 t0 -153.17 150.44 29.05 Favored 'General case' 0 N--CA 1.491 1.576 0 CA-C-O 115.27 -2.3 . . . . 15.14 108.157 -179.33 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 13' ' ' LYS . . . . . 0.572 ' HE2' ' O ' ' A' ' 59' ' ' ASN . 0.4 OUTLIER -80.16 -11.88 59.71 Favored 'General case' 0 C--O 1.257 1.455 0 CA-C-N 120.602 1.546 . . . . 17.03 112.926 179.57 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -115.22 128.72 56.34 Favored 'General case' 0 C--N 1.299 -1.597 0 O-C-N 118.963 -2.336 . . . . 12.98 108.605 177.854 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 85.8 p -58.5 -36.85 74.42 Favored 'General case' 0 C--O 1.251 1.165 0 CA-C-N 110.119 -3.219 . . . . 16.42 108.683 -179.465 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 54.5 m -64.68 -37.62 88.2 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 117.436 -1.269 . . . . 13.75 111.354 -179.646 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' MET . . . . . 0.405 ' HG2' ' OD2' ' A' ' 12' ' ' ASP . 16.3 tpt -68.45 -44.12 75.59 Favored 'General case' 0 C--O 1.262 1.711 0 O-C-N 127.615 3.072 . . . . 14.34 107.475 -179.691 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ARG . . . . . 0.443 ' HG2' ' HB3' ' A' ' 12' ' ' ASP . 59.2 mtm-85 -60.29 -34.84 74.34 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 114.642 -2.599 . . . . 15.44 113.879 177.472 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ARG . . . . . 0.448 ' HD2' ' HA ' ' A' ' 19' ' ' ARG . 0.6 OUTLIER -68.37 -45.14 73.58 Favored 'General case' 0 C--N 1.297 -1.713 1 C-N-CA 131.748 4.019 . . . . 14.13 107.914 178.771 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 70.8 mt -59.76 -52.68 58.2 Favored 'Isoleucine or valine' 0 C--O 1.281 2.749 0 CA-C-O 116.645 -1.645 . . . . 9.35 110.19 176.977 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 82.7 t -61.45 -38.14 79.37 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.381 0 CA-C-O 128.423 3.963 . . . . 8.59 115.852 179.671 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 16.6 ttm-85 -65.32 -43.44 90.98 Favored 'General case' 0 C--O 1.246 0.918 0 N-CA-C 101.864 -3.384 . . . . 22.58 101.864 179.542 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . 0.275 2.4 m-80 -63.05 -41.57 99.52 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 121.81 2.096 . . . . 12.15 113.707 178.902 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 92.2 mt -65.29 -36.55 84.41 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-O 112.473 -3.632 . . . . 9.88 109.384 178.866 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 35.3 mt -68.31 -42.38 79.51 Favored 'General case' 0 CA--C 1.51 -0.593 0 O-C-N 126.726 2.517 . . . . 11.39 112.262 179.992 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' LYS . . . . . 0.459 ' CE ' ' O ' ' A' ' 211' ' ' HOH . 0.6 OUTLIER -56.53 -54.29 47.55 Favored 'General case' 0 C--N 1.304 -1.371 0 C-N-CA 125.978 1.711 . . . . 20.8 107.047 178.479 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -55.33 -21.31 14.45 Favored 'General case' 0 C--N 1.314 -0.967 0 N-CA-C 114.964 1.468 . . . . 15.43 114.964 -179.636 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 25.7 mt -90.88 -19.54 23.24 Favored 'General case' 0 CA--C 1.56 1.34 1 C-N-CA 131.806 4.043 . . . . 11.46 111.529 177.462 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 107.4 15.4 15.73 Favored Glycine 0 C--O 1.224 -0.489 0 O-C-N 125.713 1.883 . . . . 8.31 113.714 -179.614 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 70.4 m-85 -110.3 102.37 11.04 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-O 124.413 2.054 . . . . 9.54 106.856 179.951 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ASN . . . . . 0.679 ' HA ' ' O ' ' A' ' 258' ' ' HOH . 61.5 m-80 -110.07 -5.86 15.28 Favored 'General case' 0 C--O 1.262 1.744 0 CA-C-O 113.08 -3.343 . . . . 13.92 117.563 -177.217 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 35.8 t-20 -97.79 85.42 3.55 Favored 'General case' 0 C--N 1.292 -1.929 0 O-C-N 127.701 3.126 . . . . 10.02 106.398 -179.919 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 40.7 t -126.09 140.63 48.09 Favored 'Isoleucine or valine' 0 C--O 1.189 -2.107 0 O-C-N 126.674 2.484 . . . . 11.44 105.11 -178.803 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 75.5 mm-40 -126.8 151.41 48.32 Favored 'General case' 0 C--N 1.286 -2.192 1 C-N-CA 136.645 5.978 . . . . 23.3 104.355 176.366 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 35' ' ' GLU . . . . . 0.408 ' HB3' ' HD2' ' A' ' 18' ' ' ARG . 45.8 mt-10 -127.31 154.61 44.71 Favored 'General case' 0 C--N 1.308 -1.234 0 C-N-CA 128.567 2.747 . . . . 16.28 115.355 -178.406 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -142.4 152.48 42.87 Favored 'General case' 0 N--CA 1.508 2.47 0 CA-C-O 114.353 -2.736 . . . . 10.21 108.498 -179.877 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' GLU . . . . . 0.684 ' OE1' ' O ' ' A' ' 285' ' ' HOH . 20.7 pt-20 -99.97 -12.84 19.42 Favored 'General case' 0 N--CA 1.475 0.825 0 N-CA-C 117.187 2.291 . . . . 12.52 117.187 -178.059 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 33.8 p30 -160.73 171.89 18.05 Favored 'General case' 0 CA--C 1.549 0.924 0 CA-C-O 114.441 -2.695 . . . . 10.67 106.309 178.145 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' GLY . . . . . 0.613 ' HA3' ' HB3' ' A' ' 63' ' ' MET . . . -50.02 -47.11 41.25 Favored Glycine 0 N--CA 1.433 -1.56 1 O-C-N 131.32 5.388 . . . . 8.85 116.056 179.955 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 92.6 t -63.15 -49.07 84.74 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.281 0 C-N-CA 129.337 3.055 . . . . 12.42 110.853 178.359 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 15.2 t0 -58.49 -38.0 76.73 Favored 'General case' 0 C--O 1.263 1.81 0 CA-C-O 124.933 2.302 . . . . 14.56 111.277 178.081 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.99 -43.08 83.9 Favored 'General case' 0 C--O 1.269 2.105 0 CA-C-O 111.807 -3.949 . . . . 11.86 110.874 -178.957 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' LEU . . . . . 0.77 ' O ' ' HG2' ' A' ' 47' ' ' GLN . 83.3 mt -68.14 -29.69 68.66 Favored 'General case' 0 N--CA 1.48 1.034 0 O-C-N 128.208 3.443 . . . . 13.64 111.325 -178.909 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 22.3 m-20 -58.55 -54.34 48.1 Favored 'General case' 0 C--O 1.244 0.781 0 N-CA-C 102.445 -3.169 . . . . 16.88 102.445 179.43 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 8.0 mttt -76.79 -36.76 56.77 Favored 'General case' 0 N--CA 1.491 1.597 1 CA-C-O 111.567 -4.063 . . . . 24.67 112.96 -177.851 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 31.1 mt -55.68 -30.57 61.28 Favored 'General case' 0 C--N 1.296 -1.757 0 O-C-N 128.017 3.323 . . . . 19.93 110.52 -177.4 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' GLN . . . . . 0.77 ' HG2' ' O ' ' A' ' 43' ' ' LEU . 15.1 mm-40 -59.79 -38.64 82.46 Favored 'General case' 0 C--O 1.252 1.225 0 CA-C-N 110.429 -3.078 . . . . 29.66 108.111 -178.234 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -57.8 -30.43 65.7 Favored 'General case' 0 C--O 1.27 2.141 0 O-C-N 126.202 2.189 . . . . 25.47 109.397 179.627 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 87.57 174.45 48.39 Favored Glycine 0 CA--C 1.543 1.787 1 CA-C-O 129.599 4.999 . . . . 22.9 110.049 -177.882 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 82.18 -2.68 83.77 Favored Glycine 0 N--CA 1.43 -1.741 1 C-N-CA 131.314 4.292 . . . . 18.84 116.547 -179.778 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 85.9 m-85 -67.37 151.69 47.0 Favored 'General case' 0 C--O 1.267 2.007 0 CA-C-N 120.216 2.008 . . . . 13.52 114.227 -178.994 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -119.26 -16.37 5.24 Favored Glycine 0 C--O 1.264 1.98 0 O-C-N 126.845 2.59 . . . . 9.32 119.57 -178.802 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . 0.297 4.0 t80 -164.43 140.72 6.18 Favored 'General case' 0 C--N 1.297 -1.707 0 CA-C-O 116.863 -1.541 . . . . 7.8 106.892 -176.311 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 54.7 t -119.82 133.41 66.66 Favored 'Isoleucine or valine' 0 C--O 1.259 1.562 0 N-CA-C 106.37 -1.715 . . . . 8.06 106.37 176.432 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 97.2 mt -119.4 116.07 49.67 Favored 'Isoleucine or valine' 0 C--O 1.251 1.172 0 O-C-N 128.655 3.722 . . . . 8.45 101.04 179.719 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' SER . . . . . 0.43 ' O ' ' N ' ' A' ' 86' ' ' VAL . 0.1 OUTLIER -143.31 149.68 38.16 Favored 'General case' 0 C--N 1.313 -0.983 1 CA-C-O 132.909 6.1 . . . . 8.75 117.113 -177.755 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 27.3 t0 -72.79 133.46 44.5 Favored 'General case' 0 C--N 1.291 -1.937 0 CA-C-N 108.903 -3.771 . . . . 17.44 111.08 178.915 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' TRP . . . . . 0.499 ' CZ3' ' HB2' ' A' ' 66' ' ' LEU . 71.5 t-105 -63.99 -46.91 82.47 Favored 'General case' 0 C--N 1.299 -1.625 0 CA-C-O 125.594 2.616 . . . . 12.03 111.542 179.204 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 59' ' ' ASN . . . . . 0.572 ' O ' ' HE2' ' A' ' 13' ' ' LYS . 23.0 t30 -105.36 108.3 19.74 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 112.745 -2.025 . . . . 17.78 115.807 -178.531 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 60' ' ' MET . . . . . 0.422 ' SD ' HG12 ' A' ' 11' ' ' VAL . 35.7 mtm -142.74 149.53 50.44 Favored Pre-proline 0 C--N 1.315 -0.932 0 N-CA-C 102.91 -2.996 . . . . 10.32 102.91 179.643 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -74.14 165.4 32.04 Favored 'Trans proline' 0 C--N 1.305 -1.756 0 C-N-CA 123.204 2.603 . . . . 9.08 111.208 178.746 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 64.5 m-20 63.53 -61.42 0.15 Allowed 'General case' 0 C--O 1.243 0.747 0 CA-C-O 113.153 -3.308 . . . . 11.92 112.317 178.064 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' MET . . . . . 0.92 ' HG3' ' HG2' ' A' ' 67' ' ' GLU . 2.9 ttm -136.68 108.53 7.09 Favored 'General case' 0 C--O 1.27 2.174 0 CA-C-N 124.282 3.219 . . . . 19.05 103.306 -178.918 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ASP . . . . . 0.593 ' HB3' ' O ' ' A' ' 259' ' ' HOH . 26.7 p30 -82.54 177.78 8.55 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 125.939 2.024 . . . . 12.96 116.393 -179.764 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -49.9 -55.87 13.58 Favored Glycine 0 N--CA 1.435 -1.421 0 CA-C-N 114.63 -1.168 . . . . 9.66 114.546 -179.183 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' LEU . . . . . 0.499 ' HB2' ' CZ3' ' A' ' 58' ' ' TRP . 19.0 tp -65.75 -34.54 78.42 Favored 'General case' 0 C--O 1.271 2.196 0 O-C-N 119.001 -2.47 . . . . 10.74 110.162 -179.244 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLU . . . . . 0.92 ' HG2' ' HG3' ' A' ' 63' ' ' MET . 1.5 tt0 -69.52 -41.9 75.41 Favored 'General case' 0 CA--C 1.501 -0.912 0 CA-C-O 124.753 2.216 . . . . 18.43 113.025 178.736 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 15.8 tp -67.58 -43.1 81.39 Favored 'General case' 0 C--N 1.31 -1.126 0 O-C-N 118.309 -2.744 . . . . 7.25 109.223 177.787 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 7.5 tp -59.82 -43.47 94.53 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-O 124.588 2.137 . . . . 7.59 111.69 -178.822 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 35.9 mttt -63.69 -38.84 92.61 Favored 'General case' 0 C--N 1.285 -2.208 0 O-C-N 118.067 -2.895 . . . . 15.78 109.041 -179.881 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 33.4 m -65.46 -35.86 82.16 Favored 'General case' 0 C--O 1.255 1.372 0 C-N-CA 116.217 -2.193 . . . . 12.8 106.769 179.169 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 31.5 mt -67.42 -47.31 81.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 123.555 2.889 . . . . 13.0 113.738 -177.115 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ARG . . . . . 0.419 ' HD3' ' HA ' ' A' ' 73' ' ' ARG . 68.4 mmt-85 -57.91 -32.19 67.51 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 109.588 -3.46 . . . . 17.27 113.636 177.781 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -87.77 -15.71 36.2 Favored 'General case' 0 C--N 1.312 -1.059 0 O-C-N 117.958 -2.964 . . . . 21.61 115.739 179.779 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ASP . . . . . 0.627 ' OD1' ' C ' ' A' ' 75' ' ' ASP . 20.5 t0 -87.81 116.05 25.69 Favored 'General case' 0 C--O 1.248 1.006 0 CA-C-O 124.304 2.002 . . . . 23.04 110.703 -178.926 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -33.35 -58.16 0.54 Allowed Glycine 0 C--N 1.304 -1.245 0 CA-C-O 125.444 2.691 . . . . 25.4 116.492 178.252 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -61.11 -53.85 51.89 Favored 'General case' 0 C--N 1.304 -1.393 0 C-N-CA 127.602 2.361 . . . . 26.47 116.472 179.086 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' MET . . . . . 0.582 ' HE2' ' HB3' ' A' ' 75' ' ' ASP . 7.6 mtm -94.43 -3.05 50.83 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 118.015 2.598 . . . . 28.2 118.015 -177.839 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 54.0 p -50.2 -23.29 2.12 Favored 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 117.877 2.547 . . . . 20.27 117.877 -175.338 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -97.35 -12.93 22.24 Favored 'General case' 0 C--O 1.282 2.784 0 CA-C-O 122.276 1.036 . . . . 18.75 113.574 -177.684 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . 0.275 3.7 tp -48.13 125.44 11.42 Favored Pre-proline 0 C--O 1.25 1.099 0 N-CA-C 116.24 1.941 . . . . 15.96 116.24 177.971 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -65.55 134.27 37.68 Favored 'Trans proline' 0 N--CA 1.498 1.77 0 N-CA-C 106.789 -2.043 . . . . 12.01 106.789 175.431 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 47.7 t -128.13 114.14 33.38 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.307 0 C-N-CA 129.78 3.232 . . . . 8.08 111.366 -179.287 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 37.3 tp -103.45 125.16 49.87 Favored 'General case' 0 C--O 1.248 0.976 0 N-CA-C 104.508 -2.405 . . . . 5.7 104.508 178.411 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 2.0 tpp -93.69 137.27 33.11 Favored 'General case' 0 C--O 1.256 1.41 0 O-C-N 124.827 1.329 . . . . 11.78 111.45 -179.27 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' VAL . . . . . 0.43 ' N ' ' O ' ' A' ' 56' ' ' SER . 48.8 t -118.65 131.28 71.88 Favored 'Isoleucine or valine' 0 C--O 1.245 0.855 0 CA-C-O 126.257 2.932 . . . . 11.98 108.017 -179.591 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 87' ' ' THR . . . . . 0.517 HG21 ' CE2' ' A' ' 106' ' ' TYR . 15.2 t -142.28 158.99 43.11 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-O 126.008 2.814 . . . . 13.63 112.371 -179.195 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -85.17 -27.24 26.3 Favored 'General case' 0 C--O 1.254 1.316 0 C-N-CA 128.717 2.807 . . . . 16.55 114.062 176.382 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -154.33 124.59 6.89 Favored 'General case' 0 C--N 1.292 -1.91 0 CA-C-O 114.526 -2.654 . . . . 29.0 106.217 -178.096 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -78.65 131.91 36.85 Favored 'General case' 0 C--N 1.307 -1.28 1 O-C-N 130.748 5.03 . . . . 20.1 110.471 179.815 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 21.1 mttt -126.73 135.76 51.53 Favored 'General case' 0 C--O 1.218 -0.591 0 N-CA-C 101.065 -3.68 . . . . 24.66 101.065 179.998 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' LYS . . . . . 0.473 ' HE2' HD11 ' A' ' 96' ' ' ILE . 6.2 tttt -53.44 -46.05 69.68 Favored 'General case' 0 C--N 1.296 -1.729 0 O-C-N 127.537 3.023 . . . . 22.91 114.322 -177.45 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 93' ' ' GLU . . . . . 0.579 ' CD ' ' H ' ' A' ' 93' ' ' GLU . 9.3 mp0 -70.01 -29.32 66.35 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 112.673 -3.537 . . . . 29.09 111.042 178.701 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 94' ' ' ASN . . . . . 0.472 ' HB3' ' OH ' ' A' ' 106' ' ' TYR . 71.7 m-20 -65.92 -46.1 79.51 Favored 'General case' 0 C--O 1.279 2.616 0 CA-C-O 126.872 3.225 . . . . 16.85 111.107 177.72 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 24.2 mt -61.28 -42.32 93.08 Favored 'Isoleucine or valine' 0 C--O 1.252 1.189 0 C-N-CA 129.502 3.121 . . . . 14.48 107.305 177.778 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' ILE . . . . . 0.473 HD11 ' HE2' ' A' ' 92' ' ' LYS . 64.6 mt -72.13 -51.82 28.16 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.842 0 CA-C-O 125.7 2.667 . . . . 12.63 109.49 179.844 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -48.71 -53.68 17.89 Favored 'General case' 0 C--O 1.256 1.397 0 O-C-N 117.821 -3.05 . . . . 11.3 108.412 -179.673 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -58.15 -54.89 41.91 Favored 'General case' 0 C--N 1.303 -1.436 0 C-N-CA 127.9 2.48 . . . . 10.34 112.717 -179.14 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -53.07 -51.33 62.17 Favored 'General case' 0 C--O 1.262 1.759 0 CA-C-O 122.539 1.161 . . . . 10.1 109.381 179.474 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 58.4 mt-30 -62.83 -33.76 75.91 Favored 'General case' 0 N--CA 1.493 1.7 0 CA-C-N 113.524 -1.671 . . . . 11.84 114.158 -178.764 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -83.87 -6.1 59.35 Favored 'General case' 0 C--O 1.281 2.715 0 C-N-CA 127.792 2.437 . . . . 13.46 110.121 175.762 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 112.46 4.32 25.19 Favored Glycine 0 C--N 1.359 1.848 1 N-CA-C 130.331 6.892 . . . . 12.83 130.331 178.394 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -56.99 141.85 44.04 Favored 'General case' 0 C--O 1.264 1.832 1 C-N-CA 133.773 4.829 . . . . 10.45 106.453 179.689 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -90.47 -20.42 22.75 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 125.59 1.806 . . . . 9.89 106.722 -177.808 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -174.63 -177.15 43.54 Favored Glycine 0 C--O 1.259 1.694 0 CA-C-O 124.814 2.341 . . . . 10.98 109.576 179.743 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' TYR . . . . . 0.521 ' OH ' ' O ' ' A' ' 247' ' ' HOH . 1.2 p90 -152.53 145.52 24.51 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 104.534 -2.395 . . . . 13.38 104.534 -178.123 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 4.1 p -139.08 141.42 36.25 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.032 0 O-C-N 126.133 2.145 . . . . 12.4 107.376 -179.484 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 5.1 t -97.42 140.34 17.93 Favored 'Isoleucine or valine' 0 C--O 1.248 0.974 0 N-CA-C 104.242 -2.503 . . . . 9.77 104.242 178.28 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 30.5 pttt -103.0 147.27 33.86 Favored Pre-proline 0 C--N 1.286 -2.178 0 C-N-CA 126.701 2.0 . . . . 17.56 109.653 -179.913 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -71.95 153.88 97.74 Favored 'Cis proline' 0 N--CA 1.454 -0.816 0 CA-C-O 116.721 -1.45 . . . . 10.29 115.174 -0.038 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 29.0 p90 -138.65 160.83 38.66 Favored 'General case' 0 C--O 1.239 0.517 0 O-C-N 126.139 2.149 . . . . 10.66 106.297 179.286 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 36.0 p -102.42 -178.06 3.58 Favored 'General case' 0 C--N 1.302 -1.474 0 C-N-CA 127.997 2.519 . . . . 10.57 110.252 179.365 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -77.35 -35.85 54.24 Favored 'General case' 0 C--O 1.268 2.03 0 CA-C-O 115.342 -2.266 . . . . 10.97 110.135 -179.846 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -58.09 -31.45 67.13 Favored 'General case' 0 C--N 1.308 -1.236 0 O-C-N 125.144 1.528 . . . . 8.59 114.538 178.314 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 82.5 m -77.89 -41.83 35.36 Favored 'General case' 0 C--N 1.3 -1.57 0 CA-C-O 117.409 -1.281 . . . . 8.66 108.206 -178.232 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' LEU . . . . . 0.423 ' O ' ' HG ' ' A' ' 120' ' ' LEU . 11.4 tp -68.09 -39.58 82.83 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 125.741 1.9 . . . . 10.01 106.764 179.543 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -55.14 -38.47 68.28 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 123.281 1.515 . . . . 18.47 113.624 179.301 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -70.73 -41.99 71.12 Favored 'General case' 0 C--O 1.248 1.008 0 CA-C-N 112.914 -1.948 . . . . 26.27 111.688 -179.902 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' LYS . . . . . 1.051 ' HE3' ' O ' ' A' ' 252' ' ' HOH . 27.9 mmmt -65.95 -44.13 85.93 Favored 'General case' 0 CA--C 1.545 0.781 0 O-C-N 125.464 1.728 . . . . 16.45 106.917 176.966 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 120' ' ' LEU . . . . . 0.423 ' HG ' ' O ' ' A' ' 116' ' ' LEU . 73.8 mt -58.76 -54.63 44.95 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 106.923 -1.51 . . . . 15.37 106.923 -179.969 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -52.17 -43.67 64.24 Favored 'General case' 0 C--O 1.256 1.401 0 CA-C-O 116.585 -1.674 . . . . 17.79 111.508 179.102 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 56.6 tttt -66.51 -40.65 89.31 Favored 'General case' 0 C--O 1.269 2.083 0 O-C-N 126.409 2.318 . . . . 21.05 110.541 -179.833 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' ILE . . . . . 0.693 ' O ' ' HG ' ' A' ' 127' ' ' LEU . 45.7 mt -67.93 -42.14 85.34 Favored 'Isoleucine or valine' 0 C--O 1.257 1.45 0 CA-C-N 121.351 1.887 . . . . 15.15 112.276 179.721 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . 0.278 23.1 m-85 -59.11 -47.34 85.63 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-O 113.574 -3.108 . . . . 17.51 104.443 -178.611 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.02 -38.39 85.84 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-N 124.088 3.131 . . . . 24.44 116.885 177.498 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 6.0 ttpt -64.97 -37.36 87.4 Favored 'General case' 0 C--O 1.263 1.806 1 O-C-N 115.199 -4.688 . . . . 21.43 107.658 178.204 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 127' ' ' LEU . . . . . 0.693 ' HG ' ' O ' ' A' ' 123' ' ' ILE . 3.9 mp -84.46 -5.1 59.26 Favored 'General case' 0 N--CA 1.48 1.034 0 O-C-N 120.519 -1.363 . . . . 24.68 111.956 -178.581 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 60.75 42.26 99.36 Favored Glycine 0 N--CA 1.476 1.34 0 O-C-N 128.015 3.322 . . . . 28.61 107.81 -179.343 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 1.4 mtt . . . . . 0 C--N 1.297 -1.68 0 C-N-CA 129.528 3.131 . . . . 34.89 107.895 -179.284 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 401' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 211' ' ' HOH . . . . . 0.459 ' O ' ' CE ' ' A' ' 26' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 212' ' ' HOH . . . . . 0.832 ' O ' ' OE1' ' A' ' 67' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 234' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 235' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 236' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 237' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 238' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 239' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 240' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 241' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 242' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 243' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 244' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 245' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 246' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 247' ' ' HOH . . . . . 0.521 ' O ' ' OH ' ' A' ' 106' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 248' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 249' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 250' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 251' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 252' ' ' HOH . . . . . 1.051 ' O ' ' HE3' ' A' ' 119' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 253' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 254' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 255' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 256' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 257' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 258' ' ' HOH . . . . . 0.679 ' O ' ' HA ' ' A' ' 31' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 259' ' ' HOH . . . . . 0.593 ' O ' ' HB3' ' A' ' 64' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 260' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 261' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 262' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 263' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 264' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 265' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 266' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 267' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 268' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 269' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 270' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 271' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 272' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 273' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 274' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 275' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 276' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 277' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 278' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 279' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 280' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 281' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 282' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 283' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 284' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 285' ' ' HOH . . . . . 0.684 ' O ' ' OE1' ' A' ' 37' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 286' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 287' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 288' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 289' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 290' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 291' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 292' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 293' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 294' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 295' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 296' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 297' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 298' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 299' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 300' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.87 0 CA-C-O 126.613 3.101 . . . . 34.17 116.124 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.9 t0 -76.64 126.25 30.66 Favored 'General case' 0 C--O 1.258 1.539 1 C-N-CA 136.678 5.991 . . . . 33.68 113.677 179.942 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.54 -15.54 61.11 Favored 'General case' 0 C--O 1.269 2.116 0 N-CA-C 115.393 1.627 . . . . 28.04 115.393 -179.862 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.511 ' O ' ' ND2' ' A' ' 32' ' ' ASN 0.255 39.8 mm-40 -95.22 11.7 31.51 Favored 'General case' 0 C--O 1.238 0.498 0 O-C-N 124.355 1.034 . . . . 24.37 112.75 -178.694 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 11.7 tp -59.88 121.18 11.11 Favored 'General case' 0 C--O 1.249 1.062 0 N-CA-C 105.794 -1.928 . . . . 17.4 105.794 177.037 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . 0.274 19.9 tttt -81.71 116.18 21.3 Favored 'General case' 0 N--CA 1.49 1.566 0 N-CA-C 118.354 2.724 . . . . 18.71 118.354 179.956 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 68.1 m-85 -89.35 154.63 19.92 Favored 'General case' 0 C--N 1.298 -1.638 0 CA-C-O 125.893 2.759 . . . . 11.29 115.073 -179.474 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 53.4 tp -125.93 113.57 17.36 Favored 'General case' 0 C--O 1.211 -0.952 0 N-CA-C 102.672 -3.085 . . . . 10.05 102.672 174.74 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 98.7 t -103.46 111.08 31.83 Favored 'Isoleucine or valine' 0 C--O 1.247 0.963 0 CA-C-O 123.857 1.789 . . . . 8.6 108.166 177.802 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.422 HG12 ' SD ' ' A' ' 60' ' ' MET . 8.7 t -108.64 114.57 47.1 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.983 0 O-C-N 118.772 -2.455 . . . . 8.58 110.909 -176.581 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.443 ' HB3' ' HG2' ' A' ' 18' ' ' ARG 0.298 13.8 t0 -153.17 150.44 29.05 Favored 'General case' 0 N--CA 1.491 1.576 0 CA-C-O 115.27 -2.3 . . . . 15.14 108.157 -179.33 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.572 ' HE2' ' O ' ' A' ' 59' ' ' ASN . 0.4 OUTLIER -80.16 -11.88 59.71 Favored 'General case' 0 C--O 1.257 1.455 0 CA-C-N 120.602 1.546 . . . . 17.03 112.926 179.57 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -115.22 128.72 56.34 Favored 'General case' 0 C--N 1.299 -1.597 0 O-C-N 118.963 -2.336 . . . . 12.98 108.605 177.854 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 85.8 p -58.5 -36.85 74.42 Favored 'General case' 0 C--O 1.251 1.165 0 CA-C-N 110.119 -3.219 . . . . 16.42 108.683 -179.465 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 54.5 m -64.68 -37.62 88.2 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 117.436 -1.269 . . . . 13.75 111.354 -179.646 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' MET . . . . . 0.405 ' HG2' ' OD2' ' A' ' 12' ' ' ASP . 16.3 tpt -68.45 -44.12 75.59 Favored 'General case' 0 C--O 1.262 1.711 0 O-C-N 127.615 3.072 . . . . 14.34 107.475 -179.691 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.443 ' HG2' ' HB3' ' A' ' 12' ' ' ASP . 59.2 mtm-85 -60.29 -34.84 74.34 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 114.642 -2.599 . . . . 15.44 113.879 177.472 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.448 ' HD2' ' HA ' ' A' ' 19' ' ' ARG . 0.6 OUTLIER -68.37 -45.14 73.58 Favored 'General case' 0 C--N 1.297 -1.713 1 C-N-CA 131.748 4.019 . . . . 14.13 107.914 178.771 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 70.8 mt -59.76 -52.68 58.2 Favored 'Isoleucine or valine' 0 C--O 1.281 2.749 0 CA-C-O 116.645 -1.645 . . . . 9.35 110.19 176.977 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 82.7 t -61.45 -38.14 79.37 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.381 0 CA-C-O 128.423 3.963 . . . . 8.59 115.852 179.671 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 16.6 ttm-85 -65.32 -43.44 90.98 Favored 'General case' 0 C--O 1.246 0.918 0 N-CA-C 101.864 -3.384 . . . . 22.58 101.864 179.542 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . 0.275 2.4 m-80 -63.05 -41.57 99.52 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 121.81 2.096 . . . . 12.15 113.707 178.902 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 92.2 mt -65.29 -36.55 84.41 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-O 112.473 -3.632 . . . . 9.88 109.384 178.866 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 35.3 mt -68.31 -42.38 79.51 Favored 'General case' 0 CA--C 1.51 -0.593 0 O-C-N 126.726 2.517 . . . . 11.39 112.262 179.992 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.459 ' CE ' ' O ' ' A' ' 211' ' ' HOH . 0.6 OUTLIER -56.53 -54.29 47.55 Favored 'General case' 0 C--N 1.304 -1.371 0 C-N-CA 125.978 1.711 . . . . 20.8 107.047 178.479 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -55.33 -21.31 14.45 Favored 'General case' 0 C--N 1.314 -0.967 0 N-CA-C 114.964 1.468 . . . . 15.43 114.964 -179.636 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 25.7 mt -90.88 -19.54 23.24 Favored 'General case' 0 CA--C 1.56 1.34 1 C-N-CA 131.806 4.043 . . . . 11.46 111.529 177.462 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 107.4 15.4 15.73 Favored Glycine 0 C--O 1.224 -0.489 0 O-C-N 125.713 1.883 . . . . 8.31 113.714 -179.614 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 70.4 m-85 -110.3 102.37 11.04 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-O 124.413 2.054 . . . . 9.54 106.856 179.951 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.679 ' HA ' ' O ' ' A' ' 258' ' ' HOH . 61.5 m-80 -110.07 -5.86 15.28 Favored 'General case' 0 C--O 1.262 1.744 0 CA-C-O 113.08 -3.343 . . . . 13.92 117.563 -177.217 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.511 ' ND2' ' O ' ' A' ' 5' ' ' GLU . 35.8 t-20 -97.79 85.42 3.55 Favored 'General case' 0 C--N 1.292 -1.929 0 O-C-N 127.701 3.126 . . . . 10.02 106.398 -179.919 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 40.7 t -126.09 140.63 48.09 Favored 'Isoleucine or valine' 0 C--O 1.189 -2.107 0 O-C-N 126.674 2.484 . . . . 11.44 105.11 -178.803 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 75.5 mm-40 -126.8 151.41 48.32 Favored 'General case' 0 C--N 1.286 -2.192 1 C-N-CA 136.645 5.978 . . . . 23.3 104.355 176.366 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.408 ' HB3' ' HD2' ' A' ' 18' ' ' ARG . 45.8 mt-10 -127.31 154.61 44.71 Favored 'General case' 0 C--N 1.308 -1.234 0 C-N-CA 128.567 2.747 . . . . 16.28 115.355 -178.406 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -142.4 152.48 42.87 Favored 'General case' 0 N--CA 1.508 2.47 0 CA-C-O 114.353 -2.736 . . . . 10.21 108.498 -179.877 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.684 ' OE1' ' O ' ' A' ' 285' ' ' HOH . 20.7 pt-20 -99.97 -12.84 19.42 Favored 'General case' 0 N--CA 1.475 0.825 0 N-CA-C 117.187 2.291 . . . . 12.52 117.187 -178.059 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 33.8 p30 -160.73 171.89 18.05 Favored 'General case' 0 CA--C 1.549 0.924 0 CA-C-O 114.441 -2.695 . . . . 10.67 106.309 178.145 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' GLY . . . . . 0.613 ' HA3' ' HB3' ' A' ' 63' ' ' MET . . . -50.02 -47.11 41.25 Favored Glycine 0 N--CA 1.433 -1.56 1 O-C-N 131.32 5.388 . . . . 8.85 116.056 179.955 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 92.6 t -63.15 -49.07 84.74 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.281 0 C-N-CA 129.337 3.055 . . . . 12.42 110.853 178.359 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 15.2 t0 -58.49 -38.0 76.73 Favored 'General case' 0 C--O 1.263 1.81 0 CA-C-O 124.933 2.302 . . . . 14.56 111.277 178.081 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.99 -43.08 83.9 Favored 'General case' 0 C--O 1.269 2.105 0 CA-C-O 111.807 -3.949 . . . . 11.86 110.874 -178.957 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.77 ' O ' ' HG2' ' A' ' 47' ' ' GLN . 83.3 mt -68.14 -29.69 68.66 Favored 'General case' 0 N--CA 1.48 1.034 0 O-C-N 128.208 3.443 . . . . 13.64 111.325 -178.909 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 22.3 m-20 -58.55 -54.34 48.1 Favored 'General case' 0 C--O 1.244 0.781 0 N-CA-C 102.445 -3.169 . . . . 16.88 102.445 179.43 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 8.0 mttt -76.79 -36.76 56.77 Favored 'General case' 0 N--CA 1.491 1.597 1 CA-C-O 111.567 -4.063 . . . . 24.67 112.96 -177.851 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 31.1 mt -55.68 -30.57 61.28 Favored 'General case' 0 C--N 1.296 -1.757 0 O-C-N 128.017 3.323 . . . . 19.93 110.52 -177.4 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.77 ' HG2' ' O ' ' A' ' 43' ' ' LEU . 0.2 OUTLIER -59.79 -38.64 82.46 Favored 'General case' 0 C--O 1.252 1.225 0 CA-C-N 110.429 -3.078 . . . . 29.66 108.111 -178.234 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -57.8 -30.43 65.7 Favored 'General case' 0 C--O 1.27 2.141 0 O-C-N 126.202 2.189 . . . . 25.47 109.397 179.627 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 87.57 174.45 48.39 Favored Glycine 0 CA--C 1.543 1.787 1 CA-C-O 129.599 4.999 . . . . 22.9 110.049 -177.882 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 82.18 -2.68 83.77 Favored Glycine 0 N--CA 1.43 -1.741 1 C-N-CA 131.314 4.292 . . . . 18.84 116.547 -179.778 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 85.9 m-85 -67.37 151.69 47.0 Favored 'General case' 0 C--O 1.267 2.007 0 CA-C-N 120.216 2.008 . . . . 13.52 114.227 -178.994 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -119.26 -16.37 5.24 Favored Glycine 0 C--O 1.264 1.98 0 O-C-N 126.845 2.59 . . . . 9.32 119.57 -178.802 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . 0.297 4.0 t80 -164.43 140.72 6.18 Favored 'General case' 0 C--N 1.297 -1.707 0 CA-C-O 116.863 -1.541 . . . . 7.8 106.892 -176.311 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 54.7 t -119.82 133.41 66.66 Favored 'Isoleucine or valine' 0 C--O 1.259 1.562 0 N-CA-C 106.37 -1.715 . . . . 8.06 106.37 176.432 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 97.2 mt -119.4 116.07 49.67 Favored 'Isoleucine or valine' 0 C--O 1.251 1.172 0 O-C-N 128.655 3.722 . . . . 8.45 101.04 179.719 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' SER . . . . . 0.43 ' O ' ' N ' ' A' ' 86' ' ' VAL . 0.1 OUTLIER -143.31 149.68 38.16 Favored 'General case' 0 C--N 1.313 -0.983 1 CA-C-O 132.909 6.1 . . . . 8.75 117.113 -177.755 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 27.3 t0 -72.79 133.46 44.5 Favored 'General case' 0 C--N 1.291 -1.937 0 CA-C-N 108.903 -3.771 . . . . 17.44 111.08 178.915 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' TRP . . . . . 0.499 ' CZ3' ' HB2' ' A' ' 66' ' ' LEU . 71.5 t-105 -63.99 -46.91 82.47 Favored 'General case' 0 C--N 1.299 -1.625 0 CA-C-O 125.594 2.616 . . . . 12.03 111.542 179.204 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' ASN . . . . . 0.572 ' O ' ' HE2' ' A' ' 13' ' ' LYS . 23.0 t30 -105.36 108.3 19.74 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 112.745 -2.025 . . . . 17.78 115.807 -178.531 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' MET . . . . . 0.422 ' SD ' HG12 ' A' ' 11' ' ' VAL . 35.7 mtm -142.74 149.53 50.44 Favored Pre-proline 0 C--N 1.315 -0.932 0 N-CA-C 102.91 -2.996 . . . . 10.32 102.91 179.643 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -74.14 165.4 32.04 Favored 'Trans proline' 0 C--N 1.305 -1.756 0 C-N-CA 123.204 2.603 . . . . 9.08 111.208 178.746 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 64.5 m-20 63.53 -61.42 0.15 Allowed 'General case' 0 C--O 1.243 0.747 0 CA-C-O 113.153 -3.308 . . . . 11.92 112.317 178.064 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' MET . . . . . 0.92 ' HG3' ' HG2' ' A' ' 67' ' ' GLU . 2.9 ttm -136.68 108.53 7.09 Favored 'General case' 0 C--O 1.27 2.174 0 CA-C-N 124.282 3.219 . . . . 19.05 103.306 -178.918 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.593 ' HB3' ' O ' ' A' ' 259' ' ' HOH . 26.7 p30 -82.54 177.78 8.55 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 125.939 2.024 . . . . 12.96 116.393 -179.764 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -49.9 -55.87 13.58 Favored Glycine 0 N--CA 1.435 -1.421 0 CA-C-N 114.63 -1.168 . . . . 9.66 114.546 -179.183 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.499 ' HB2' ' CZ3' ' A' ' 58' ' ' TRP . 19.0 tp -65.75 -34.54 78.42 Favored 'General case' 0 C--O 1.271 2.196 0 O-C-N 119.001 -2.47 . . . . 10.74 110.162 -179.244 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.92 ' HG2' ' HG3' ' A' ' 63' ' ' MET . 1.5 tt0 -69.52 -41.9 75.41 Favored 'General case' 0 CA--C 1.501 -0.912 0 CA-C-O 124.753 2.216 . . . . 18.43 113.025 178.736 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 15.8 tp -67.58 -43.1 81.39 Favored 'General case' 0 C--N 1.31 -1.126 0 O-C-N 118.309 -2.744 . . . . 7.25 109.223 177.787 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 7.5 tp -59.82 -43.47 94.53 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-O 124.588 2.137 . . . . 7.59 111.69 -178.822 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 35.9 mttt -63.69 -38.84 92.61 Favored 'General case' 0 C--N 1.285 -2.208 0 O-C-N 118.067 -2.895 . . . . 15.78 109.041 -179.881 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 33.4 m -65.46 -35.86 82.16 Favored 'General case' 0 C--O 1.255 1.372 0 C-N-CA 116.217 -2.193 . . . . 12.8 106.769 179.169 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 31.5 mt -67.42 -47.31 81.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 123.555 2.889 . . . . 13.0 113.738 -177.115 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.419 ' HD3' ' HA ' ' A' ' 73' ' ' ARG . 68.4 mmt-85 -57.91 -32.19 67.51 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 109.588 -3.46 . . . . 17.27 113.636 177.781 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -87.77 -15.71 36.2 Favored 'General case' 0 C--N 1.312 -1.059 0 O-C-N 117.958 -2.964 . . . . 21.61 115.739 179.779 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.627 ' OD1' ' C ' ' A' ' 75' ' ' ASP . 20.5 t0 -87.81 116.05 25.69 Favored 'General case' 0 C--O 1.248 1.006 0 CA-C-O 124.304 2.002 . . . . 23.04 110.703 -178.926 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -33.35 -58.16 0.54 Allowed Glycine 0 C--N 1.304 -1.245 0 CA-C-O 125.444 2.691 . . . . 25.4 116.492 178.252 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -61.11 -53.85 51.89 Favored 'General case' 0 C--N 1.304 -1.393 0 C-N-CA 127.602 2.361 . . . . 26.47 116.472 179.086 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' MET . . . . . 0.582 ' HE2' ' HB3' ' A' ' 75' ' ' ASP . 7.6 mtm -94.43 -3.05 50.83 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 118.015 2.598 . . . . 28.2 118.015 -177.839 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 54.0 p -50.2 -23.29 2.12 Favored 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 117.877 2.547 . . . . 20.27 117.877 -175.338 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -97.35 -12.93 22.24 Favored 'General case' 0 C--O 1.282 2.784 0 CA-C-O 122.276 1.036 . . . . 18.75 113.574 -177.684 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . 0.275 3.7 tp -48.13 125.44 11.42 Favored Pre-proline 0 C--O 1.25 1.099 0 N-CA-C 116.24 1.941 . . . . 15.96 116.24 177.971 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -65.55 134.27 37.68 Favored 'Trans proline' 0 N--CA 1.498 1.77 0 N-CA-C 106.789 -2.043 . . . . 12.01 106.789 175.431 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 47.7 t -128.13 114.14 33.38 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.307 0 C-N-CA 129.78 3.232 . . . . 8.08 111.366 -179.287 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 37.3 tp -103.45 125.16 49.87 Favored 'General case' 0 C--O 1.248 0.976 0 N-CA-C 104.508 -2.405 . . . . 5.7 104.508 178.411 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 2.0 tpp -93.69 137.27 33.11 Favored 'General case' 0 C--O 1.256 1.41 0 O-C-N 124.827 1.329 . . . . 11.78 111.45 -179.27 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.43 ' N ' ' O ' ' A' ' 56' ' ' SER . 48.8 t -118.65 131.28 71.88 Favored 'Isoleucine or valine' 0 C--O 1.245 0.855 0 CA-C-O 126.257 2.932 . . . . 11.98 108.017 -179.591 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' THR . . . . . 0.517 HG21 ' CE2' ' A' ' 106' ' ' TYR . 15.2 t -142.28 158.99 43.11 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-O 126.008 2.814 . . . . 13.63 112.371 -179.195 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -85.17 -27.24 26.3 Favored 'General case' 0 C--O 1.254 1.316 0 C-N-CA 128.717 2.807 . . . . 16.55 114.062 176.382 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -154.33 124.59 6.89 Favored 'General case' 0 C--N 1.292 -1.91 0 CA-C-O 114.526 -2.654 . . . . 29.0 106.217 -178.096 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -78.65 131.91 36.85 Favored 'General case' 0 C--N 1.307 -1.28 1 O-C-N 130.748 5.03 . . . . 20.1 110.471 179.815 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 21.1 mttt -126.73 135.76 51.53 Favored 'General case' 0 C--O 1.218 -0.591 0 N-CA-C 101.065 -3.68 . . . . 24.66 101.065 179.998 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.473 ' HE2' HD11 ' A' ' 96' ' ' ILE . 6.2 tttt -53.44 -46.05 69.68 Favored 'General case' 0 C--N 1.296 -1.729 0 O-C-N 127.537 3.023 . . . . 22.91 114.322 -177.45 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.579 ' CD ' ' H ' ' A' ' 93' ' ' GLU . 9.3 mp0 -70.01 -29.32 66.35 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 112.673 -3.537 . . . . 29.09 111.042 178.701 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' ASN . . . . . 0.472 ' HB3' ' OH ' ' A' ' 106' ' ' TYR . 71.7 m-20 -65.92 -46.1 79.51 Favored 'General case' 0 C--O 1.279 2.616 0 CA-C-O 126.872 3.225 . . . . 16.85 111.107 177.72 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 24.2 mt -61.28 -42.32 93.08 Favored 'Isoleucine or valine' 0 C--O 1.252 1.189 0 C-N-CA 129.502 3.121 . . . . 14.48 107.305 177.778 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.473 HD11 ' HE2' ' A' ' 92' ' ' LYS . 64.6 mt -72.13 -51.82 28.16 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.842 0 CA-C-O 125.7 2.667 . . . . 12.63 109.49 179.844 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -48.71 -53.68 17.89 Favored 'General case' 0 C--O 1.256 1.397 0 O-C-N 117.821 -3.05 . . . . 11.3 108.412 -179.673 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -58.15 -54.89 41.91 Favored 'General case' 0 C--N 1.303 -1.436 0 C-N-CA 127.9 2.48 . . . . 10.34 112.717 -179.14 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -53.07 -51.33 62.17 Favored 'General case' 0 C--O 1.262 1.759 0 CA-C-O 122.539 1.161 . . . . 10.1 109.381 179.474 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 58.4 mt-30 -62.83 -33.76 75.91 Favored 'General case' 0 N--CA 1.493 1.7 0 CA-C-N 113.524 -1.671 . . . . 11.84 114.158 -178.764 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -83.87 -6.1 59.35 Favored 'General case' 0 C--O 1.281 2.715 0 C-N-CA 127.792 2.437 . . . . 13.46 110.121 175.762 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 112.46 4.32 25.19 Favored Glycine 0 C--N 1.359 1.848 1 N-CA-C 130.331 6.892 . . . . 12.83 130.331 178.394 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -56.99 141.85 44.04 Favored 'General case' 0 C--O 1.264 1.832 1 C-N-CA 133.773 4.829 . . . . 10.45 106.453 179.689 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -90.47 -20.42 22.75 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 125.59 1.806 . . . . 9.89 106.722 -177.808 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -174.63 -177.15 43.54 Favored Glycine 0 C--O 1.259 1.694 0 CA-C-O 124.814 2.341 . . . . 10.98 109.576 179.743 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' TYR . . . . . 0.521 ' OH ' ' O ' ' A' ' 247' ' ' HOH . 1.2 p90 -152.53 145.52 24.51 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 104.534 -2.395 . . . . 13.38 104.534 -178.123 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 4.1 p -139.08 141.42 36.25 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.032 0 O-C-N 126.133 2.145 . . . . 12.4 107.376 -179.484 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 5.1 t -97.42 140.34 17.93 Favored 'Isoleucine or valine' 0 C--O 1.248 0.974 0 N-CA-C 104.242 -2.503 . . . . 9.77 104.242 178.28 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 30.5 pttt -103.0 147.27 33.86 Favored Pre-proline 0 C--N 1.286 -2.178 0 C-N-CA 126.701 2.0 . . . . 17.56 109.653 -179.913 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -71.95 153.88 97.74 Favored 'Cis proline' 0 N--CA 1.454 -0.816 0 CA-C-O 116.721 -1.45 . . . . 10.29 115.174 -0.038 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 29.0 p90 -138.65 160.83 38.66 Favored 'General case' 0 C--O 1.239 0.517 0 O-C-N 126.139 2.149 . . . . 10.66 106.297 179.286 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 36.0 p -102.42 -178.06 3.58 Favored 'General case' 0 C--N 1.302 -1.474 0 C-N-CA 127.997 2.519 . . . . 10.57 110.252 179.365 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -77.35 -35.85 54.24 Favored 'General case' 0 C--O 1.268 2.03 0 CA-C-O 115.342 -2.266 . . . . 10.97 110.135 -179.846 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -58.09 -31.45 67.13 Favored 'General case' 0 C--N 1.308 -1.236 0 O-C-N 125.144 1.528 . . . . 8.59 114.538 178.314 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 82.5 m -77.89 -41.83 35.36 Favored 'General case' 0 C--N 1.3 -1.57 0 CA-C-O 117.409 -1.281 . . . . 8.66 108.206 -178.232 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.423 ' O ' ' HG ' ' A' ' 120' ' ' LEU . 11.4 tp -68.09 -39.58 82.83 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 125.741 1.9 . . . . 10.01 106.764 179.543 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -55.14 -38.47 68.28 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 123.281 1.515 . . . . 18.47 113.624 179.301 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -70.73 -41.99 71.12 Favored 'General case' 0 C--O 1.248 1.008 0 CA-C-N 112.914 -1.948 . . . . 26.27 111.688 -179.902 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' LYS . . . . . 1.051 ' HE3' ' O ' ' A' ' 252' ' ' HOH . 27.9 mmmt -65.95 -44.13 85.93 Favored 'General case' 0 CA--C 1.545 0.781 0 O-C-N 125.464 1.728 . . . . 16.45 106.917 176.966 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.423 ' HG ' ' O ' ' A' ' 116' ' ' LEU . 73.8 mt -58.76 -54.63 44.95 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 106.923 -1.51 . . . . 15.37 106.923 -179.969 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -52.17 -43.67 64.24 Favored 'General case' 0 C--O 1.256 1.401 0 CA-C-O 116.585 -1.674 . . . . 17.79 111.508 179.102 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 56.6 tttt -66.51 -40.65 89.31 Favored 'General case' 0 C--O 1.269 2.083 0 O-C-N 126.409 2.318 . . . . 21.05 110.541 -179.833 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' ILE . . . . . 0.693 ' O ' ' HG ' ' A' ' 127' ' ' LEU . 45.7 mt -67.93 -42.14 85.34 Favored 'Isoleucine or valine' 0 C--O 1.257 1.45 0 CA-C-N 121.351 1.887 . . . . 15.15 112.276 179.721 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . 0.278 23.1 m-85 -59.11 -47.34 85.63 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-O 113.574 -3.108 . . . . 17.51 104.443 -178.611 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.02 -38.39 85.84 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-N 124.088 3.131 . . . . 24.44 116.885 177.498 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 6.0 ttpt -64.97 -37.36 87.4 Favored 'General case' 0 C--O 1.263 1.806 1 O-C-N 115.199 -4.688 . . . . 21.43 107.658 178.204 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.693 ' HG ' ' O ' ' A' ' 123' ' ' ILE . 3.9 mp -84.46 -5.1 59.26 Favored 'General case' 0 N--CA 1.48 1.034 0 O-C-N 120.519 -1.363 . . . . 24.68 111.956 -178.581 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 60.75 42.26 99.36 Favored Glycine 0 N--CA 1.476 1.34 0 O-C-N 128.015 3.322 . . . . 28.61 107.81 -179.343 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 1.4 mtt . . . . . 0 C--N 1.297 -1.68 0 C-N-CA 129.528 3.131 . . . . 34.89 107.895 -179.284 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 401' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 211' ' ' HOH . . . . . 0.459 ' O ' ' CE ' ' A' ' 26' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 212' ' ' HOH . . . . . 0.832 ' O ' ' OE1' ' A' ' 67' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 234' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 235' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 236' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 237' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 238' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 239' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 240' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 241' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 242' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 243' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 244' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 245' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 246' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 247' ' ' HOH . . . . . 0.521 ' O ' ' OH ' ' A' ' 106' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 248' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 249' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 250' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 251' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 252' ' ' HOH . . . . . 1.051 ' O ' ' HE3' ' A' ' 119' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 253' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 254' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 255' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 256' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 257' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 258' ' ' HOH . . . . . 0.679 ' O ' ' HA ' ' A' ' 31' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 259' ' ' HOH . . . . . 0.593 ' O ' ' HB3' ' A' ' 64' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 260' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 261' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 262' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 263' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 264' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 265' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 266' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 267' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 268' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 269' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 270' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 271' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 272' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 273' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 274' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 275' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 276' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 277' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 278' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 279' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 280' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 281' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 282' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 283' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 284' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 285' ' ' HOH . . . . . 0.684 ' O ' ' OE1' ' A' ' 37' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 286' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 287' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 288' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 289' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 290' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 291' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 292' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 293' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 294' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 295' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 296' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 297' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 298' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 299' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 300' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_