data_3iig_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 3iig _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' ' ' SER . . . . . . . . . . . . . 74.4 m . . . . . 0 C--O 1.25 1.091 0 CA-C-O 123.319 1.533 . . . . 66.969999999999999 112.762 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 33.6 tp60 -65.2 -25.81 67.87 Favored 'General case' 0 N--CA 1.423 -1.825 0 CA-C-N 112.558 -2.11 . . . . 78.540000000000006 105.992 159.957 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -62.37 -48.52 79.39 Favored 'General case' 0 C--O 1.252 1.2 0 C-N-CA 123.567 0.747 . . . . 64.019999999999996 112.039 179.757 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' ASN . . . . . 0.597 ' OD1' ' ND2' ' A' ' 175' ' ' ASN . 1.2 m120 -56.28 -43.32 78.71 Favored 'General case' 0 C--O 1.255 1.349 0 C-N-CA 125.431 1.492 . . . . 64.299999999999997 111.539 176.368 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.93 -44.64 78.53 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 125.395 1.684 . . . . 79.560000000000002 111.083 177.328 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -67.72 -42.45 81.89 Favored 'General case' 0 N--CA 1.425 -1.714 0 CA-C-N 114.124 -1.398 . . . . 69.049999999999997 108.397 -174.57 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 4.2 mt -54.92 -48.25 73.34 Favored 'General case' 0 C--O 1.22 -0.456 0 CA-C-O 122.446 1.117 . . . . 46.170000000000002 113.143 173.371 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 2.5 t -57.37 -54.88 25.07 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.899 0 CA-C-N 115.124 -0.944 . . . . 40.850000000000001 110.705 179.655 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 69.2 t -60.3 -45.99 95.56 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 123.401 0.68 . . . . 42.799999999999997 110.711 179.14 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -59.4 -49.51 77.51 Favored 'General case' 0 C--O 1.211 -0.937 0 C-N-CA 117.479 -1.689 . . . . 48.509999999999998 113.568 174.395 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -53.57 -46.9 70.44 Favored 'General case' 0 N--CA 1.485 1.322 0 O-C-N 120.173 -1.58 . . . . 38.68 113.948 173.205 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 88.2 mt -73.58 -36.8 65.6 Favored 'General case' 0 C--O 1.283 2.828 0 C-N-CA 118.029 -1.468 . . . . 39.670000000000002 112.702 -170.002 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 68.9 m -56.91 -46.46 81.97 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 114.504 -1.226 . . . . 43.609999999999999 112.916 169.427 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 89.8 t80 -55.07 -44.32 74.71 Favored 'General case' 0 N--CA 1.436 -1.162 0 CA-C-O 121.681 0.753 . . . . 42.149999999999999 111.779 175.368 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 9.6 tppt? -71.66 -47.82 51.79 Favored 'General case' 0 C--O 1.243 0.714 0 N-CA-C 107.548 -1.278 . . . . 39.719999999999999 107.548 -173.415 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' LEU . . . . . 0.455 ' O ' ' C ' ' A' ' 18' ' ' SER . 39.7 mt -55.24 -53.59 54.13 Favored 'General case' 0 CA--C 1.577 1.995 0 N-CA-C 108.263 -1.014 . . . . 40.119999999999997 108.263 175.049 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' SER . . . . . 0.455 ' C ' ' O ' ' A' ' 17' ' ' LEU . 30.9 t -52.25 -45.2 65.27 Favored 'General case' 0 C--O 1.273 2.328 0 C-N-CA 114.312 -2.955 . . . . 39.93 112.223 -178.49 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -62.51 -33.94 75.89 Favored 'General case' 0 CA--C 1.485 -1.541 0 CA-C-N 113.759 -1.564 . . . . 38.700000000000003 110.956 -167.475 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 40.1 mmtt -100.52 1.74 41.29 Favored 'General case' 0 C--O 1.283 2.851 0 O-C-N 123.435 0.459 . . . . 47.399999999999999 111.574 -165.987 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 99.81 19.42 19.85 Favored Glycine 0 N--CA 1.48 1.576 0 O-C-N 125.056 1.472 . . . . 39.189999999999998 112.943 170.151 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 82.9 m-85 -108.89 163.6 13.15 Favored 'General case' 0 N--CA 1.433 -1.304 0 CA-C-O 121.982 0.896 . . . . 41.780000000000001 109.828 -176.678 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 26.0 t -66.47 142.85 57.41 Favored 'General case' 0 C--O 1.169 -3.168 0 N-CA-C 114.908 1.447 . . . . 46.130000000000003 114.908 170.876 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 48.8 p90 -110.93 25.75 11.44 Favored 'General case' 0 C--N 1.31 -1.151 0 O-C-N 119.433 -2.042 . . . . 46.030000000000001 112.621 167.293 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 5.8 m -63.06 -37.22 86.34 Favored 'General case' 0 C--O 1.257 1.471 0 N-CA-C 119.237 3.051 . . . . 56.509999999999998 119.237 -170.512 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . 0.286 10.9 mp0 -41.79 -14.43 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.735 0 N-CA-C 116.575 2.065 . . . . 73.780000000000001 116.575 176.475 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . 0.34 27.5 m-85 . . . . . 0 CA--C 1.588 2.436 0 N-CA-C 118.909 2.929 . . . . 66.629999999999995 118.909 -172.0 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_exo . . . . . 0 N--CA 1.486 1.05 0 CA-C-O 121.195 0.415 . . . . 68.159999999999997 112.664 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' MET . . . . . 0.421 ' CE ' ' CA ' ' A' ' 83' ' ' MET . 0.0 OUTLIER -49.01 -62.49 1.5 Allowed 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 122.764 1.269 . . . . 74.180000000000007 113.095 -165.132 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -41.54 -40.05 1.74 Allowed 'General case' 0 N--CA 1.437 -1.11 0 N-CA-C 115.145 1.535 . . . . 55.390000000000001 115.145 174.743 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -75.34 -35.37 61.18 Favored 'General case' 0 C--O 1.261 1.693 0 N-CA-C 113.634 0.975 . . . . 48.649999999999999 113.634 -178.129 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 3.4 t -63.7 -56.88 14.29 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.395 0 C-N-CA 124.625 1.17 . . . . 47.43 109.238 173.708 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 82.1 mttt -45.13 -47.12 12.21 Favored 'General case' 0 C--O 1.19 -2.052 0 N-CA-C 115.221 1.563 . . . . 60.259999999999998 115.221 174.391 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -75.61 -33.91 60.57 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 121.135 -0.978 . . . . 63.5 108.772 -173.653 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -67.72 -40.2 84.27 Favored 'General case' 0 C--O 1.216 -0.667 0 CA-C-O 121.686 0.755 . . . . 39.82 110.51 179.476 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 14.1 tp -68.73 -46.51 68.7 Favored 'General case' 0 CA--C 1.486 -1.499 0 N-CA-C 109.493 -0.558 . . . . 39.390000000000001 109.493 175.549 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 47.5 mtt180 -48.61 -60.48 2.67 Favored 'General case' 0 N--CA 1.501 2.085 0 C-N-CA 117.747 -1.581 . . . . 61.340000000000003 110.123 172.996 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . 0.252 0.0 OUTLIER -65.38 -31.68 72.91 Favored 'General case' 0 CA--C 1.483 -1.626 0 C-N-CA 116.055 -2.258 . . . . 62.259999999999998 113.95 -175.788 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -59.44 -42.47 91.98 Favored 'General case' 0 CA--C 1.498 -1.023 0 CA-C-O 117.918 -1.039 . . . . 36.270000000000003 112.573 177.828 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -67.15 -33.17 82.29 Favored Glycine 0 C--N 1.338 0.647 0 C-N-CA 118.555 -1.783 . . . . 36.32 111.871 179.007 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 66.7 m-20 -69.47 -46.15 67.36 Favored 'General case' 0 C--O 1.259 1.581 0 N-CA-C 102.754 -3.054 . . . . 43.25 102.754 -172.345 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 16.4 tp10 -60.52 -37.89 82.63 Favored 'General case' 0 N--CA 1.446 -0.656 0 O-C-N 125.388 1.68 . . . . 64.280000000000001 111.27 179.744 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -74.93 -37.38 62.05 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 118.433 0.56 . . . . 43.43 111.602 178.172 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 10.8 mt-10 -67.3 -37.08 82.79 Favored 'General case' 0 CA--C 1.548 0.879 0 N-CA-C 116.018 1.859 . . . . 52.280000000000001 116.018 173.665 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 5.0 mt -69.08 -50.0 52.31 Favored 'General case' 0 CA--C 1.485 -1.542 0 N-CA-C 107.337 -1.357 . . . . 67.170000000000002 107.337 -178.598 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 24.2 ttp-105 -61.29 -25.42 67.1 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-N 114.78 -1.1 . . . . 83.319999999999993 112.529 -176.928 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' TYR . . . . . 0.545 ' C ' ' N ' ' A' ' 103' ' ' ARG . 4.3 m-30 -106.4 -68.77 0.86 Allowed 'General case' 0 N--CA 1.442 -0.861 0 C-N-CA 118.286 -1.365 . . . . 91.349999999999994 112.619 -173.814 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 7.0 mtt180 61.32 -2.2 0.24 Allowed 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 106.667 -1.605 . . . . 101.38 106.667 -163.05 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' ARG . . . . . 0.799 ' CG ' ' O ' ' A' ' 103' ' ' ARG 0.25 0.0 OUTLIER -76.96 115.02 16.39 Favored 'General case' 0 C--O 1.258 1.538 0 N-CA-C 115.617 1.71 . . . . 105.67 115.617 168.985 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' ALA . . . . . 0.754 ' CB ' ' CA ' ' A' ' 105' ' ' ALA . . . 134.21 178.93 0.0 OUTLIER 'General case' 0 CA--C 1.567 1.627 0 O-C-N 126.027 2.079 . . . . 99.920000000000002 113.689 -174.948 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' ALA . . . . . 0.755 ' O ' ' CB ' ' A' ' 108' ' ' LEU . . . -92.66 16.34 12.39 Favored 'General case' 0 CA--C 1.551 1.019 1 N-CA-C 126.554 5.761 . . . . 99.219999999999999 126.554 12.609 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' SER . . . . . 0.527 ' N ' ' N ' ' A' ' 108' ' ' LEU . 3.3 t -113.78 -91.52 0.5 Allowed 'General case' 0 CA--C 1.492 -1.28 1 N-CA-C 99.422 -4.288 . . . . 97.739999999999995 99.422 4.02 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' ASP . . . . . 0.86 ' O ' ' CB ' ' A' ' 111' ' ' GLN . 0.2 OUTLIER -72.49 12.41 0.47 Allowed 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 106.224 -1.769 . . . . 95.049999999999997 106.224 147.579 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' LEU . . . . . 0.755 ' CB ' ' O ' ' A' ' 105' ' ' ALA 0.259 7.6 mp -77.48 -63.81 1.29 Allowed 'General case' 0 CA--C 1.48 -1.735 0 C-N-CA 117.316 -1.753 . . . . 87.980000000000004 110.59 177.396 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' THR . . . . . 0.483 ' CG2' ' CB ' ' A' ' 105' ' ' ALA . 20.5 p -61.95 -40.9 97.14 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 105.607 -1.997 . . . . 81.170000000000002 105.607 173.476 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' SER . . . . . 0.52 ' CB ' ' CA ' ' A' ' 107' ' ' ASP . 0.1 OUTLIER -47.86 -53.09 16.72 Favored 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 107.216 -1.401 . . . . 76.569999999999993 107.216 172.214 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' GLN . . . . . 0.86 ' CB ' ' O ' ' A' ' 107' ' ' ASP . 0.0 OUTLIER -61.63 -27.12 68.43 Favored 'General case' 0 C--N 1.258 -3.401 0 C-N-CA 126.481 1.912 . . . . 81.599999999999994 109.75 -177.325 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' LEU . . . . . 0.42 ' O ' ' C ' ' A' ' 113' ' ' HIS . 11.6 tp -92.56 -36.47 13.01 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 115.465 1.654 . . . . 66.879999999999995 115.465 -172.152 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' HIS . . . . . 0.42 ' C ' ' O ' ' A' ' 112' ' ' LEU . 10.3 p-80 33.33 61.47 0.43 Allowed 'General case' 0 CA--C 1.574 1.896 0 N-CA-C 112.383 0.512 . . . . 82.959999999999994 112.383 -175.888 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 1.8 tt -54.08 134.77 16.8 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.315 0 N-CA-C 116.055 1.872 . . . . 64.469999999999999 116.055 -178.333 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 3.3 p -135.45 177.05 2.41 Favored Pre-proline 0 CA--C 1.483 -1.62 0 N-CA-C 103.403 -2.814 . . . . 62.619999999999997 103.403 171.804 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_exo -78.46 -2.94 12.93 Favored 'Trans proline' 0 N--CA 1.486 1.081 0 O-C-N 123.043 1.023 . . . . 63.630000000000003 112.53 178.884 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -92.32 -9.81 61.44 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.249 -0.977 . . . . 63.340000000000003 111.709 174.862 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 92.7 m -58.47 135.84 57.37 Favored 'General case' 0 C--O 1.243 0.741 0 C-N-CA 123.889 0.876 . . . . 61.539999999999999 109.575 174.195 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -108.66 161.81 14.74 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 120.664 -0.414 . . . . 56.270000000000003 110.27 174.37 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' TYR . . . . . . . . . . . . . 50.4 t80 -43.52 -46.97 7.19 Favored 'General case' 0 CA--C 1.558 1.266 0 CA-C-O 123.429 1.585 . . . . 49.170000000000002 115.235 178.962 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -58.71 -35.68 73.05 Favored 'General case' 0 N--CA 1.386 -3.641 0 CA-C-N 114.339 -1.3 . . . . 71.890000000000001 112.599 -172.718 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 5.8 m -67.03 -44.44 80.23 Favored 'General case' 0 C--O 1.253 1.242 0 C-N-CA 119.128 -1.029 . . . . 52.149999999999999 110.999 175.438 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 45.6 t80 -54.19 -49.96 68.17 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 105.011 -2.218 . . . . 42.350000000000001 105.011 176.499 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -58.6 -40.45 83.29 Favored 'General case' 0 C--O 1.289 3.164 0 O-C-N 121.259 -0.9 . . . . 43.579999999999998 110.251 -174.901 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -64.7 -39.9 94.45 Favored 'General case' 0 C--O 1.246 0.883 0 CA-C-N 115.336 -0.847 . . . . 67.900000000000006 110.651 -172.959 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 43.0 t -70.52 -50.88 42.04 Favored 'Isoleucine or valine' 0 C--O 1.255 1.389 0 CA-C-N 114.505 -1.225 . . . . 42.200000000000003 109.926 179.914 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 97.4 t -61.91 -35.16 66.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 C-N-CA 120.312 -0.555 . . . . 40.670000000000002 110.516 -174.384 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 99.6 m-20 -45.76 -38.02 6.58 Favored 'General case' 0 C--O 1.173 -2.94 0 CA-C-O 115.704 -2.093 . . . . 44.149999999999999 111.666 168.531 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -59.12 -25.56 63.95 Favored 'General case' 0 N--CA 1.536 3.853 0 CA-C-N 122.659 2.482 . . . . 63.729999999999997 114.485 179.463 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.97 -33.08 75.01 Favored 'General case' 0 C--O 1.2 -1.506 0 CA-C-N 115.358 -0.837 . . . . 44.950000000000003 110.866 176.344 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' PHE . . . . . . . . . . . . . 69.3 m-85 -109.76 25.42 11.81 Favored 'General case' 0 CA--C 1.469 -2.167 0 C-N-CA 124.09 0.956 . . . . 40.530000000000001 113.046 -170.791 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 8.0 ptp85 -63.33 -19.75 64.89 Favored 'General case' 0 N--CA 1.424 -1.73 0 O-C-N 124.861 1.351 . . . . 73.129999999999995 112.206 177.258 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 43.1 m-20 -110.92 19.46 18.5 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 117.266 -1.773 . . . . 60.460000000000001 107.952 176.009 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 86.61 -174.44 46.53 Favored Glycine 0 C--O 1.264 1.98 0 N-CA-C 107.423 -2.271 . . . . 38.159999999999997 107.423 179.758 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 59.7 t -89.52 151.32 3.5 Favored 'Isoleucine or valine' 0 C--O 1.271 2.194 0 O-C-N 125.023 1.072 . . . . 32.170000000000002 111.375 -170.015 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' ASN . . . . . 0.543 ' ND2' ' C ' ' A' ' 136' ' ' ASN . 0.2 OUTLIER -156.42 179.75 8.96 Favored 'General case' 0 C--O 1.255 1.381 0 CA-C-N 114.614 -1.176 . . . . 37.829999999999998 109.322 159.626 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' TRP . . . . . . . . . . . . . 72.5 m95 -67.67 -42.38 82.22 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 117.131 -1.828 . . . . 35.880000000000003 110.999 -174.046 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -56.25 -34.32 62.7 Favored Glycine 0 C--O 1.21 -1.399 0 CA-C-O 118.746 -1.03 . . . . 37.210000000000001 113.558 -179.945 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 74.5 mtt180 -84.07 -27.37 28.32 Favored 'General case' 0 C--O 1.299 3.677 0 CA-C-N 118.723 1.261 . . . . 36.479999999999997 109.125 -171.5 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' ILE . . . . . . . . . . . . . 96.7 mt -68.3 -39.1 80.48 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.048 0 C-N-CA 118.467 -1.293 . . . . 34.789999999999999 111.622 166.999 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . 0.418 90.8 t -54.94 -52.13 46.53 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.242 0 C-N-CA 119.182 -1.007 . . . . 32.420000000000002 111.021 169.955 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -60.42 -32.6 71.51 Favored 'General case' 0 CA--C 1.564 1.512 0 N-CA-C 115.331 1.604 . . . . 30.739999999999998 115.331 179.493 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -63.94 -51.67 63.35 Favored 'General case' 0 C--O 1.258 1.501 0 N-CA-C 104.211 -2.514 . . . . 32.799999999999997 104.211 -179.971 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 19.9 m-85 -63.96 -46.34 85.07 Favored 'General case' 0 CA--C 1.584 2.274 0 CA-C-O 122.889 1.328 . . . . 34.829999999999998 110.185 -179.868 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 1.5 t -59.79 -37.13 78.26 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 118.619 -2.55 . . . . 37.189999999999998 109.611 177.369 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 90.3 t80 -56.76 -54.63 44.11 Favored 'General case' 0 N--CA 1.461 0.109 0 O-C-N 120.648 -1.283 . . . . 38.969999999999999 113.592 175.959 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . -49.34 -45.05 35.9 Favored Glycine 0 CA--C 1.491 -1.416 0 N-CA-C 114.597 0.599 . . . . 33.43 114.597 171.51 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -58.11 -48.91 80.02 Favored Glycine 1 C--O 1.307 4.695 0 N-CA-C 114.89 0.716 . . . . 30.629999999999999 114.89 175.617 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -58.98 -39.18 81.01 Favored 'General case' 0 N--CA 1.496 1.866 0 C-N-CA 118.443 -1.303 . . . . 34.780000000000001 111.838 178.028 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 11.0 tp -67.87 -37.24 81.56 Favored 'General case' 0 N--CA 1.441 -0.877 0 O-C-N 121.579 -0.701 . . . . 42.859999999999999 112.442 -177.856 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' CYS . . . . . . . . . . . . . 52.4 m -59.89 -43.24 94.91 Favored 'General case' 0 C--O 1.205 -1.251 0 N-CA-C 114.116 1.154 . . . . 37.829999999999998 114.116 167.839 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 2.1 t -66.57 -44.11 90.23 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.527 0 N-CA-C 107.899 -1.149 . . . . 39.270000000000003 107.899 179.547 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 84.1 mt-10 -64.5 -37.45 87.59 Favored 'General case' 0 CA--C 1.467 -2.245 0 CA-C-N 119.671 1.123 . . . . 62.829999999999998 109.52 179.974 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 63.4 m -56.47 -44.48 80.61 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 122.787 1.28 . . . . 44.390000000000001 110.752 -178.688 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 43.2 t -70.16 -46.13 73.39 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.589 0 CA-C-N 114.555 -1.202 . . . . 42.210000000000001 109.677 -177.034 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 81.7 m-20 -51.05 -30.49 15.8 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 117.891 2.552 . . . . 45.829999999999998 117.891 168.071 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 34.9 mttt -92.49 14.36 16.98 Favored 'General case' 0 N--CA 1.403 -2.805 0 N-CA-C 106.246 -1.761 . . . . 49.520000000000003 106.246 179.867 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 66.1 mm-40 58.05 39.34 26.39 Favored 'General case' 0 CA--C 1.56 1.355 0 C-N-CA 117.399 -1.72 . . . . 48.420000000000002 109.816 -178.822 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 159' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -117.79 38.86 3.5 Favored 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 107.459 -1.311 . . . . 59.57 107.459 178.975 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 160' ' ' GLN . . . . . 0.647 ' CG ' ' O ' ' A' ' 199' ' ' HOH . 61.4 mt-30 -54.49 -27.45 37.99 Favored 'General case' 0 N--CA 1.487 1.414 0 N-CA-C 117.184 2.29 . . . . 72.569999999999993 117.184 -173.503 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 24.3 m -52.08 -37.34 21.81 Favored 'Isoleucine or valine' 0 C--O 1.259 1.555 0 C-N-CA 119.343 -0.943 . . . . 55.719999999999999 112.973 174.849 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 32.9 mt -58.31 -27.08 63.77 Favored 'General case' 0 C--O 1.189 -2.104 0 O-C-N 124.164 0.915 . . . . 51.049999999999997 111.735 -178.122 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 163' ' ' VAL . . . . . . . . . . . . 0.283 5.5 t -55.83 -33.31 34.3 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.932 0 C-N-CA 117.569 -1.653 . . . . 44.32 113.762 -170.482 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 27.3 p -84.91 -26.4 27.3 Favored 'General case' 0 CA--C 1.564 1.482 0 C-N-CA 117.162 -1.815 . . . . 42.560000000000002 107.816 -172.975 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 36.8 ttm180 -63.4 -51.25 66.58 Favored 'General case' 0 N--CA 1.436 -1.146 0 C-N-CA 125.121 1.368 . . . . 65.549999999999997 112.073 172.598 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 166' ' ' ILE . . . . . . . . . . . . . 82.1 mt -59.16 -37.71 70.02 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.201 0 CA-C-O 121.786 0.803 . . . . 40.299999999999997 108.871 178.068 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 167' ' ' ALA . . . . . . . . . . . . . . . -61.72 -38.34 87.54 Favored 'General case' 0 CA--C 1.556 1.199 0 CA-C-O 122.59 1.186 . . . . 41.969999999999999 111.685 177.842 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 5.3 m -67.7 -47.34 69.7 Favored 'General case' 0 CA--C 1.499 -0.99 0 O-C-N 121.533 -0.73 . . . . 49.560000000000002 112.261 178.547 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 169' ' ' TRP . . . . . . . . . . . . . 54.1 m0 -55.76 -40.0 71.98 Favored 'General case' 0 N--CA 1.431 -1.387 0 CA-C-N 114.886 -1.052 . . . . 44.229999999999997 110.968 176.623 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 170' ' ' MET . . . . . . . . . . . . . 55.0 mtp -69.14 -37.87 78.51 Favored 'General case' 0 C--N 1.315 -0.932 0 N-CA-C 105.704 -1.962 . . . . 41.25 105.704 -173.244 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -72.26 -41.32 66.89 Favored 'General case' 0 C--O 1.264 1.862 0 C-N-CA 118.276 -1.37 . . . . 40.130000000000003 109.787 -175.307 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 172' ' ' THR . . . . . . . . . . . . . 72.1 m -55.52 -50.45 69.96 Favored 'General case' 0 N--CA 1.491 1.589 0 CA-C-N 115.315 -0.857 . . . . 40.420000000000002 109.287 173.212 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 173' ' ' TYR . . . . . . . . . . . . . 13.0 t80 -67.29 -46.32 73.94 Favored 'General case' 0 C--N 1.344 0.365 0 N-CA-C 107.251 -1.389 . . . . 38.07 107.251 -170.402 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 24.1 tp -53.1 -58.43 7.06 Favored 'General case' 0 N--CA 1.431 -1.383 0 CA-C-N 115.444 -0.798 . . . . 41.909999999999997 110.477 175.718 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 175' ' ' ASN . . . . . 0.597 ' ND2' ' OD1' ' A' ' 5' ' ' ASN . 4.3 m120 -62.94 -26.01 68.61 Favored 'General case' 0 C--O 1.251 1.143 0 N-CA-C 113.43 0.9 . . . . 56.43 113.43 -171.978 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 17.9 t0 -89.85 -60.61 1.89 Allowed 'General case' 0 C--O 1.214 -0.765 0 CA-C-N 115.543 -0.753 . . . . 55.710000000000001 110.578 -174.869 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 177' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -95.54 -18.57 20.51 Favored 'General case' 0 CA--C 1.487 -1.467 0 N-CA-C 116.494 2.035 . . . . 47.149999999999999 116.494 -174.829 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 18.8 mt -104.72 -37.52 7.05 Favored 'General case' 0 C--O 1.169 -3.153 0 N-CA-C 114.75 1.389 . . . . 36.990000000000002 114.75 -176.134 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 179' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -52.51 -44.22 93.95 Favored Pre-proline 0 N--CA 1.485 1.321 0 CA-C-O 118.294 -0.86 . . . . 65.599999999999994 113.206 179.823 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 180' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_exo -50.53 -42.64 48.53 Favored 'Trans proline' 0 N--CA 1.501 1.954 0 N-CA-C 115.88 1.454 . . . . 42.100000000000001 115.88 174.783 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 181' ' ' TRP . . . . . 0.457 ' O ' ' ND2' ' A' ' 185' ' ' ASN . 83.5 t90 -78.28 -35.55 47.86 Favored 'General case' 0 N--CA 1.485 1.314 0 CA-C-O 123.065 1.412 . . . . 40.369999999999997 108.587 -174.838 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 182' ' ' ILE . . . . . . . . . . . . . 1.2 mt -64.17 -43.72 97.41 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.072 0 N-CA-C 105.408 -2.071 . . . . 43.82 105.408 -175.513 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 83.7 mm-40 -67.97 -30.47 69.76 Favored 'General case' 0 C--O 1.202 -1.395 0 O-C-N 124.079 0.862 . . . . 63.799999999999997 110.34 -177.786 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 184' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -79.18 -21.88 45.77 Favored 'General case' 0 N--CA 1.437 -1.122 0 N-CA-C 107.591 -1.262 . . . . 55.829999999999998 107.591 -175.026 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 185' ' ' ASN . . . . . 0.457 ' ND2' ' O ' ' A' ' 181' ' ' TRP . 13.3 m-80 -113.17 20.9 15.85 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 115.996 1.851 . . . . 51.880000000000003 115.996 -175.601 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 186' ' ' GLY . . . . . . . . . . . . . . . 117.21 6.36 13.73 Favored Glycine 0 N--CA 1.428 -1.897 0 O-C-N 124.901 1.376 . . . . 46.630000000000003 112.678 161.029 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 187' ' ' GLY . . . . . . . . . . . . . . . 72.7 -176.65 42.39 Favored Glycine 0 C--O 1.206 -1.619 0 N-CA-C 108.002 -2.039 . . . . 43.630000000000003 108.002 178.023 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 188' ' ' TRP . . . . . . . . . . . . . 94.1 m95 -66.89 -21.85 65.99 Favored 'General case' 0 C--N 1.304 -1.411 0 C-N-CA 125.53 1.532 . . . . 47.890000000000001 112.789 -177.64 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 189' ' ' ASP . . . . . . . . . . . . . 84.3 m-20 -46.38 -48.42 18.58 Favored 'General case' 0 CA--C 1.489 -1.402 0 C-N-CA 125.571 1.548 . . . . 57.780000000000001 112.049 166.822 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 190' ' ' THR . . . . . . . . . . . . . 11.7 m -72.4 -32.82 66.71 Favored 'General case' 0 C--N 1.311 -1.092 0 N-CA-C 108.374 -0.972 . . . . 45.479999999999997 108.374 179.523 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 191' ' ' PHE . . . . . . . . . . . . . 70.7 t80 -64.98 -40.45 95.0 Favored 'General case' 0 C--O 1.266 1.934 0 N-CA-C 106.095 -1.817 . . . . 49.060000000000002 106.095 -175.214 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 192' ' ' VAL . . . . . . . . . . . . . 42.8 t -67.82 -46.13 82.9 Favored 'Isoleucine or valine' 0 C--O 1.173 -2.953 0 CA-C-N 113.771 -1.559 . . . . 53.200000000000003 113.152 173.684 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 193' ' ' ASP . . . . . . . . . . . . . 71.7 m-20 -49.25 -36.45 20.45 Favored 'General case' 0 N--CA 1.489 1.496 0 CA-C-N 121.395 1.907 . . . . 63.390000000000001 113.43 170.411 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 21.0 mt -91.79 -30.77 16.04 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 114.201 1.185 . . . . 55.219999999999999 114.201 -174.134 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 195' ' ' TYR . . . . . . . . . . . . . 70.5 m-85 -108.55 -46.66 3.63 Favored 'General case' 0 C--O 1.209 -1.046 0 O-C-N 121.595 -0.691 . . . . 55.240000000000002 112.427 -175.966 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 196' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.817 0 C-N-CA 124.84 1.21 . . . . 61.770000000000003 111.36 -165.455 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 197' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 198' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 199' ' ' HOH . . . . . 0.647 ' O ' ' CG ' ' A' ' 160' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 200' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' HOH . . . . . 0.706 ' O ' ' N ' ' A' ' 105' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 build full ' A' A ' 2' ' ' SER . . . . . 0.413 ' HB3' ' H ' ' A' ' 5' ' ' ASN . 74.4 m . . . . . 0 C--O 1.25 1.091 0 CA-C-O 123.319 1.533 . . . . 66.97 112.762 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 33.6 tp60 -65.2 -25.81 67.87 Favored 'General case' 0 N--CA 1.423 -1.825 0 CA-C-N 112.558 -2.11 . . . . 78.54 105.992 159.957 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -62.37 -48.52 79.39 Favored 'General case' 0 C--O 1.252 1.2 0 C-N-CA 123.567 0.747 . . . . 64.02 112.039 179.757 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 5' ' ' ASN . . . . . 0.438 ' ND2' ' OD1' ' A' ' 175' ' ' ASN . 17.4 m-20 -56.28 -43.32 78.71 Favored 'General case' 0 C--O 1.255 1.349 0 C-N-CA 125.431 1.492 . . . . 64.3 111.539 176.368 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.93 -44.64 78.53 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 125.395 1.684 . . . . 79.56 111.083 177.328 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -67.72 -42.45 81.89 Favored 'General case' 0 N--CA 1.425 -1.714 0 CA-C-N 114.124 -1.398 . . . . 69.05 108.397 -174.57 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' LEU . . . . . 0.686 HD22 ' CD2' ' A' ' 90' ' ' LEU . 4.2 mt -54.92 -48.25 73.34 Favored 'General case' 0 C--O 1.22 -0.456 0 CA-C-O 122.446 1.117 . . . . 46.17 113.143 173.371 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 2.5 t -57.37 -54.88 25.07 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.899 0 CA-C-N 115.124 -0.944 . . . . 40.85 110.705 179.655 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 69.2 t -60.3 -45.99 95.56 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 123.401 0.68 . . . . 42.8 110.711 179.14 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -59.4 -49.51 77.51 Favored 'General case' 0 C--O 1.211 -0.937 0 C-N-CA 117.479 -1.689 . . . . 48.51 113.568 174.395 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -53.57 -46.9 70.44 Favored 'General case' 0 N--CA 1.485 1.322 0 O-C-N 120.173 -1.58 . . . . 38.68 113.948 173.205 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 88.2 mt -73.58 -36.8 65.6 Favored 'General case' 0 C--O 1.283 2.828 0 C-N-CA 118.029 -1.468 . . . . 39.67 112.702 -170.002 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 68.9 m -56.91 -46.46 81.97 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 114.504 -1.226 . . . . 43.61 112.916 169.427 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 89.8 t80 -55.07 -44.32 74.71 Favored 'General case' 0 N--CA 1.436 -1.162 0 CA-C-O 121.681 0.753 . . . . 42.15 111.779 175.368 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 9.6 tppt? -71.66 -47.82 51.79 Favored 'General case' 0 C--O 1.243 0.714 0 N-CA-C 107.548 -1.278 . . . . 39.72 107.548 -173.415 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' LEU . . . . . 0.455 ' O ' ' C ' ' A' ' 18' ' ' SER . 39.7 mt -55.24 -53.59 54.13 Favored 'General case' 0 CA--C 1.577 1.995 0 N-CA-C 108.263 -1.014 . . . . 40.12 108.263 175.049 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 18' ' ' SER . . . . . 0.455 ' C ' ' O ' ' A' ' 17' ' ' LEU . 30.9 t -52.25 -45.2 65.27 Favored 'General case' 0 C--O 1.273 2.328 0 C-N-CA 114.312 -2.955 . . . . 39.93 112.223 -178.49 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -62.51 -33.94 75.89 Favored 'General case' 0 CA--C 1.485 -1.541 0 CA-C-N 113.759 -1.564 . . . . 38.7 110.956 -167.475 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 40.1 mmtt -100.52 1.74 41.29 Favored 'General case' 0 C--O 1.283 2.851 0 O-C-N 123.435 0.459 . . . . 47.4 111.574 -165.987 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 99.81 19.42 19.85 Favored Glycine 0 N--CA 1.48 1.576 0 O-C-N 125.056 1.472 . . . . 39.19 112.943 170.151 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 82.9 m-85 -108.89 163.6 13.15 Favored 'General case' 0 N--CA 1.433 -1.304 0 CA-C-O 121.982 0.896 . . . . 41.78 109.828 -176.678 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 26.0 t -66.47 142.85 57.41 Favored 'General case' 0 C--O 1.169 -3.168 0 N-CA-C 114.908 1.447 . . . . 46.13 114.908 170.876 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 48.8 p90 -110.93 25.75 11.44 Favored 'General case' 0 C--N 1.31 -1.151 0 O-C-N 119.433 -2.042 . . . . 46.03 112.621 167.293 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 5.8 m -63.06 -37.22 86.34 Favored 'General case' 0 C--O 1.257 1.471 0 N-CA-C 119.237 3.051 . . . . 56.51 119.237 -170.512 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . 0.286 10.9 mp0 -41.79 -14.43 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.735 0 N-CA-C 116.575 2.065 . . . . 73.78 116.575 176.475 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . 0.34 27.5 m-85 . . . . . 0 CA--C 1.588 2.436 0 N-CA-C 118.909 2.929 . . . . 66.63 118.909 -172.0 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' PRO . . . . . 0.569 ' O ' HG23 ' A' ' 86' ' ' VAL . 13.3 Cg_exo . . . . . 0 N--CA 1.486 1.05 0 CA-C-O 121.195 0.415 . . . . 68.16 112.664 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' MET . . . . . 0.7 ' HE2' ' HA ' ' A' ' 83' ' ' MET . 0.0 OUTLIER -49.01 -62.49 1.5 Allowed 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 122.764 1.269 . . . . 74.18 113.095 -165.132 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -41.54 -40.05 1.74 Allowed 'General case' 0 N--CA 1.437 -1.11 0 N-CA-C 115.145 1.535 . . . . 55.39 115.145 174.743 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -75.34 -35.37 61.18 Favored 'General case' 0 C--O 1.261 1.693 0 N-CA-C 113.634 0.975 . . . . 48.65 113.634 -178.129 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' VAL . . . . . 0.569 HG23 ' O ' ' A' ' 82' ' ' PRO . 3.4 t -63.7 -56.88 14.29 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.395 0 C-N-CA 124.625 1.17 . . . . 47.43 109.238 173.708 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 87' ' ' LYS . . . . . 0.535 ' HE3' ' HG3' ' A' ' 83' ' ' MET . 82.1 mttt -45.13 -47.12 12.21 Favored 'General case' 0 C--O 1.19 -2.052 0 N-CA-C 115.221 1.563 . . . . 60.26 115.221 174.391 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -75.61 -33.91 60.57 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 121.135 -0.978 . . . . 63.5 108.772 -173.653 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -67.72 -40.2 84.27 Favored 'General case' 0 C--O 1.216 -0.667 0 CA-C-O 121.686 0.755 . . . . 39.82 110.51 179.476 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' LEU . . . . . 0.686 ' CD2' HD22 ' A' ' 8' ' ' LEU . 14.1 tp -68.73 -46.51 68.7 Favored 'General case' 0 CA--C 1.486 -1.499 0 N-CA-C 109.493 -0.558 . . . . 39.39 109.493 175.549 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 47.5 mtt180 -48.61 -60.48 2.67 Favored 'General case' 0 N--CA 1.501 2.085 0 C-N-CA 117.747 -1.581 . . . . 61.34 110.123 172.996 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . 0.252 0.0 OUTLIER -65.38 -31.68 72.91 Favored 'General case' 0 CA--C 1.483 -1.626 0 C-N-CA 116.055 -2.258 . . . . 62.26 113.95 -175.788 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -59.44 -42.47 91.98 Favored 'General case' 0 CA--C 1.498 -1.023 0 CA-C-O 117.918 -1.039 . . . . 36.27 112.573 177.828 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -67.15 -33.17 82.29 Favored Glycine 0 C--N 1.338 0.647 0 C-N-CA 118.555 -1.783 . . . . 36.32 111.871 179.007 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 66.7 m-20 -69.47 -46.15 67.36 Favored 'General case' 0 C--O 1.259 1.581 0 N-CA-C 102.754 -3.054 . . . . 43.25 102.754 -172.345 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 16.4 tp10 -60.52 -37.89 82.63 Favored 'General case' 0 N--CA 1.446 -0.656 0 O-C-N 125.388 1.68 . . . . 64.28 111.27 179.744 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -74.93 -37.38 62.05 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 118.433 0.56 . . . . 43.43 111.602 178.172 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 10.8 mt-10 -67.3 -37.08 82.79 Favored 'General case' 0 CA--C 1.548 0.879 0 N-CA-C 116.018 1.859 . . . . 52.28 116.018 173.665 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 5.0 mt -69.08 -50.0 52.31 Favored 'General case' 0 CA--C 1.485 -1.542 0 N-CA-C 107.337 -1.357 . . . . 67.17 107.337 -178.598 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' ARG . . . . . 0.443 ' HG2' ' CD1' ' A' ' 101' ' ' TYR . 24.2 ttp-105 -61.29 -25.42 67.1 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-N 114.78 -1.1 . . . . 83.32 112.529 -176.928 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 101' ' ' TYR . . . . . 0.766 ' HD2' ' HG2' ' A' ' 103' ' ' ARG . 4.3 m-30 -106.4 -68.77 0.86 Allowed 'General case' 0 N--CA 1.442 -0.861 0 C-N-CA 118.286 -1.365 . . . . 91.35 112.619 -173.814 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 102' ' ' ARG . . . . . 0.463 ' HB2' ' O ' ' A' ' 101' ' ' TYR . 7.0 mtt180 61.32 -2.2 0.24 Allowed 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 106.667 -1.605 . . . . 101.38 106.667 -163.05 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 103' ' ' ARG . . . . . 0.969 ' O ' ' HG3' ' A' ' 103' ' ' ARG 0.25 0.0 OUTLIER -76.96 115.02 16.39 Favored 'General case' 0 C--O 1.258 1.538 0 N-CA-C 115.617 1.71 . . . . 105.67 115.617 168.985 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 104' ' ' ALA . . . . . 1.146 ' CB ' ' HA ' ' A' ' 105' ' ' ALA . . . 134.21 178.93 0.0 OUTLIER 'General case' 0 CA--C 1.567 1.627 0 O-C-N 126.027 2.079 . . . . 99.92 113.689 -174.948 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 105' ' ' ALA . . . . . 1.146 ' HA ' ' CB ' ' A' ' 104' ' ' ALA . . . -92.66 16.34 12.39 Favored 'General case' 0 CA--C 1.551 1.019 1 N-CA-C 126.554 5.761 . . . . 99.22 126.554 12.609 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 106' ' ' SER . . . . . 0.888 ' H ' ' H ' ' A' ' 108' ' ' LEU . 3.3 t -113.78 -91.52 0.5 Allowed 'General case' 0 CA--C 1.492 -1.28 1 N-CA-C 99.422 -4.288 . . . . 97.74 99.422 4.02 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 107' ' ' ASP . . . . . 1.174 ' O ' ' HB2' ' A' ' 111' ' ' GLN . 0.2 OUTLIER -72.49 12.41 0.47 Allowed 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 106.224 -1.769 . . . . 95.05 106.224 147.579 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 108' ' ' LEU . . . . . 0.913 ' HB2' ' O ' ' A' ' 105' ' ' ALA 0.259 7.6 mp -77.48 -63.81 1.29 Allowed 'General case' 0 CA--C 1.48 -1.735 0 C-N-CA 117.316 -1.753 . . . . 87.98 110.59 177.396 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 109' ' ' THR . . . . . 0.766 ' OG1' ' HB3' ' A' ' 105' ' ' ALA . 20.5 p -61.95 -40.9 97.14 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 105.607 -1.997 . . . . 81.17 105.607 173.476 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 110' ' ' SER . . . . . 0.899 ' CB ' ' HA ' ' A' ' 107' ' ' ASP . 0.1 OUTLIER -47.86 -53.09 16.72 Favored 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 107.216 -1.401 . . . . 76.57 107.216 172.214 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 111' ' ' GLN . . . . . 1.174 ' HB2' ' O ' ' A' ' 107' ' ' ASP . 0.2 OUTLIER -61.63 -27.12 68.43 Favored 'General case' 0 C--N 1.258 -3.401 0 C-N-CA 126.481 1.912 . . . . 81.6 109.75 -177.325 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 112' ' ' LEU . . . . . 0.42 ' O ' ' C ' ' A' ' 113' ' ' HIS . 11.6 tp -92.56 -36.47 13.01 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 115.465 1.654 . . . . 66.88 115.465 -172.152 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 113' ' ' HIS . . . . . 0.42 ' C ' ' O ' ' A' ' 112' ' ' LEU . 26.4 p80 33.33 61.47 0.43 Allowed 'General case' 0 CA--C 1.574 1.896 0 N-CA-C 112.383 0.512 . . . . 82.96 112.383 -175.888 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 114' ' ' ILE . . . . . 0.881 HG12 HD13 ' A' ' 162' ' ' LEU . 1.8 tt -54.08 134.77 16.8 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.315 0 N-CA-C 116.055 1.872 . . . . 64.47 116.055 -178.333 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 115' ' ' THR . . . . . 0.431 ' HA ' ' HE3' ' A' ' 159' ' ' MET . 3.3 p -135.45 177.05 2.41 Favored Pre-proline 0 CA--C 1.483 -1.62 0 N-CA-C 103.403 -2.814 . . . . 62.62 103.403 171.804 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_exo -78.46 -2.94 12.93 Favored 'Trans proline' 0 N--CA 1.486 1.081 0 O-C-N 123.043 1.023 . . . . 63.63 112.53 178.884 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -92.32 -9.81 61.44 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.249 -0.977 . . . . 63.34 111.709 174.862 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 92.7 m -58.47 135.84 57.37 Favored 'General case' 0 C--O 1.243 0.741 0 C-N-CA 123.889 0.876 . . . . 61.54 109.575 174.195 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -108.66 161.81 14.74 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 120.664 -0.414 . . . . 56.27 110.27 174.37 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' TYR . . . . . . . . . . . . . 50.4 t80 -43.52 -46.97 7.19 Favored 'General case' 0 CA--C 1.558 1.266 0 CA-C-O 123.429 1.585 . . . . 49.17 115.235 178.962 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -58.71 -35.68 73.05 Favored 'General case' 0 N--CA 1.386 -3.641 0 CA-C-N 114.339 -1.3 . . . . 71.89 112.599 -172.718 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 5.8 m -67.03 -44.44 80.23 Favored 'General case' 0 C--O 1.253 1.242 0 C-N-CA 119.128 -1.029 . . . . 52.15 110.999 175.438 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 45.6 t80 -54.19 -49.96 68.17 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 105.011 -2.218 . . . . 42.35 105.011 176.499 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -58.6 -40.45 83.29 Favored 'General case' 0 C--O 1.289 3.164 0 O-C-N 121.259 -0.9 . . . . 43.58 110.251 -174.901 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 5.3 mt-30 -64.7 -39.9 94.45 Favored 'General case' 0 C--O 1.246 0.883 0 CA-C-N 115.336 -0.847 . . . . 67.9 110.651 -172.959 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 43.0 t -70.52 -50.88 42.04 Favored 'Isoleucine or valine' 0 C--O 1.255 1.389 0 CA-C-N 114.505 -1.225 . . . . 42.2 109.926 179.914 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 97.4 t -61.91 -35.16 66.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 C-N-CA 120.312 -0.555 . . . . 40.67 110.516 -174.384 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 99.6 m-20 -45.76 -38.02 6.58 Favored 'General case' 0 C--O 1.173 -2.94 0 CA-C-O 115.704 -2.093 . . . . 44.15 111.666 168.531 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -59.12 -25.56 63.95 Favored 'General case' 0 N--CA 1.536 3.853 0 CA-C-N 122.659 2.482 . . . . 63.73 114.485 179.463 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.97 -33.08 75.01 Favored 'General case' 0 C--O 1.2 -1.506 0 CA-C-N 115.358 -0.837 . . . . 44.95 110.866 176.344 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 131' ' ' PHE . . . . . . . . . . . . . 69.3 m-85 -109.76 25.42 11.81 Favored 'General case' 0 CA--C 1.469 -2.167 0 C-N-CA 124.09 0.956 . . . . 40.53 113.046 -170.791 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 8.0 ptp85 -63.33 -19.75 64.89 Favored 'General case' 0 N--CA 1.424 -1.73 0 O-C-N 124.861 1.351 . . . . 73.13 112.206 177.258 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 43.1 m-20 -110.92 19.46 18.5 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 117.266 -1.773 . . . . 60.46 107.952 176.009 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 86.61 -174.44 46.53 Favored Glycine 0 C--O 1.264 1.98 0 N-CA-C 107.423 -2.271 . . . . 38.16 107.423 179.758 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 59.7 t -89.52 151.32 3.5 Favored 'Isoleucine or valine' 0 C--O 1.271 2.194 0 O-C-N 125.023 1.072 . . . . 32.17 111.375 -170.015 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 44.0 p30 -156.42 179.75 8.96 Favored 'General case' 0 C--O 1.255 1.381 0 CA-C-N 114.614 -1.176 . . . . 37.83 109.322 159.626 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' TRP . . . . . . . . . . . . . 72.5 m95 -67.67 -42.38 82.22 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 117.131 -1.828 . . . . 35.88 110.999 -174.046 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -56.25 -34.32 62.7 Favored Glycine 0 C--O 1.21 -1.399 0 CA-C-O 118.746 -1.03 . . . . 37.21 113.558 -179.945 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 74.5 mtt180 -84.07 -27.37 28.32 Favored 'General case' 0 C--O 1.299 3.677 0 CA-C-N 118.723 1.261 . . . . 36.48 109.125 -171.5 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 140' ' ' ILE . . . . . 0.559 HD13 HD11 ' A' ' 182' ' ' ILE . 96.7 mt -68.3 -39.1 80.48 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.048 0 C-N-CA 118.467 -1.293 . . . . 34.79 111.622 166.999 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . 0.418 90.8 t -54.94 -52.13 46.53 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.242 0 C-N-CA 119.182 -1.007 . . . . 32.42 111.021 169.955 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -60.42 -32.6 71.51 Favored 'General case' 0 CA--C 1.564 1.512 0 N-CA-C 115.331 1.604 . . . . 30.74 115.331 179.493 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -63.94 -51.67 63.35 Favored 'General case' 0 C--O 1.258 1.501 0 N-CA-C 104.211 -2.514 . . . . 32.8 104.211 -179.971 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 19.9 m-85 -63.96 -46.34 85.07 Favored 'General case' 0 CA--C 1.584 2.274 0 CA-C-O 122.889 1.328 . . . . 34.83 110.185 -179.868 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 1.5 t -59.79 -37.13 78.26 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 118.619 -2.55 . . . . 37.19 109.611 177.369 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 146' ' ' PHE . . . . . 0.513 ' CE1' ' HB3' ' A' ' 108' ' ' LEU . 90.3 t80 -56.76 -54.63 44.11 Favored 'General case' 0 N--CA 1.461 0.109 0 O-C-N 120.648 -1.283 . . . . 38.97 113.592 175.959 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 147' ' ' GLY . . . . . 0.446 ' HA3' ' SD ' ' A' ' 170' ' ' MET . . . -49.34 -45.05 35.9 Favored Glycine 0 CA--C 1.491 -1.416 0 N-CA-C 114.597 0.599 . . . . 33.43 114.597 171.51 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -58.11 -48.91 80.02 Favored Glycine 1 C--O 1.307 4.695 0 N-CA-C 114.89 0.716 . . . . 30.63 114.89 175.617 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -58.98 -39.18 81.01 Favored 'General case' 0 N--CA 1.496 1.866 0 C-N-CA 118.443 -1.303 . . . . 34.78 111.838 178.028 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 150' ' ' LEU . . . . . 0.452 HD13 HG22 ' A' ' 109' ' ' THR . 11.0 tp -67.87 -37.24 81.56 Favored 'General case' 0 N--CA 1.441 -0.877 0 O-C-N 121.579 -0.701 . . . . 42.86 112.442 -177.856 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 151' ' ' CYS . . . . . . . . . . . . . 52.4 m -59.89 -43.24 94.91 Favored 'General case' 0 C--O 1.205 -1.251 0 N-CA-C 114.116 1.154 . . . . 37.83 114.116 167.839 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 2.1 t -66.57 -44.11 90.23 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.527 0 N-CA-C 107.899 -1.149 . . . . 39.27 107.899 179.547 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 84.1 mt-10 -64.5 -37.45 87.59 Favored 'General case' 0 CA--C 1.467 -2.245 0 CA-C-N 119.671 1.123 . . . . 62.83 109.52 179.974 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 63.4 m -56.47 -44.48 80.61 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 122.787 1.28 . . . . 44.39 110.752 -178.688 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 43.2 t -70.16 -46.13 73.39 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.589 0 CA-C-N 114.555 -1.202 . . . . 42.21 109.677 -177.034 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 81.7 m-20 -51.05 -30.49 15.8 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 117.891 2.552 . . . . 45.83 117.891 168.071 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 34.9 mttt -92.49 14.36 16.98 Favored 'General case' 0 N--CA 1.403 -2.805 0 N-CA-C 106.246 -1.761 . . . . 49.52 106.246 179.867 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 66.1 mm-40 58.05 39.34 26.39 Favored 'General case' 0 CA--C 1.56 1.355 0 C-N-CA 117.399 -1.72 . . . . 48.42 109.816 -178.822 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 159' ' ' MET . . . . . 0.431 ' HE3' ' HA ' ' A' ' 115' ' ' THR . 0.3 OUTLIER -117.79 38.86 3.5 Favored 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 107.459 -1.311 . . . . 59.57 107.459 178.975 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 160' ' ' GLN . . . . . 1.0 ' HG3' ' O ' ' A' ' 199' ' ' HOH . 61.4 mt-30 -54.49 -27.45 37.99 Favored 'General case' 0 N--CA 1.487 1.414 0 N-CA-C 117.184 2.29 . . . . 72.57 117.184 -173.503 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 24.3 m -52.08 -37.34 21.81 Favored 'Isoleucine or valine' 0 C--O 1.259 1.555 0 C-N-CA 119.343 -0.943 . . . . 55.72 112.973 174.849 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 162' ' ' LEU . . . . . 0.881 HD13 HG12 ' A' ' 114' ' ' ILE . 32.9 mt -58.31 -27.08 63.77 Favored 'General case' 0 C--O 1.189 -2.104 0 O-C-N 124.164 0.915 . . . . 51.05 111.735 -178.122 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 163' ' ' VAL . . . . . . . . . . . . 0.283 5.5 t -55.83 -33.31 34.3 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.932 0 C-N-CA 117.569 -1.653 . . . . 44.32 113.762 -170.482 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 27.3 p -84.91 -26.4 27.3 Favored 'General case' 0 CA--C 1.564 1.482 0 C-N-CA 117.162 -1.815 . . . . 42.56 107.816 -172.975 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 36.8 ttm180 -63.4 -51.25 66.58 Favored 'General case' 0 N--CA 1.436 -1.146 0 C-N-CA 125.121 1.368 . . . . 65.55 112.073 172.598 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 166' ' ' ILE . . . . . . . . . . . . . 82.1 mt -59.16 -37.71 70.02 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.201 0 CA-C-O 121.786 0.803 . . . . 40.3 108.871 178.068 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 167' ' ' ALA . . . . . . . . . . . . . . . -61.72 -38.34 87.54 Favored 'General case' 0 CA--C 1.556 1.199 0 CA-C-O 122.59 1.186 . . . . 41.97 111.685 177.842 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 5.3 m -67.7 -47.34 69.7 Favored 'General case' 0 CA--C 1.499 -0.99 0 O-C-N 121.533 -0.73 . . . . 49.56 112.261 178.547 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 169' ' ' TRP . . . . . . . . . . . . . 54.1 m0 -55.76 -40.0 71.98 Favored 'General case' 0 N--CA 1.431 -1.387 0 CA-C-N 114.886 -1.052 . . . . 44.23 110.968 176.623 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 170' ' ' MET . . . . . 0.446 ' SD ' ' HA3' ' A' ' 147' ' ' GLY . 55.0 mtp -69.14 -37.87 78.51 Favored 'General case' 0 C--N 1.315 -0.932 0 N-CA-C 105.704 -1.962 . . . . 41.25 105.704 -173.244 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -72.26 -41.32 66.89 Favored 'General case' 0 C--O 1.264 1.862 0 C-N-CA 118.276 -1.37 . . . . 40.13 109.787 -175.307 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 172' ' ' THR . . . . . . . . . . . . . 72.1 m -55.52 -50.45 69.96 Favored 'General case' 0 N--CA 1.491 1.589 0 CA-C-N 115.315 -0.857 . . . . 40.42 109.287 173.212 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 173' ' ' TYR . . . . . . . . . . . . . 13.0 t80 -67.29 -46.32 73.94 Favored 'General case' 0 C--N 1.344 0.365 0 N-CA-C 107.251 -1.389 . . . . 38.07 107.251 -170.402 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 24.1 tp -53.1 -58.43 7.06 Favored 'General case' 0 N--CA 1.431 -1.383 0 CA-C-N 115.444 -0.798 . . . . 41.91 110.477 175.718 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 175' ' ' ASN . . . . . 0.438 ' OD1' ' ND2' ' A' ' 5' ' ' ASN . 66.3 m-20 -62.94 -26.01 68.61 Favored 'General case' 0 C--O 1.251 1.143 0 N-CA-C 113.43 0.9 . . . . 56.43 113.43 -171.978 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 17.9 t0 -89.85 -60.61 1.89 Allowed 'General case' 0 C--O 1.214 -0.765 0 CA-C-N 115.543 -0.753 . . . . 55.71 110.578 -174.869 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 177' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -95.54 -18.57 20.51 Favored 'General case' 0 CA--C 1.487 -1.467 0 N-CA-C 116.494 2.035 . . . . 47.15 116.494 -174.829 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 18.8 mt -104.72 -37.52 7.05 Favored 'General case' 0 C--O 1.169 -3.153 0 N-CA-C 114.75 1.389 . . . . 36.99 114.75 -176.134 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 179' ' ' GLU . . . . . 0.403 ' N ' ' HD2' ' A' ' 180' ' ' PRO . 3.4 tp10 -52.51 -44.22 93.95 Favored Pre-proline 0 N--CA 1.485 1.321 0 CA-C-O 118.294 -0.86 . . . . 65.6 113.206 179.823 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 180' ' ' PRO . . . . . 0.403 ' HD2' ' N ' ' A' ' 179' ' ' GLU . 10.7 Cg_exo -50.53 -42.64 48.53 Favored 'Trans proline' 0 N--CA 1.501 1.954 0 N-CA-C 115.88 1.454 . . . . 42.1 115.88 174.783 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 181' ' ' TRP . . . . . . . . . . . . . 83.5 t90 -78.28 -35.55 47.86 Favored 'General case' 0 N--CA 1.485 1.314 0 CA-C-O 123.065 1.412 . . . . 40.37 108.587 -174.838 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 182' ' ' ILE . . . . . 0.559 HD11 HD13 ' A' ' 140' ' ' ILE . 1.2 mt -64.17 -43.72 97.41 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.072 0 N-CA-C 105.408 -2.071 . . . . 43.82 105.408 -175.513 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 83.7 mm-40 -67.97 -30.47 69.76 Favored 'General case' 0 C--O 1.202 -1.395 0 O-C-N 124.079 0.862 . . . . 63.8 110.34 -177.786 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 184' ' ' GLU . . . . . 0.51 ' O ' ' HG3' ' A' ' 184' ' ' GLU . 5.3 tp10 -79.18 -21.88 45.77 Favored 'General case' 0 N--CA 1.437 -1.122 0 N-CA-C 107.591 -1.262 . . . . 55.83 107.591 -175.026 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 185' ' ' ASN . . . . . . . . . . . . . 13.3 m-80 -113.17 20.9 15.85 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 115.996 1.851 . . . . 51.88 115.996 -175.601 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 186' ' ' GLY . . . . . . . . . . . . . . . 117.21 6.36 13.73 Favored Glycine 0 N--CA 1.428 -1.897 0 O-C-N 124.901 1.376 . . . . 46.63 112.678 161.029 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 187' ' ' GLY . . . . . . . . . . . . . . . 72.7 -176.65 42.39 Favored Glycine 0 C--O 1.206 -1.619 0 N-CA-C 108.002 -2.039 . . . . 43.63 108.002 178.023 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 188' ' ' TRP . . . . . . . . . . . . . 94.1 m95 -66.89 -21.85 65.99 Favored 'General case' 0 C--N 1.304 -1.411 0 C-N-CA 125.53 1.532 . . . . 47.89 112.789 -177.64 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 189' ' ' ASP . . . . . . . . . . . . . 84.3 m-20 -46.38 -48.42 18.58 Favored 'General case' 0 CA--C 1.489 -1.402 0 C-N-CA 125.571 1.548 . . . . 57.78 112.049 166.822 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 190' ' ' THR . . . . . . . . . . . . . 11.7 m -72.4 -32.82 66.71 Favored 'General case' 0 C--N 1.311 -1.092 0 N-CA-C 108.374 -0.972 . . . . 45.48 108.374 179.523 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 191' ' ' PHE . . . . . . . . . . . . . 70.7 t80 -64.98 -40.45 95.0 Favored 'General case' 0 C--O 1.266 1.934 0 N-CA-C 106.095 -1.817 . . . . 49.06 106.095 -175.214 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 192' ' ' VAL . . . . . . . . . . . . . 42.8 t -67.82 -46.13 82.9 Favored 'Isoleucine or valine' 0 C--O 1.173 -2.953 0 CA-C-N 113.771 -1.559 . . . . 53.2 113.152 173.684 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 193' ' ' ASP . . . . . . . . . . . . . 71.7 m-20 -49.25 -36.45 20.45 Favored 'General case' 0 N--CA 1.489 1.496 0 CA-C-N 121.395 1.907 . . . . 63.39 113.43 170.411 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 21.0 mt -91.79 -30.77 16.04 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 114.201 1.185 . . . . 55.22 114.201 -174.134 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 195' ' ' TYR . . . . . . . . . . . . . 70.5 m-85 -108.55 -46.66 3.63 Favored 'General case' 0 C--O 1.209 -1.046 0 O-C-N 121.595 -0.691 . . . . 55.24 112.427 -175.966 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 196' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.817 0 C-N-CA 124.84 1.21 . . . . 61.77 111.36 -165.455 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 197' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 198' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 199' ' ' HOH . . . . . 1.0 ' O ' ' HG3' ' A' ' 160' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 200' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 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 . . . . . 0.464 ' O ' ' N ' ' A' ' 105' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 nobuild full ' A' A ' 2' ' ' SER . . . . . 0.413 ' HB3' ' H ' ' A' ' 5' ' ' ASN . 74.4 m . . . . . 0 C--O 1.25 1.091 0 CA-C-O 123.319 1.533 . . . . 66.97 112.762 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 33.6 tp60 -65.2 -25.81 67.87 Favored 'General case' 0 N--CA 1.423 -1.825 0 CA-C-N 112.558 -2.11 . . . . 78.54 105.992 159.957 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -62.37 -48.52 79.39 Favored 'General case' 0 C--O 1.252 1.2 0 C-N-CA 123.567 0.747 . . . . 64.02 112.039 179.757 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.597 ' OD1' ' ND2' ' A' ' 175' ' ' ASN . 1.2 m120 -56.28 -43.32 78.71 Favored 'General case' 0 C--O 1.255 1.349 0 C-N-CA 125.431 1.492 . . . . 64.3 111.539 176.368 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.93 -44.64 78.53 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 125.395 1.684 . . . . 79.56 111.083 177.328 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -67.72 -42.45 81.89 Favored 'General case' 0 N--CA 1.425 -1.714 0 CA-C-N 114.124 -1.398 . . . . 69.05 108.397 -174.57 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.686 HD22 ' CD2' ' A' ' 90' ' ' LEU . 4.2 mt -54.92 -48.25 73.34 Favored 'General case' 0 C--O 1.22 -0.456 0 CA-C-O 122.446 1.117 . . . . 46.17 113.143 173.371 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 2.5 t -57.37 -54.88 25.07 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.899 0 CA-C-N 115.124 -0.944 . . . . 40.85 110.705 179.655 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 69.2 t -60.3 -45.99 95.56 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 123.401 0.68 . . . . 42.8 110.711 179.14 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -59.4 -49.51 77.51 Favored 'General case' 0 C--O 1.211 -0.937 0 C-N-CA 117.479 -1.689 . . . . 48.51 113.568 174.395 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -53.57 -46.9 70.44 Favored 'General case' 0 N--CA 1.485 1.322 0 O-C-N 120.173 -1.58 . . . . 38.68 113.948 173.205 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 88.2 mt -73.58 -36.8 65.6 Favored 'General case' 0 C--O 1.283 2.828 0 C-N-CA 118.029 -1.468 . . . . 39.67 112.702 -170.002 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 68.9 m -56.91 -46.46 81.97 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 114.504 -1.226 . . . . 43.61 112.916 169.427 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 89.8 t80 -55.07 -44.32 74.71 Favored 'General case' 0 N--CA 1.436 -1.162 0 CA-C-O 121.681 0.753 . . . . 42.15 111.779 175.368 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 9.6 tppt? -71.66 -47.82 51.79 Favored 'General case' 0 C--O 1.243 0.714 0 N-CA-C 107.548 -1.278 . . . . 39.72 107.548 -173.415 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.455 ' O ' ' C ' ' A' ' 18' ' ' SER . 39.7 mt -55.24 -53.59 54.13 Favored 'General case' 0 CA--C 1.577 1.995 0 N-CA-C 108.263 -1.014 . . . . 40.12 108.263 175.049 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' SER . . . . . 0.455 ' C ' ' O ' ' A' ' 17' ' ' LEU . 30.9 t -52.25 -45.2 65.27 Favored 'General case' 0 C--O 1.273 2.328 0 C-N-CA 114.312 -2.955 . . . . 39.93 112.223 -178.49 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -62.51 -33.94 75.89 Favored 'General case' 0 CA--C 1.485 -1.541 0 CA-C-N 113.759 -1.564 . . . . 38.7 110.956 -167.475 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 40.1 mmtt -100.52 1.74 41.29 Favored 'General case' 0 C--O 1.283 2.851 0 O-C-N 123.435 0.459 . . . . 47.4 111.574 -165.987 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 99.81 19.42 19.85 Favored Glycine 0 N--CA 1.48 1.576 0 O-C-N 125.056 1.472 . . . . 39.19 112.943 170.151 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 82.9 m-85 -108.89 163.6 13.15 Favored 'General case' 0 N--CA 1.433 -1.304 0 CA-C-O 121.982 0.896 . . . . 41.78 109.828 -176.678 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 26.0 t -66.47 142.85 57.41 Favored 'General case' 0 C--O 1.169 -3.168 0 N-CA-C 114.908 1.447 . . . . 46.13 114.908 170.876 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 48.8 p90 -110.93 25.75 11.44 Favored 'General case' 0 C--N 1.31 -1.151 0 O-C-N 119.433 -2.042 . . . . 46.03 112.621 167.293 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 5.8 m -63.06 -37.22 86.34 Favored 'General case' 0 C--O 1.257 1.471 0 N-CA-C 119.237 3.051 . . . . 56.51 119.237 -170.512 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . 0.286 10.9 mp0 -41.79 -14.43 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.735 0 N-CA-C 116.575 2.065 . . . . 73.78 116.575 176.475 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . 0.34 27.5 m-85 . . . . . 0 CA--C 1.588 2.436 0 N-CA-C 118.909 2.929 . . . . 66.63 118.909 -172.0 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.569 ' O ' HG23 ' A' ' 86' ' ' VAL . 13.3 Cg_exo . . . . . 0 N--CA 1.486 1.05 0 CA-C-O 121.195 0.415 . . . . 68.16 112.664 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' MET . . . . . 0.7 ' HE2' ' HA ' ' A' ' 83' ' ' MET . 0.0 OUTLIER -49.01 -62.49 1.5 Allowed 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 122.764 1.269 . . . . 74.18 113.095 -165.132 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -41.54 -40.05 1.74 Allowed 'General case' 0 N--CA 1.437 -1.11 0 N-CA-C 115.145 1.535 . . . . 55.39 115.145 174.743 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -75.34 -35.37 61.18 Favored 'General case' 0 C--O 1.261 1.693 0 N-CA-C 113.634 0.975 . . . . 48.65 113.634 -178.129 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.569 HG23 ' O ' ' A' ' 82' ' ' PRO . 3.4 t -63.7 -56.88 14.29 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.395 0 C-N-CA 124.625 1.17 . . . . 47.43 109.238 173.708 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.535 ' HE3' ' HG3' ' A' ' 83' ' ' MET . 82.1 mttt -45.13 -47.12 12.21 Favored 'General case' 0 C--O 1.19 -2.052 0 N-CA-C 115.221 1.563 . . . . 60.26 115.221 174.391 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -75.61 -33.91 60.57 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 121.135 -0.978 . . . . 63.5 108.772 -173.653 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -67.72 -40.2 84.27 Favored 'General case' 0 C--O 1.216 -0.667 0 CA-C-O 121.686 0.755 . . . . 39.82 110.51 179.476 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.686 ' CD2' HD22 ' A' ' 8' ' ' LEU . 14.1 tp -68.73 -46.51 68.7 Favored 'General case' 0 CA--C 1.486 -1.499 0 N-CA-C 109.493 -0.558 . . . . 39.39 109.493 175.549 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 47.5 mtt180 -48.61 -60.48 2.67 Favored 'General case' 0 N--CA 1.501 2.085 0 C-N-CA 117.747 -1.581 . . . . 61.34 110.123 172.996 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . 0.252 0.0 OUTLIER -65.38 -31.68 72.91 Favored 'General case' 0 CA--C 1.483 -1.626 0 C-N-CA 116.055 -2.258 . . . . 62.26 113.95 -175.788 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -59.44 -42.47 91.98 Favored 'General case' 0 CA--C 1.498 -1.023 0 CA-C-O 117.918 -1.039 . . . . 36.27 112.573 177.828 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -67.15 -33.17 82.29 Favored Glycine 0 C--N 1.338 0.647 0 C-N-CA 118.555 -1.783 . . . . 36.32 111.871 179.007 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 66.7 m-20 -69.47 -46.15 67.36 Favored 'General case' 0 C--O 1.259 1.581 0 N-CA-C 102.754 -3.054 . . . . 43.25 102.754 -172.345 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 16.4 tp10 -60.52 -37.89 82.63 Favored 'General case' 0 N--CA 1.446 -0.656 0 O-C-N 125.388 1.68 . . . . 64.28 111.27 179.744 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -74.93 -37.38 62.05 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 118.433 0.56 . . . . 43.43 111.602 178.172 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 10.8 mt-10 -67.3 -37.08 82.79 Favored 'General case' 0 CA--C 1.548 0.879 0 N-CA-C 116.018 1.859 . . . . 52.28 116.018 173.665 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 5.0 mt -69.08 -50.0 52.31 Favored 'General case' 0 CA--C 1.485 -1.542 0 N-CA-C 107.337 -1.357 . . . . 67.17 107.337 -178.598 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' ARG . . . . . 0.443 ' HG2' ' CD1' ' A' ' 101' ' ' TYR . 24.2 ttp-105 -61.29 -25.42 67.1 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-N 114.78 -1.1 . . . . 83.32 112.529 -176.928 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' TYR . . . . . 0.766 ' HD2' ' HG2' ' A' ' 103' ' ' ARG . 4.3 m-30 -106.4 -68.77 0.86 Allowed 'General case' 0 N--CA 1.442 -0.861 0 C-N-CA 118.286 -1.365 . . . . 91.35 112.619 -173.814 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.463 ' HB2' ' O ' ' A' ' 101' ' ' TYR . 7.0 mtt180 61.32 -2.2 0.24 Allowed 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 106.667 -1.605 . . . . 101.38 106.667 -163.05 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' ARG . . . . . 0.969 ' O ' ' HG3' ' A' ' 103' ' ' ARG 0.25 0.0 OUTLIER -76.96 115.02 16.39 Favored 'General case' 0 C--O 1.258 1.538 0 N-CA-C 115.617 1.71 . . . . 105.67 115.617 168.985 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' ALA . . . . . 1.146 ' CB ' ' HA ' ' A' ' 105' ' ' ALA . . . 134.21 178.93 0.0 OUTLIER 'General case' 0 CA--C 1.567 1.627 0 O-C-N 126.027 2.079 . . . . 99.92 113.689 -174.948 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' ALA . . . . . 1.146 ' HA ' ' CB ' ' A' ' 104' ' ' ALA . . . -92.66 16.34 12.39 Favored 'General case' 0 CA--C 1.551 1.019 1 N-CA-C 126.554 5.761 . . . . 99.22 126.554 12.609 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' SER . . . . . 0.888 ' H ' ' H ' ' A' ' 108' ' ' LEU . 3.3 t -113.78 -91.52 0.5 Allowed 'General case' 0 CA--C 1.492 -1.28 1 N-CA-C 99.422 -4.288 . . . . 97.74 99.422 4.02 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' ASP . . . . . 1.174 ' O ' ' HB2' ' A' ' 111' ' ' GLN . 0.2 OUTLIER -72.49 12.41 0.47 Allowed 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 106.224 -1.769 . . . . 95.05 106.224 147.579 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.913 ' HB2' ' O ' ' A' ' 105' ' ' ALA 0.259 7.6 mp -77.48 -63.81 1.29 Allowed 'General case' 0 CA--C 1.48 -1.735 0 C-N-CA 117.316 -1.753 . . . . 87.98 110.59 177.396 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' THR . . . . . 0.766 ' OG1' ' HB3' ' A' ' 105' ' ' ALA . 20.5 p -61.95 -40.9 97.14 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 105.607 -1.997 . . . . 81.17 105.607 173.476 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' SER . . . . . 0.899 ' CB ' ' HA ' ' A' ' 107' ' ' ASP . 0.1 OUTLIER -47.86 -53.09 16.72 Favored 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 107.216 -1.401 . . . . 76.57 107.216 172.214 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' GLN . . . . . 1.174 ' HB2' ' O ' ' A' ' 107' ' ' ASP . 0.0 OUTLIER -61.63 -27.12 68.43 Favored 'General case' 0 C--N 1.258 -3.401 0 C-N-CA 126.481 1.912 . . . . 81.6 109.75 -177.325 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.42 ' O ' ' C ' ' A' ' 113' ' ' HIS . 11.6 tp -92.56 -36.47 13.01 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 115.465 1.654 . . . . 66.88 115.465 -172.152 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' HIS . . . . . 0.42 ' C ' ' O ' ' A' ' 112' ' ' LEU . 10.3 p-80 33.33 61.47 0.43 Allowed 'General case' 0 CA--C 1.574 1.896 0 N-CA-C 112.383 0.512 . . . . 82.96 112.383 -175.888 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.881 HG12 HD13 ' A' ' 162' ' ' LEU . 1.8 tt -54.08 134.77 16.8 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.315 0 N-CA-C 116.055 1.872 . . . . 64.47 116.055 -178.333 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' THR . . . . . 0.431 ' HA ' ' HE3' ' A' ' 159' ' ' MET . 3.3 p -135.45 177.05 2.41 Favored Pre-proline 0 CA--C 1.483 -1.62 0 N-CA-C 103.403 -2.814 . . . . 62.62 103.403 171.804 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_exo -78.46 -2.94 12.93 Favored 'Trans proline' 0 N--CA 1.486 1.081 0 O-C-N 123.043 1.023 . . . . 63.63 112.53 178.884 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -92.32 -9.81 61.44 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.249 -0.977 . . . . 63.34 111.709 174.862 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 92.7 m -58.47 135.84 57.37 Favored 'General case' 0 C--O 1.243 0.741 0 C-N-CA 123.889 0.876 . . . . 61.54 109.575 174.195 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -108.66 161.81 14.74 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 120.664 -0.414 . . . . 56.27 110.27 174.37 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' TYR . . . . . . . . . . . . . 50.4 t80 -43.52 -46.97 7.19 Favored 'General case' 0 CA--C 1.558 1.266 0 CA-C-O 123.429 1.585 . . . . 49.17 115.235 178.962 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -58.71 -35.68 73.05 Favored 'General case' 0 N--CA 1.386 -3.641 0 CA-C-N 114.339 -1.3 . . . . 71.89 112.599 -172.718 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 5.8 m -67.03 -44.44 80.23 Favored 'General case' 0 C--O 1.253 1.242 0 C-N-CA 119.128 -1.029 . . . . 52.15 110.999 175.438 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 45.6 t80 -54.19 -49.96 68.17 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 105.011 -2.218 . . . . 42.35 105.011 176.499 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -58.6 -40.45 83.29 Favored 'General case' 0 C--O 1.289 3.164 0 O-C-N 121.259 -0.9 . . . . 43.58 110.251 -174.901 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -64.7 -39.9 94.45 Favored 'General case' 0 C--O 1.246 0.883 0 CA-C-N 115.336 -0.847 . . . . 67.9 110.651 -172.959 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 43.0 t -70.52 -50.88 42.04 Favored 'Isoleucine or valine' 0 C--O 1.255 1.389 0 CA-C-N 114.505 -1.225 . . . . 42.2 109.926 179.914 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 97.4 t -61.91 -35.16 66.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 C-N-CA 120.312 -0.555 . . . . 40.67 110.516 -174.384 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 99.6 m-20 -45.76 -38.02 6.58 Favored 'General case' 0 C--O 1.173 -2.94 0 CA-C-O 115.704 -2.093 . . . . 44.15 111.666 168.531 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -59.12 -25.56 63.95 Favored 'General case' 0 N--CA 1.536 3.853 0 CA-C-N 122.659 2.482 . . . . 63.73 114.485 179.463 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.97 -33.08 75.01 Favored 'General case' 0 C--O 1.2 -1.506 0 CA-C-N 115.358 -0.837 . . . . 44.95 110.866 176.344 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' PHE . . . . . . . . . . . . . 69.3 m-85 -109.76 25.42 11.81 Favored 'General case' 0 CA--C 1.469 -2.167 0 C-N-CA 124.09 0.956 . . . . 40.53 113.046 -170.791 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 8.0 ptp85 -63.33 -19.75 64.89 Favored 'General case' 0 N--CA 1.424 -1.73 0 O-C-N 124.861 1.351 . . . . 73.13 112.206 177.258 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 43.1 m-20 -110.92 19.46 18.5 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 117.266 -1.773 . . . . 60.46 107.952 176.009 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 86.61 -174.44 46.53 Favored Glycine 0 C--O 1.264 1.98 0 N-CA-C 107.423 -2.271 . . . . 38.16 107.423 179.758 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 59.7 t -89.52 151.32 3.5 Favored 'Isoleucine or valine' 0 C--O 1.271 2.194 0 O-C-N 125.023 1.072 . . . . 32.17 111.375 -170.015 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' ASN . . . . . 0.772 HD22 ' C ' ' A' ' 136' ' ' ASN . 0.2 OUTLIER -156.42 179.75 8.96 Favored 'General case' 0 C--O 1.255 1.381 0 CA-C-N 114.614 -1.176 . . . . 37.83 109.322 159.626 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' TRP . . . . . . . . . . . . . 72.5 m95 -67.67 -42.38 82.22 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 117.131 -1.828 . . . . 35.88 110.999 -174.046 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -56.25 -34.32 62.7 Favored Glycine 0 C--O 1.21 -1.399 0 CA-C-O 118.746 -1.03 . . . . 37.21 113.558 -179.945 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' ARG . . . . . 0.521 ' H ' ' ND2' ' A' ' 136' ' ' ASN . 74.5 mtt180 -84.07 -27.37 28.32 Favored 'General case' 0 C--O 1.299 3.677 0 CA-C-N 118.723 1.261 . . . . 36.48 109.125 -171.5 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' ILE . . . . . 0.559 HD13 HD11 ' A' ' 182' ' ' ILE . 96.7 mt -68.3 -39.1 80.48 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.048 0 C-N-CA 118.467 -1.293 . . . . 34.79 111.622 166.999 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . 0.418 90.8 t -54.94 -52.13 46.53 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.242 0 C-N-CA 119.182 -1.007 . . . . 32.42 111.021 169.955 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -60.42 -32.6 71.51 Favored 'General case' 0 CA--C 1.564 1.512 0 N-CA-C 115.331 1.604 . . . . 30.74 115.331 179.493 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -63.94 -51.67 63.35 Favored 'General case' 0 C--O 1.258 1.501 0 N-CA-C 104.211 -2.514 . . . . 32.8 104.211 -179.971 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 19.9 m-85 -63.96 -46.34 85.07 Favored 'General case' 0 CA--C 1.584 2.274 0 CA-C-O 122.889 1.328 . . . . 34.83 110.185 -179.868 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 1.5 t -59.79 -37.13 78.26 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 118.619 -2.55 . . . . 37.19 109.611 177.369 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' PHE . . . . . 0.513 ' CE1' ' HB3' ' A' ' 108' ' ' LEU . 90.3 t80 -56.76 -54.63 44.11 Favored 'General case' 0 N--CA 1.461 0.109 0 O-C-N 120.648 -1.283 . . . . 38.97 113.592 175.959 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' GLY . . . . . 0.446 ' HA3' ' SD ' ' A' ' 170' ' ' MET . . . -49.34 -45.05 35.9 Favored Glycine 0 CA--C 1.491 -1.416 0 N-CA-C 114.597 0.599 . . . . 33.43 114.597 171.51 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -58.11 -48.91 80.02 Favored Glycine 1 C--O 1.307 4.695 0 N-CA-C 114.89 0.716 . . . . 30.63 114.89 175.617 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -58.98 -39.18 81.01 Favored 'General case' 0 N--CA 1.496 1.866 0 C-N-CA 118.443 -1.303 . . . . 34.78 111.838 178.028 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' LEU . . . . . 0.452 HD13 HG22 ' A' ' 109' ' ' THR . 11.0 tp -67.87 -37.24 81.56 Favored 'General case' 0 N--CA 1.441 -0.877 0 O-C-N 121.579 -0.701 . . . . 42.86 112.442 -177.856 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' CYS . . . . . . . . . . . . . 52.4 m -59.89 -43.24 94.91 Favored 'General case' 0 C--O 1.205 -1.251 0 N-CA-C 114.116 1.154 . . . . 37.83 114.116 167.839 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 2.1 t -66.57 -44.11 90.23 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.527 0 N-CA-C 107.899 -1.149 . . . . 39.27 107.899 179.547 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 84.1 mt-10 -64.5 -37.45 87.59 Favored 'General case' 0 CA--C 1.467 -2.245 0 CA-C-N 119.671 1.123 . . . . 62.83 109.52 179.974 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 63.4 m -56.47 -44.48 80.61 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 122.787 1.28 . . . . 44.39 110.752 -178.688 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 43.2 t -70.16 -46.13 73.39 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.589 0 CA-C-N 114.555 -1.202 . . . . 42.21 109.677 -177.034 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 81.7 m-20 -51.05 -30.49 15.8 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 117.891 2.552 . . . . 45.83 117.891 168.071 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 34.9 mttt -92.49 14.36 16.98 Favored 'General case' 0 N--CA 1.403 -2.805 0 N-CA-C 106.246 -1.761 . . . . 49.52 106.246 179.867 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 66.1 mm-40 58.05 39.34 26.39 Favored 'General case' 0 CA--C 1.56 1.355 0 C-N-CA 117.399 -1.72 . . . . 48.42 109.816 -178.822 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 159' ' ' MET . . . . . 0.431 ' HE3' ' HA ' ' A' ' 115' ' ' THR . 0.3 OUTLIER -117.79 38.86 3.5 Favored 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 107.459 -1.311 . . . . 59.57 107.459 178.975 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 160' ' ' GLN . . . . . 1.0 ' HG3' ' O ' ' A' ' 199' ' ' HOH . 61.4 mt-30 -54.49 -27.45 37.99 Favored 'General case' 0 N--CA 1.487 1.414 0 N-CA-C 117.184 2.29 . . . . 72.57 117.184 -173.503 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 161' ' ' VAL . . . . . . . . . . . . . 24.3 m -52.08 -37.34 21.81 Favored 'Isoleucine or valine' 0 C--O 1.259 1.555 0 C-N-CA 119.343 -0.943 . . . . 55.72 112.973 174.849 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 162' ' ' LEU . . . . . 0.881 HD13 HG12 ' A' ' 114' ' ' ILE . 32.9 mt -58.31 -27.08 63.77 Favored 'General case' 0 C--O 1.189 -2.104 0 O-C-N 124.164 0.915 . . . . 51.05 111.735 -178.122 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 163' ' ' VAL . . . . . . . . . . . . 0.283 5.5 t -55.83 -33.31 34.3 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.932 0 C-N-CA 117.569 -1.653 . . . . 44.32 113.762 -170.482 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 27.3 p -84.91 -26.4 27.3 Favored 'General case' 0 CA--C 1.564 1.482 0 C-N-CA 117.162 -1.815 . . . . 42.56 107.816 -172.975 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 36.8 ttm180 -63.4 -51.25 66.58 Favored 'General case' 0 N--CA 1.436 -1.146 0 C-N-CA 125.121 1.368 . . . . 65.55 112.073 172.598 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 166' ' ' ILE . . . . . . . . . . . . . 82.1 mt -59.16 -37.71 70.02 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.201 0 CA-C-O 121.786 0.803 . . . . 40.3 108.871 178.068 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 167' ' ' ALA . . . . . . . . . . . . . . . -61.72 -38.34 87.54 Favored 'General case' 0 CA--C 1.556 1.199 0 CA-C-O 122.59 1.186 . . . . 41.97 111.685 177.842 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 5.3 m -67.7 -47.34 69.7 Favored 'General case' 0 CA--C 1.499 -0.99 0 O-C-N 121.533 -0.73 . . . . 49.56 112.261 178.547 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 169' ' ' TRP . . . . . . . . . . . . . 54.1 m0 -55.76 -40.0 71.98 Favored 'General case' 0 N--CA 1.431 -1.387 0 CA-C-N 114.886 -1.052 . . . . 44.23 110.968 176.623 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 170' ' ' MET . . . . . 0.446 ' SD ' ' HA3' ' A' ' 147' ' ' GLY . 55.0 mtp -69.14 -37.87 78.51 Favored 'General case' 0 C--N 1.315 -0.932 0 N-CA-C 105.704 -1.962 . . . . 41.25 105.704 -173.244 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 171' ' ' ALA . . . . . . . . . . . . . . . -72.26 -41.32 66.89 Favored 'General case' 0 C--O 1.264 1.862 0 C-N-CA 118.276 -1.37 . . . . 40.13 109.787 -175.307 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 172' ' ' THR . . . . . . . . . . . . . 72.1 m -55.52 -50.45 69.96 Favored 'General case' 0 N--CA 1.491 1.589 0 CA-C-N 115.315 -0.857 . . . . 40.42 109.287 173.212 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 173' ' ' TYR . . . . . . . . . . . . . 13.0 t80 -67.29 -46.32 73.94 Favored 'General case' 0 C--N 1.344 0.365 0 N-CA-C 107.251 -1.389 . . . . 38.07 107.251 -170.402 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 24.1 tp -53.1 -58.43 7.06 Favored 'General case' 0 N--CA 1.431 -1.383 0 CA-C-N 115.444 -0.798 . . . . 41.91 110.477 175.718 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 175' ' ' ASN . . . . . 0.597 ' ND2' ' OD1' ' A' ' 5' ' ' ASN . 4.3 m120 -62.94 -26.01 68.61 Favored 'General case' 0 C--O 1.251 1.143 0 N-CA-C 113.43 0.9 . . . . 56.43 113.43 -171.978 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 17.9 t0 -89.85 -60.61 1.89 Allowed 'General case' 0 C--O 1.214 -0.765 0 CA-C-N 115.543 -0.753 . . . . 55.71 110.578 -174.869 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 177' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -95.54 -18.57 20.51 Favored 'General case' 0 CA--C 1.487 -1.467 0 N-CA-C 116.494 2.035 . . . . 47.15 116.494 -174.829 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 178' ' ' LEU . . . . . . . . . . . . . 18.8 mt -104.72 -37.52 7.05 Favored 'General case' 0 C--O 1.169 -3.153 0 N-CA-C 114.75 1.389 . . . . 36.99 114.75 -176.134 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 179' ' ' GLU . . . . . 0.403 ' N ' ' HD2' ' A' ' 180' ' ' PRO . 3.4 tp10 -52.51 -44.22 93.95 Favored Pre-proline 0 N--CA 1.485 1.321 0 CA-C-O 118.294 -0.86 . . . . 65.6 113.206 179.823 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 180' ' ' PRO . . . . . 0.403 ' HD2' ' N ' ' A' ' 179' ' ' GLU . 10.7 Cg_exo -50.53 -42.64 48.53 Favored 'Trans proline' 0 N--CA 1.501 1.954 0 N-CA-C 115.88 1.454 . . . . 42.1 115.88 174.783 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 181' ' ' TRP . . . . . . . . . . . . . 83.5 t90 -78.28 -35.55 47.86 Favored 'General case' 0 N--CA 1.485 1.314 0 CA-C-O 123.065 1.412 . . . . 40.37 108.587 -174.838 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 182' ' ' ILE . . . . . 0.559 HD11 HD13 ' A' ' 140' ' ' ILE . 1.2 mt -64.17 -43.72 97.41 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.072 0 N-CA-C 105.408 -2.071 . . . . 43.82 105.408 -175.513 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 83.7 mm-40 -67.97 -30.47 69.76 Favored 'General case' 0 C--O 1.202 -1.395 0 O-C-N 124.079 0.862 . . . . 63.8 110.34 -177.786 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 184' ' ' GLU . . . . . 0.51 ' O ' ' HG3' ' A' ' 184' ' ' GLU . 5.3 tp10 -79.18 -21.88 45.77 Favored 'General case' 0 N--CA 1.437 -1.122 0 N-CA-C 107.591 -1.262 . . . . 55.83 107.591 -175.026 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 185' ' ' ASN . . . . . . . . . . . . . 13.3 m-80 -113.17 20.9 15.85 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 115.996 1.851 . . . . 51.88 115.996 -175.601 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 186' ' ' GLY . . . . . . . . . . . . . . . 117.21 6.36 13.73 Favored Glycine 0 N--CA 1.428 -1.897 0 O-C-N 124.901 1.376 . . . . 46.63 112.678 161.029 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 187' ' ' GLY . . . . . . . . . . . . . . . 72.7 -176.65 42.39 Favored Glycine 0 C--O 1.206 -1.619 0 N-CA-C 108.002 -2.039 . . . . 43.63 108.002 178.023 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 188' ' ' TRP . . . . . . . . . . . . . 94.1 m95 -66.89 -21.85 65.99 Favored 'General case' 0 C--N 1.304 -1.411 0 C-N-CA 125.53 1.532 . . . . 47.89 112.789 -177.64 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 189' ' ' ASP . . . . . . . . . . . . . 84.3 m-20 -46.38 -48.42 18.58 Favored 'General case' 0 CA--C 1.489 -1.402 0 C-N-CA 125.571 1.548 . . . . 57.78 112.049 166.822 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 190' ' ' THR . . . . . . . . . . . . . 11.7 m -72.4 -32.82 66.71 Favored 'General case' 0 C--N 1.311 -1.092 0 N-CA-C 108.374 -0.972 . . . . 45.48 108.374 179.523 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 191' ' ' PHE . . . . . . . . . . . . . 70.7 t80 -64.98 -40.45 95.0 Favored 'General case' 0 C--O 1.266 1.934 0 N-CA-C 106.095 -1.817 . . . . 49.06 106.095 -175.214 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 192' ' ' VAL . . . . . . . . . . . . . 42.8 t -67.82 -46.13 82.9 Favored 'Isoleucine or valine' 0 C--O 1.173 -2.953 0 CA-C-N 113.771 -1.559 . . . . 53.2 113.152 173.684 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 193' ' ' ASP . . . . . . . . . . . . . 71.7 m-20 -49.25 -36.45 20.45 Favored 'General case' 0 N--CA 1.489 1.496 0 CA-C-N 121.395 1.907 . . . . 63.39 113.43 170.411 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 194' ' ' LEU . . . . . . . . . . . . . 21.0 mt -91.79 -30.77 16.04 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 114.201 1.185 . . . . 55.22 114.201 -174.134 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 195' ' ' TYR . . . . . . . . . . . . . 70.5 m-85 -108.55 -46.66 3.63 Favored 'General case' 0 C--O 1.209 -1.046 0 O-C-N 121.595 -0.691 . . . . 55.24 112.427 -175.966 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 196' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.817 0 C-N-CA 124.84 1.21 . . . . 61.77 111.36 -165.455 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 197' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 198' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 199' ' ' HOH . . . . . 1.0 ' O ' ' HG3' ' A' ' 160' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 200' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 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 . . . . . 0.464 ' O ' ' N ' ' A' ' 105' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 stop_ save_