data_1crh_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 1crh _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 ' -5' ' ' THR . . . . . . . . . . . . . 8.8 t . . . . . 0 N--CA 1.483 1.179 0 N-CA-C 106.946 -1.502 . . . . 41.76 106.946 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' -4' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -151.56 2.2 0.39 Allowed 'General case' 0 C--O 1.254 1.3 0 CA-C-O 117.63 -1.176 . . . . 42.7 112.399 -178.239 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 18.9 t80 -133.03 127.09 33.32 Favored 'General case' 0 N--CA 1.483 1.204 0 CA-C-O 116.367 -1.778 . . . . 42.27 106.429 178.511 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -120.08 147.23 45.11 Favored 'General case' 0 C--N 1.303 -1.427 1 O-C-N 129.986 4.554 . . . . 39.71 106.307 -178.232 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -77.21 126.74 31.43 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 119.898 3.296 . . . . 31.52 119.898 -176.359 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -93.5 -166.36 37.8 Favored Glycine 0 C--N 1.317 -0.504 0 C-N-CA 127.643 2.544 . . . . 25.72 110.815 -179.736 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.4 t -92.8 119.44 32.15 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-O 115.666 -2.111 . . . . 17.72 110.247 -179.313 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -65.92 -41.19 91.73 Favored 'General case' 0 C--O 1.267 1.999 0 O-C-N 126.467 2.354 . . . . 12.61 109.572 177.281 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.2 mttm -58.99 -45.45 90.57 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 117.772 -1.571 . . . . 18.77 107.749 175.989 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.2 tppp? -68.78 -32.98 73.1 Favored 'General case' 0 N--CA 1.507 2.406 0 CA-C-O 123.23 1.49 . . . . 17.07 107.361 -178.841 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -61.89 -54.32 36.18 Favored Glycine 0 CA--C 1.559 2.825 0 CA-C-O 116.754 -2.137 . . . . 10.35 107.765 176.598 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -51.5 -38.52 54.4 Favored 'General case' 0 C--O 1.263 1.792 0 N-CA-C 116.918 2.192 . . . . 11.15 116.918 179.681 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 75.5 p -81.85 -24.13 35.98 Favored 'General case' 0 C--N 1.297 -1.717 0 CA-C-O 123.3 1.524 . . . . 15.36 112.01 -178.61 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.84 -45.38 61.63 Favored 'General case' 0 C--O 1.222 -0.38 0 N-CA-C 103.026 -2.953 . . . . 20.35 103.026 179.366 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 42.6 t80 -55.68 -56.98 14.0 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 128.24 3.462 . . . . 10.19 109.63 177.994 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 26.9 mttt -49.93 -41.75 46.83 Favored 'General case' 0 CA--C 1.545 0.754 0 O-C-N 125.482 1.739 . . . . 14.86 112.701 178.478 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 21.2 p -91.3 -19.01 23.42 Favored 'General case' 0 CA--C 1.5 -0.96 0 O-C-N 117.284 -3.385 . . . . 13.84 111.725 -178.765 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.8 mtp180 -118.02 -8.91 10.66 Favored 'General case' 0 C--O 1.268 2.058 1 CA-C-N 126.723 4.329 . . . . 26.14 118.034 -179.49 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 7.1 m -132.81 -23.18 2.04 Favored 'General case' 0 CA--C 1.501 -0.919 0 CA-C-O 112.739 -3.505 . . . . 6.51 114.256 -176.465 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 33.9 tp -57.24 -44.81 84.15 Favored 'General case' 0 C--N 1.306 -1.297 0 C-N-CA 128.809 2.844 . . . . 5.64 112.256 -177.359 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 54.7 tt0 -41.26 -35.35 0.61 Allowed 'General case' 0 C--N 1.287 -2.113 0 O-C-N 127.399 2.937 . . . . 16.81 109.897 174.512 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 77.5 m -118.7 -20.58 8.23 Favored 'General case' 0 C--O 1.24 0.573 0 O-C-N 127.065 2.728 . . . . 11.53 117.303 -174.684 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 93.8 m-70 -131.32 154.07 48.94 Favored 'General case' 0 N--CA 1.49 1.533 1 O-C-N 129.91 4.506 . . . . 8.28 115.035 -177.847 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 18.5 p -107.86 153.59 22.8 Favored 'General case' 0 CA--C 1.559 1.293 0 N-CA-C 102.699 -3.074 . . . . 6.54 102.699 172.867 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 33.7 m -117.27 -12.81 11.2 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.01 0 O-C-N 127.127 2.767 . . . . 13.26 117.6 177.088 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -72.44 148.08 45.5 Favored 'General case' 0 C--N 1.319 -0.757 0 O-C-N 117.45 -3.281 . . . . 27.29 115.228 -178.972 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.5 tptm -56.88 118.25 4.75 Favored 'General case' 0 N--CA 1.503 2.182 0 CA-C-O 116.429 -1.748 . . . . 14.55 107.269 176.839 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 82.8 7.83 86.77 Favored Glycine 0 N--CA 1.503 3.125 0 C-N-CA 114.779 -3.581 . . . . 5.48 111.501 179.167 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -72.18 148.15 42.17 Favored Glycine 0 N--CA 1.491 2.357 1 N-CA-C 100.704 -4.958 . . . . 11.54 100.704 171.993 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -81.16 164.18 19.72 Favored 'Trans proline' 0 C--N 1.311 -1.432 0 C-N-CA 121.029 1.153 . . . . 8.21 115.077 -177.926 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' HIS . . . . . 0.511 ' ND1' ' N ' ' A' ' 31' ' ' ASN . 27.1 m-70 -83.14 159.13 22.13 Favored 'General case' 0 N--CA 1.511 2.594 0 N-CA-C 103.139 -2.911 . . . . 5.63 103.139 173.924 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.6 mtmt -138.02 -137.85 0.14 Allowed 'General case' 0 C--O 1.266 1.954 0 C-N-CA 129.744 3.218 . . . . 7.76 107.818 177.918 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 3.5 t -56.92 -45.29 83.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 CA-C-O 124.498 2.094 . . . . 7.4 105.615 178.113 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -107.14 158.52 15.05 Favored Glycine 0 N--CA 1.488 2.157 0 N-CA-C 103.939 -3.664 . . . . 6.44 103.939 -179.461 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_endo -72.73 160.68 45.75 Favored 'Trans proline' 0 C--O 1.269 2.049 0 O-C-N 126.824 3.013 . . . . 6.95 114.494 -178.136 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ASN . . . . . 0.511 ' N ' ' ND1' ' A' ' 26' ' ' HIS 0.269 18.9 t-20 -67.04 139.89 57.64 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 126.859 2.599 . . . . 6.32 104.592 174.228 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 8.5 mt -106.82 14.99 26.03 Favored 'General case' 0 C--O 1.261 1.659 0 CA-C-N 120.798 1.635 . . . . 5.76 109.96 -176.987 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 11.3 t60 -66.15 142.78 57.63 Favored 'General case' 0 N--CA 1.513 2.71 0 C-N-CA 113.364 -3.334 . . . . 13.22 104.854 -178.109 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 69.42 15.84 70.87 Favored Glycine 0 CA--C 1.535 1.324 1 O-C-N 129.388 4.18 . . . . 9.86 115.731 -177.788 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 4.0 tp -58.67 -37.39 65.28 Favored 'Isoleucine or valine' 0 C--O 1.246 0.915 0 CA-C-N 123.706 3.753 . . . . 11.19 115.302 -178.803 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 74.5 m-85 -69.14 134.92 49.93 Favored 'General case' 0 C--O 1.237 0.408 0 O-C-N 119.538 -1.976 . . . . 24.11 106.865 179.829 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 89.05 -21.25 28.56 Favored Glycine 0 C--N 1.308 -0.997 0 CA-C-N 112.685 -2.052 . . . . 21.13 110.566 178.972 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 49.6 ttp180 -83.84 160.21 21.21 Favored 'General case' 0 N--CA 1.506 2.328 0 CA-C-N 112.114 -2.043 . . . . 29.92 107.506 -179.422 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 65.4 m80 -98.65 159.17 15.13 Favored 'General case' 0 C--O 1.267 1.994 0 N-CA-C 106.403 -1.703 . . . . 18.02 106.403 178.636 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 19.9 p -67.69 141.56 56.62 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-O 123.474 1.607 . . . . 14.95 112.665 178.593 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 73.63 32.73 59.09 Favored Glycine 0 C--O 1.277 2.797 0 N-CA-C 118.339 2.095 . . . . 14.14 118.339 -179.637 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' GLN . . . . . 0.448 ' NE2' ' O ' ' A' ' 155' ' ' HOH . 0.7 OUTLIER -122.94 8.47 9.32 Favored 'General case' 0 C--O 1.252 1.192 0 CA-C-N 122.061 2.93 . . . . 15.98 115.489 -177.172 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -83.9 128.83 34.82 Favored 'General case' 0 CA--C 1.561 1.366 0 N-CA-C 101.444 -3.539 . . . . 15.88 101.444 175.914 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -82.98 148.45 27.58 Favored 'General case' 0 C--O 1.247 0.939 0 CA-C-O 124.908 2.29 . . . . 25.73 108.53 -179.319 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 85.43 18.42 60.48 Favored Glycine 0 C--O 1.257 1.543 2 CA-C-N 106.728 -4.76 . . . . 14.41 107.081 178.455 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 39.4 t80 -132.53 131.58 41.73 Favored 'General case' 0 C--N 1.307 -1.277 0 O-C-N 129.616 3.774 . . . . 11.98 112.075 176.708 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 47.1 t -95.16 105.41 17.34 Favored 'General case' 0 C--O 1.269 2.122 0 O-C-N 118.983 -2.323 . . . . 12.47 107.975 179.195 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 97.6 m-85 -97.56 154.05 17.78 Favored 'General case' 0 C--N 1.309 -1.164 0 C-N-CA 129.663 3.185 . . . . 9.78 109.515 178.311 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 60.8 p -65.64 164.98 13.26 Favored 'General case' 0 C--N 1.301 -1.526 0 CA-C-O 123.494 1.616 . . . . 16.47 111.137 174.868 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . 0.303 67.5 m-20 -60.7 -50.88 71.72 Favored 'General case' 0 CA--C 1.514 -0.414 0 N-CA-C 107.393 -1.336 . . . . 22.96 107.393 179.527 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -45.7 -49.47 14.6 Favored 'General case' 0 C--O 1.26 1.632 0 O-C-N 127.649 3.093 . . . . 18.32 116.338 -179.851 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . 0.256 4.4 tt -67.24 -49.98 67.36 Favored 'Isoleucine or valine' 0 C--O 1.247 0.948 0 C-N-CA 117.675 -1.61 . . . . 15.67 112.398 -179.675 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 1.5 mt -53.74 -47.46 62.37 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.34 0 O-C-N 118.004 -2.935 . . . . 21.24 109.185 178.813 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.14 -33.33 69.06 Favored 'General case' 0 C--N 1.306 -1.312 0 CA-C-N 111.905 -2.407 . . . . 20.57 114.943 -176.11 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' LYS . . . . . 0.427 ' CG ' ' CG2' ' A' ' 57' ' ' VAL 0.303 5.1 tptm -76.96 -32.33 57.21 Favored 'General case' 0 C--N 1.312 -1.047 0 O-C-N 126.544 2.402 . . . . 27.71 110.187 -178.536 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 40.53 65.87 0.71 Allowed 'General case' 0 C--N 1.316 -0.877 0 CA-C-O 118.135 -0.936 . . . . 30.23 111.251 178.093 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' VAL . . . . . 0.427 ' CG2' ' CG ' ' A' ' 55' ' ' LYS . 60.3 t -86.92 133.4 30.04 Favored 'Isoleucine or valine' 0 C--O 1.255 1.367 0 C-N-CA 128.22 2.608 . . . . 26.74 110.764 179.82 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.95 132.01 35.17 Favored 'General case' 0 N--CA 1.493 1.701 0 N-CA-C 102.2 -3.259 . . . . 26.99 102.2 178.541 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 5.7 m95 -96.18 110.5 22.77 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 125.071 2.367 . . . . 18.59 110.536 -174.626 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ASP . . . . . 0.493 ' OD1' ' N ' ' A' ' 62' ' ' ASN . 0.7 OUTLIER -140.71 166.55 24.43 Favored 'General case' 0 C--O 1.26 1.633 0 C-N-CA 131.291 3.836 . . . . 22.45 107.582 -177.104 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' GLU . . . . . 0.461 ' OE1' ' OD1' ' A' ' 62' ' ' ASN . 0.0 OUTLIER -59.07 -40.03 83.94 Favored 'General case' 0 C--O 1.27 2.16 0 O-C-N 127.679 3.112 . . . . 31.53 113.502 -177.911 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' ASN . . . . . 0.493 ' N ' ' OD1' ' A' ' 60' ' ' ASP . 1.0 OUTLIER -59.52 -46.86 87.63 Favored 'General case' 0 C--O 1.25 1.093 0 N-CA-C 115.471 1.656 . . . . 28.65 115.471 -176.026 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' ASN . . . . . 0.436 ' OD1' ' OH ' ' A' ' 74' ' ' TYR 0.255 1.5 t-20 -70.43 -42.42 71.59 Favored 'General case' 0 C--N 1.282 -2.346 2 CA-C-O 129.473 4.463 . . . . 30.94 113.169 179.972 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 29.5 tpp -65.94 -24.31 66.79 Favored 'General case' 0 N--CA 1.485 1.28 0 CA-C-N 111.737 -2.483 . . . . 24.13 110.388 -177.608 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.8 t -74.42 -45.23 47.86 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 115.202 -0.908 . . . . 21.07 111.451 178.687 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . 0.359 1.0 OUTLIER -74.7 -36.45 62.74 Favored 'General case' 0 C--O 1.245 0.836 0 O-C-N 126.13 2.144 . . . . 25.32 106.574 -179.111 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 44.2 t80 -59.31 -38.86 81.3 Favored 'General case' 0 N--CA 1.498 1.968 0 C-N-CA 116.265 -2.174 . . . . 23.65 106.721 178.62 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . 0.403 8.9 mt -68.01 -27.81 66.88 Favored 'General case' 0 C--O 1.264 1.863 0 O-C-N 127.015 2.697 . . . . 20.7 112.796 -176.016 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' THR . . . . . 0.464 ' CG2' ' NZ ' ' A' ' 86' ' ' LYS . 2.4 m -68.9 -39.76 79.54 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 114.784 -2.766 . . . . 23.26 111.557 179.268 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -169.38 91.82 0.55 Allowed Pre-proline 0 C--N 1.309 -1.161 0 CA-C-O 115.654 -2.117 . . . . 26.46 106.439 -174.69 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . 0.409 3.3 Cg_endo -61.4 -49.34 7.72 Favored 'Trans proline' 0 C--O 1.26 1.576 1 O-C-N 129.866 4.614 . . . . 17.29 116.009 -176.49 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 1.852 0 CA-C-O 126.06 2.838 . . . . 19.83 111.146 178.995 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 7.9 tptm -74.35 -65.84 0.8 Allowed 'General case' 0 C--O 1.257 1.464 0 CA-C-N 111.257 -2.701 . . . . 25.39 104.431 178.303 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' TYR . . . . . 0.436 ' OH ' ' OD1' ' A' ' 63' ' ' ASN . 51.4 t80 -49.9 -40.27 42.57 Favored 'General case' 0 C--O 1.269 2.124 0 O-C-N 127.486 2.991 . . . . 16.38 115.381 179.785 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -138.77 90.33 12.57 Favored Pre-proline 0 C--O 1.264 1.84 1 C-N-CA 133.457 4.703 . . . . 18.42 114.606 177.75 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -66.9 141.81 60.16 Favored 'Trans proline' 0 C--O 1.266 1.906 0 N-CA-C 103.316 -3.379 . . . . 16.34 103.316 -179.863 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 98.9 -18.74 56.41 Favored Glycine 0 C--O 1.252 1.277 0 CA-C-O 114.537 -3.368 . . . . 14.93 111.417 -179.01 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 9.4 t -58.26 142.13 48.72 Favored 'General case' 0 N--CA 1.483 1.201 0 O-C-N 126.238 1.787 . . . . 11.73 110.861 179.243 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' LYS . . . . . 0.404 ' NZ ' ' O ' ' A' ' 112' ' ' HOH . 0.0 OUTLIER -87.89 -0.24 56.72 Favored 'General case' 0 C--N 1.297 -1.689 0 O-C-N 125.023 1.452 . . . . 17.94 109.53 -179.784 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 2.4 ttt -65.61 106.95 1.58 Allowed 'General case' 0 C--O 1.258 1.516 0 CA-C-O 115.091 -2.385 . . . . 11.32 108.403 176.554 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -85.97 67.86 10.14 Favored 'General case' 0 N--CA 1.494 1.737 1 O-C-N 130.759 5.037 . . . . 12.99 112.616 177.123 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . 0.346 42.6 t80 -132.44 128.52 37.65 Favored 'General case' 0 N--CA 1.493 1.689 0 CA-C-O 127.973 3.749 . . . . 11.02 110.15 178.18 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -61.19 -55.77 27.56 Favored Glycine 0 CA--C 1.553 2.425 0 O-C-N 118.212 -2.805 . . . . 10.79 108.234 -177.186 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 144.16 -177.75 22.6 Favored Glycine 0 N--CA 1.478 1.478 0 O-C-N 129.992 3.995 . . . . 10.47 107.056 177.233 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . 0.272 11.0 mt -125.7 84.73 2.31 Favored 'General case' 0 C--N 1.272 -2.787 2 C-N-CA 150.211 11.404 . . . . 7.55 107.974 178.171 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' LYS . . . . . 0.512 ' NZ ' ' CB ' ' A' ' 86' ' ' LYS . 0.0 OUTLIER -78.58 -23.18 46.19 Favored 'General case' 0 C--O 1.264 1.84 1 O-C-N 113.898 -5.501 . . . . 27.57 110.796 -179.352 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 13.8 mttp -78.76 121.91 25.36 Favored 'General case' 0 C--O 1.258 1.549 0 O-C-N 124.484 1.115 . . . . 17.16 109.768 178.774 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -63.65 -36.8 85.03 Favored 'General case' 0 C--O 1.274 2.347 0 CA-C-O 125.257 2.456 . . . . 16.84 108.606 177.645 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . 0.296 0.9 OUTLIER -59.25 -46.79 87.54 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-O 112.358 -3.686 . . . . 16.35 109.141 178.623 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -65.18 -41.6 94.44 Favored 'General case' 0 C--O 1.252 1.22 0 CA-C-N 123.094 2.679 . . . . 20.01 113.406 -178.659 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 11.6 mtm180 -56.48 -45.68 80.83 Favored 'General case' 0 N--CA 1.421 -1.896 0 C-N-CA 127.856 2.462 . . . . 23.48 106.524 177.184 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . 0.31 77.8 m-20 -62.55 -50.8 69.91 Favored 'General case' 0 C--O 1.268 2.042 0 C-N-CA 116.068 -2.253 . . . . 14.01 112.735 -179.402 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 92.9 m-20 -52.87 -56.72 13.75 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-O 124.906 2.288 . . . . 12.51 111.027 179.064 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 40.5 tp -53.79 -45.15 70.61 Favored 'General case' 0 C--O 1.26 1.608 0 CA-C-N 111.761 -2.472 . . . . 5.61 111.48 -176.734 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . 0.26 91.2 mt -68.75 -31.19 49.81 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 O-C-N 126.229 2.206 . . . . 8.97 112.184 -179.411 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' THR . . . . . 0.694 ' O ' ' NZ ' ' A' ' 99' ' ' LYS 0.345 22.7 m -65.79 -39.55 91.07 Favored 'General case' 0 C--N 1.298 -1.655 0 N-CA-C 103.369 -2.826 . . . . 17.68 103.369 178.291 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 81.3 t80 -66.04 -48.36 71.35 Favored 'General case' 0 C--O 1.255 1.35 0 CA-C-N 115.32 -0.855 . . . . 15.94 111.763 176.681 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 5.7 mt -70.13 -38.21 75.49 Favored 'General case' 0 N--CA 1.491 1.58 0 CA-C-O 116.891 -1.528 . . . . 14.97 109.931 -176.028 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' LYS . . . . . 0.694 ' NZ ' ' O ' ' A' ' 96' ' ' THR . 1.7 ttpm? -53.73 -36.06 61.88 Favored 'General case' 0 C--O 1.267 1.988 1 O-C-N 129.237 4.086 . . . . 15.1 107.355 179.397 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 17.6 mmmt -80.77 -51.14 8.98 Favored 'General case' 0 C--O 1.251 1.154 0 CA-C-O 114.036 -2.887 . . . . 24.93 118.533 -178.32 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' ALA . . . . . 0.432 ' C ' ' N ' ' A' ' 103' ' ' GLU . . . -82.56 -36.08 26.59 Favored 'General case' 0 N--CA 1.486 1.353 0 O-C-N 127.169 2.793 . . . . 18.77 115.814 -177.273 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 3.6 m -73.05 16.54 0.16 Allowed 'General case' 0 N--CA 1.485 1.306 0 CA-C-O 123.529 1.633 . . . . 22.7 107.459 178.369 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' GLU . . . . . 0.432 ' N ' ' C ' ' A' ' 101' ' ' ALA . 29.1 tp10 . . . . . 0 C--O 1.256 1.423 0 CA-C-O 112.537 -3.601 . . . . 21.21 113.689 179.862 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' HOH . . . . . 0.404 ' O ' ' NZ ' ' A' ' 79' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' HOH . . . . . 0.448 ' O ' ' NE2' ' A' ' 42' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 158' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 160' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 161' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 162' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 163' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 167' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 168' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 169' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 172' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 175' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 182' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 184' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 185' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 188' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 189' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 195' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 196' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 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 ' 200' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 300' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' -5' ' ' THR . . . . . . . . . . . . . 8.8 t . . . . . 0 N--CA 1.483 1.179 0 N-CA-C 106.946 -1.502 . . . . 41.76 106.946 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' -4' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -151.56 2.2 0.39 Allowed 'General case' 0 C--O 1.254 1.3 0 CA-C-O 117.63 -1.176 . . . . 42.7 112.399 -178.239 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 18.9 t80 -133.03 127.09 33.32 Favored 'General case' 0 N--CA 1.483 1.204 0 CA-C-O 116.367 -1.778 . . . . 42.27 106.429 178.511 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -120.08 147.23 45.11 Favored 'General case' 0 C--N 1.303 -1.427 1 O-C-N 129.986 4.554 . . . . 39.71 106.307 -178.232 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -77.21 126.74 31.43 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 119.898 3.296 . . . . 31.52 119.898 -176.359 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -93.5 -166.36 37.8 Favored Glycine 0 C--N 1.317 -0.504 0 C-N-CA 127.643 2.544 . . . . 25.72 110.815 -179.736 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 2' ' ' SER . . . . . 0.49 ' HB3' ' HB3' ' A' ' 5' ' ' LYS . 22.4 t -92.8 119.44 32.15 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-O 115.666 -2.111 . . . . 17.72 110.247 -179.313 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -65.92 -41.19 91.73 Favored 'General case' 0 C--O 1.267 1.999 0 O-C-N 126.467 2.354 . . . . 12.61 109.572 177.281 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' LYS . . . . . 0.417 ' HG3' ' O1 ' ' A' ' 117' ' ' SO4 . 1.2 mttm -58.99 -45.45 90.57 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 117.772 -1.571 . . . . 18.77 107.749 175.989 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 5' ' ' LYS . . . . . 0.49 ' HB3' ' HB3' ' A' ' 2' ' ' SER . 2.2 tppp? -68.78 -32.98 73.1 Favored 'General case' 0 N--CA 1.507 2.406 0 CA-C-O 123.23 1.49 . . . . 17.07 107.361 -178.841 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 6' ' ' GLY . . . . . 0.58 ' HA3' ' HB2' ' A' ' 97' ' ' TYR . . . -61.89 -54.32 36.18 Favored Glycine 0 CA--C 1.559 2.825 0 CA-C-O 116.754 -2.137 . . . . 10.35 107.765 176.598 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 7' ' ' ALA . . . . . 0.46 ' HB2' ' CE1' ' A' ' 97' ' ' TYR . . . -51.5 -38.52 54.4 Favored 'General case' 0 C--O 1.263 1.792 0 N-CA-C 116.918 2.192 . . . . 11.15 116.918 179.681 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 8' ' ' THR . . . . . 0.426 ' HA ' ' HD2' ' A' ' 11' ' ' LYS . 75.5 p -81.85 -24.13 35.98 Favored 'General case' 0 C--N 1.297 -1.717 0 CA-C-O 123.3 1.524 . . . . 15.36 112.01 -178.61 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.84 -45.38 61.63 Favored 'General case' 0 C--O 1.222 -0.38 0 N-CA-C 103.026 -2.953 . . . . 20.35 103.026 179.366 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 10' ' ' PHE . . . . . 0.587 ' CZ ' HG13 ' A' ' 20' ' ' VAL . 42.6 t80 -55.68 -56.98 14.0 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 128.24 3.462 . . . . 10.19 109.63 177.994 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 11' ' ' LYS . . . . . 0.426 ' HD2' ' HA ' ' A' ' 8' ' ' THR . 26.9 mttt -49.93 -41.75 46.83 Favored 'General case' 0 CA--C 1.545 0.754 0 O-C-N 125.482 1.739 . . . . 14.86 112.701 178.478 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 21.2 p -91.3 -19.01 23.42 Favored 'General case' 0 CA--C 1.5 -0.96 0 O-C-N 117.284 -3.385 . . . . 13.84 111.725 -178.765 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.8 mtp180 -118.02 -8.91 10.66 Favored 'General case' 0 C--O 1.268 2.058 1 CA-C-N 126.723 4.329 . . . . 26.14 118.034 -179.49 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 7.1 m -132.81 -23.18 2.04 Favored 'General case' 0 CA--C 1.501 -0.919 0 CA-C-O 112.739 -3.505 . . . . 6.51 114.256 -176.465 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 33.9 tp -57.24 -44.81 84.15 Favored 'General case' 0 C--N 1.306 -1.297 0 C-N-CA 128.809 2.844 . . . . 5.64 112.256 -177.359 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 54.7 tt0 -41.26 -35.35 0.61 Allowed 'General case' 0 C--N 1.287 -2.113 0 O-C-N 127.399 2.937 . . . . 16.81 109.897 174.512 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 77.5 m -118.7 -20.58 8.23 Favored 'General case' 0 C--O 1.24 0.573 0 O-C-N 127.065 2.728 . . . . 11.53 117.303 -174.684 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' HIS . . . . . 0.413 ' CE1' ' HD2' ' A' ' 30' ' ' PRO . 93.8 m-70 -131.32 154.07 48.94 Favored 'General case' 0 N--CA 1.49 1.533 1 O-C-N 129.91 4.506 . . . . 8.28 115.035 -177.847 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 19' ' ' THR . . . . . 0.57 HG21 ' HD2' ' A' ' 25' ' ' PRO . 18.5 p -107.86 153.59 22.8 Favored 'General case' 0 CA--C 1.559 1.293 0 N-CA-C 102.699 -3.074 . . . . 6.54 102.699 172.867 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 20' ' ' VAL . . . . . 0.587 HG13 ' CZ ' ' A' ' 10' ' ' PHE . 33.7 m -117.27 -12.81 11.2 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.01 0 O-C-N 127.127 2.767 . . . . 13.26 117.6 177.088 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 21' ' ' GLU . . . . . 0.5 ' OE1' ' HB ' ' A' ' 19' ' ' THR . 0.1 OUTLIER -72.44 148.08 45.5 Favored 'General case' 0 C--N 1.319 -0.757 0 O-C-N 117.45 -3.281 . . . . 27.29 115.228 -178.972 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.5 tptm -56.88 118.25 4.75 Favored 'General case' 0 N--CA 1.503 2.182 0 CA-C-O 116.429 -1.748 . . . . 14.55 107.269 176.839 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 82.8 7.83 86.77 Favored Glycine 0 N--CA 1.503 3.125 0 C-N-CA 114.779 -3.581 . . . . 5.48 111.501 179.167 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -72.18 148.15 42.17 Favored Glycine 0 N--CA 1.491 2.357 1 N-CA-C 100.704 -4.958 . . . . 11.54 100.704 171.993 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 25' ' ' PRO . . . . . 0.57 ' HD2' HG21 ' A' ' 19' ' ' THR . 40.1 Cg_endo -81.16 164.18 19.72 Favored 'Trans proline' 0 C--N 1.311 -1.432 0 C-N-CA 121.029 1.153 . . . . 8.21 115.077 -177.926 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 27.1 m-70 -83.14 159.13 22.13 Favored 'General case' 0 N--CA 1.511 2.594 0 N-CA-C 103.139 -2.911 . . . . 5.63 103.139 173.924 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' LYS . . . . . 0.741 ' HD2' ' O ' ' A' ' 125' ' ' HOH . 17.6 mtmt -138.02 -137.85 0.14 Allowed 'General case' 0 C--O 1.266 1.954 0 C-N-CA 129.744 3.218 . . . . 7.76 107.818 177.918 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 3.5 t -56.92 -45.29 83.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 CA-C-O 124.498 2.094 . . . . 7.4 105.615 178.113 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -107.14 158.52 15.05 Favored Glycine 0 N--CA 1.488 2.157 0 N-CA-C 103.939 -3.664 . . . . 6.44 103.939 -179.461 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' PRO . . . . . 0.413 ' HD2' ' CE1' ' A' ' 18' ' ' HIS . 78.2 Cg_endo -72.73 160.68 45.75 Favored 'Trans proline' 0 C--O 1.269 2.049 0 O-C-N 126.824 3.013 . . . . 6.95 114.494 -178.136 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.269 18.9 t-20 -67.04 139.89 57.64 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 126.859 2.599 . . . . 6.32 104.592 174.228 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 8.5 mt -106.82 14.99 26.03 Favored 'General case' 0 C--O 1.261 1.659 0 CA-C-N 120.798 1.635 . . . . 5.76 109.96 -176.987 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 11.3 t60 -66.15 142.78 57.63 Favored 'General case' 0 N--CA 1.513 2.71 0 C-N-CA 113.364 -3.334 . . . . 13.22 104.854 -178.109 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 69.42 15.84 70.87 Favored Glycine 0 CA--C 1.535 1.324 1 O-C-N 129.388 4.18 . . . . 9.86 115.731 -177.788 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ILE . . . . . 0.457 HD11 HBA2 ' A' ' 104' ' ' HEM . 4.0 tp -58.67 -37.39 65.28 Favored 'Isoleucine or valine' 0 C--O 1.246 0.915 0 CA-C-N 123.706 3.753 . . . . 11.19 115.302 -178.803 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 36' ' ' PHE . . . . . 0.505 ' HA ' ' O ' ' A' ' 59' ' ' TRP . 74.5 m-85 -69.14 134.92 49.93 Favored 'General case' 0 C--O 1.237 0.408 0 O-C-N 119.538 -1.976 . . . . 24.11 106.865 179.829 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 89.05 -21.25 28.56 Favored Glycine 0 C--N 1.308 -0.997 0 CA-C-N 112.685 -2.052 . . . . 21.13 110.566 178.972 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 49.6 ttp180 -83.84 160.21 21.21 Favored 'General case' 0 N--CA 1.506 2.328 0 CA-C-N 112.114 -2.043 . . . . 29.92 107.506 -179.422 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' HIS . . . . . 0.706 ' CD2' HD23 ' A' ' 58' ' ' LEU . 65.4 m80 -98.65 159.17 15.13 Favored 'General case' 0 C--O 1.267 1.994 0 N-CA-C 106.403 -1.703 . . . . 18.02 106.403 178.636 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 40' ' ' SER . . . . . 0.67 ' HA ' ' O2A' ' A' ' 104' ' ' HEM . 19.9 p -67.69 141.56 56.62 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-O 123.474 1.607 . . . . 14.95 112.665 178.593 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 41' ' ' GLY . . . . . 0.532 ' HA2' ' CE2' ' A' ' 48' ' ' TYR . . . 73.63 32.73 59.09 Favored Glycine 0 C--O 1.277 2.797 0 N-CA-C 118.339 2.095 . . . . 14.14 118.339 -179.637 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 -122.94 8.47 9.32 Favored 'General case' 0 C--O 1.252 1.192 0 CA-C-N 122.061 2.93 . . . . 15.98 115.489 -177.172 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -83.9 128.83 34.82 Favored 'General case' 0 CA--C 1.561 1.366 0 N-CA-C 101.444 -3.539 . . . . 15.88 101.444 175.914 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -82.98 148.45 27.58 Favored 'General case' 0 C--O 1.247 0.939 0 CA-C-O 124.908 2.29 . . . . 25.73 108.53 -179.319 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 85.43 18.42 60.48 Favored Glycine 0 C--O 1.257 1.543 2 CA-C-N 106.728 -4.76 . . . . 14.41 107.081 178.455 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 39.4 t80 -132.53 131.58 41.73 Favored 'General case' 0 C--N 1.307 -1.277 0 O-C-N 129.616 3.774 . . . . 11.98 112.075 176.708 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' SER . . . . . 0.464 ' HB3' ' O ' ' A' ' 113' ' ' HOH . 47.1 t -95.16 105.41 17.34 Favored 'General case' 0 C--O 1.269 2.122 0 O-C-N 118.983 -2.323 . . . . 12.47 107.975 179.195 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 48' ' ' TYR . . . . . 0.532 ' CE2' ' HA2' ' A' ' 41' ' ' GLY . 97.6 m-85 -97.56 154.05 17.78 Favored 'General case' 0 C--N 1.309 -1.164 0 C-N-CA 129.663 3.185 . . . . 9.78 109.515 178.311 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 49' ' ' THR . . . . . 0.556 HG23 ' CD ' ' A' ' 79' ' ' LYS . 60.8 p -65.64 164.98 13.26 Favored 'General case' 0 C--N 1.301 -1.526 0 CA-C-O 123.494 1.616 . . . . 16.47 111.137 174.868 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . 0.303 67.5 m-20 -60.7 -50.88 71.72 Favored 'General case' 0 CA--C 1.514 -0.414 0 N-CA-C 107.393 -1.336 . . . . 22.96 107.393 179.527 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -45.7 -49.47 14.6 Favored 'General case' 0 C--O 1.26 1.632 0 O-C-N 127.649 3.093 . . . . 18.32 116.338 -179.851 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ILE . . . . . 0.461 ' CG2' ' HB3' ' A' ' 48' ' ' TYR 0.256 4.4 tt -67.24 -49.98 67.36 Favored 'Isoleucine or valine' 0 C--O 1.247 0.948 0 C-N-CA 117.675 -1.61 . . . . 15.67 112.398 -179.675 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ILE . . . . . 0.639 HD11 ' O ' ' A' ' 153' ' ' HOH . 1.5 mt -53.74 -47.46 62.37 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.34 0 O-C-N 118.004 -2.935 . . . . 21.24 109.185 178.813 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.14 -33.33 69.06 Favored 'General case' 0 C--N 1.306 -1.312 0 CA-C-N 111.905 -2.407 . . . . 20.57 114.943 -176.11 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 55' ' ' LYS . . . . . 0.94 ' HG3' HG23 ' A' ' 57' ' ' VAL 0.303 5.1 tptm -76.96 -32.33 57.21 Favored 'General case' 0 C--N 1.312 -1.047 0 O-C-N 126.544 2.402 . . . . 27.71 110.187 -178.536 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 61.4 t30 40.53 65.87 0.71 Allowed 'General case' 0 C--N 1.316 -0.877 0 CA-C-O 118.135 -0.936 . . . . 30.23 111.251 178.093 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' VAL . . . . . 0.94 HG23 ' HG3' ' A' ' 55' ' ' LYS . 60.3 t -86.92 133.4 30.04 Favored 'Isoleucine or valine' 0 C--O 1.255 1.367 0 C-N-CA 128.22 2.608 . . . . 26.74 110.764 179.82 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 58' ' ' LEU . . . . . 0.706 HD23 ' CD2' ' A' ' 39' ' ' HIS . 0.2 OUTLIER -82.95 132.01 35.17 Favored 'General case' 0 N--CA 1.493 1.701 0 N-CA-C 102.2 -3.259 . . . . 26.99 102.2 178.541 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 59' ' ' TRP . . . . . 0.505 ' O ' ' HA ' ' A' ' 36' ' ' PHE . 5.7 m95 -96.18 110.5 22.77 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 125.071 2.367 . . . . 18.59 110.536 -174.626 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ASP . . . . . 0.493 ' OD1' ' N ' ' A' ' 62' ' ' ASN . 0.7 OUTLIER -140.71 166.55 24.43 Favored 'General case' 0 C--O 1.26 1.633 0 C-N-CA 131.291 3.836 . . . . 22.45 107.582 -177.104 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 61' ' ' GLU . . . . . 0.553 ' HG2' ' O ' ' A' ' 184' ' ' HOH . 0.0 OUTLIER -59.07 -40.03 83.94 Favored 'General case' 0 C--O 1.27 2.16 0 O-C-N 127.679 3.112 . . . . 31.53 113.502 -177.911 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 62' ' ' ASN . . . . . 0.493 ' N ' ' OD1' ' A' ' 60' ' ' ASP . 1.0 OUTLIER -59.52 -46.86 87.63 Favored 'General case' 0 C--O 1.25 1.093 0 N-CA-C 115.471 1.656 . . . . 28.65 115.471 -176.026 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . 0.255 1.5 t-20 -70.43 -42.42 71.59 Favored 'General case' 0 C--N 1.282 -2.346 2 CA-C-O 129.473 4.463 . . . . 30.94 113.169 179.972 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 29.5 tpp -65.94 -24.31 66.79 Favored 'General case' 0 N--CA 1.485 1.28 0 CA-C-N 111.737 -2.483 . . . . 24.13 110.388 -177.608 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.8 t -74.42 -45.23 47.86 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 115.202 -0.908 . . . . 21.07 111.451 178.687 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . 0.359 1.0 OUTLIER -74.7 -36.45 62.74 Favored 'General case' 0 C--O 1.245 0.836 0 O-C-N 126.13 2.144 . . . . 25.32 106.574 -179.111 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 67' ' ' TYR . . . . . 0.513 ' CE2' ' HB3' ' A' ' 71' ' ' PRO . 44.2 t80 -59.31 -38.86 81.3 Favored 'General case' 0 N--CA 1.498 1.968 0 C-N-CA 116.265 -2.174 . . . . 23.65 106.721 178.62 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . 0.403 8.9 mt -68.01 -27.81 66.88 Favored 'General case' 0 C--O 1.264 1.863 0 O-C-N 127.015 2.697 . . . . 20.7 112.796 -176.016 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 69' ' ' THR . . . . . 0.627 HG22 ' HZ1' ' A' ' 86' ' ' LYS . 2.4 m -68.9 -39.76 79.54 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 114.784 -2.766 . . . . 23.26 111.557 179.268 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -169.38 91.82 0.55 Allowed Pre-proline 0 C--N 1.309 -1.161 0 CA-C-O 115.654 -2.117 . . . . 26.46 106.439 -174.69 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' PRO . . . . . 0.513 ' HB3' ' CE2' ' A' ' 67' ' ' TYR 0.409 3.3 Cg_endo -61.4 -49.34 7.72 Favored 'Trans proline' 0 C--O 1.26 1.576 1 O-C-N 129.866 4.614 . . . . 17.29 116.009 -176.49 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 72' ' ' M3L . . . . . 0.697 ' HG2' ' O ' ' A' ' 172' ' ' HOH . . . . . . . . 0 N--CA 1.496 1.852 0 CA-C-O 126.06 2.838 . . . . 19.83 111.146 178.995 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 7.9 tptm -74.35 -65.84 0.8 Allowed 'General case' 0 C--O 1.257 1.464 0 CA-C-N 111.257 -2.701 . . . . 25.39 104.431 178.303 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 51.4 t80 -49.9 -40.27 42.57 Favored 'General case' 0 C--O 1.269 2.124 0 O-C-N 127.486 2.991 . . . . 16.38 115.381 179.785 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -138.77 90.33 12.57 Favored Pre-proline 0 C--O 1.264 1.84 1 C-N-CA 133.457 4.703 . . . . 18.42 114.606 177.75 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -66.9 141.81 60.16 Favored 'Trans proline' 0 C--O 1.266 1.906 0 N-CA-C 103.316 -3.379 . . . . 16.34 103.316 -179.863 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 98.9 -18.74 56.41 Favored Glycine 0 C--O 1.252 1.277 0 CA-C-O 114.537 -3.368 . . . . 14.93 111.417 -179.01 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 9.4 t -58.26 142.13 48.72 Favored 'General case' 0 N--CA 1.483 1.201 0 O-C-N 126.238 1.787 . . . . 11.73 110.861 179.243 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' LYS . . . . . 0.556 ' CD ' HG23 ' A' ' 49' ' ' THR . 0.0 OUTLIER -87.89 -0.24 56.72 Favored 'General case' 0 C--N 1.297 -1.689 0 O-C-N 125.023 1.452 . . . . 17.94 109.53 -179.784 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 2.4 ttt -65.61 106.95 1.58 Allowed 'General case' 0 C--O 1.258 1.516 0 CA-C-O 115.091 -2.385 . . . . 11.32 108.403 176.554 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -85.97 67.86 10.14 Favored 'General case' 0 N--CA 1.494 1.737 1 O-C-N 130.759 5.037 . . . . 12.99 112.616 177.123 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 82' ' ' PHE . . . . . 0.489 ' CE1' ' HA2' ' A' ' 84' ' ' GLY 0.346 42.6 t80 -132.44 128.52 37.65 Favored 'General case' 0 N--CA 1.493 1.689 0 CA-C-O 127.973 3.749 . . . . 11.02 110.15 178.18 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -61.19 -55.77 27.56 Favored Glycine 0 CA--C 1.553 2.425 0 O-C-N 118.212 -2.805 . . . . 10.79 108.234 -177.186 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' GLY . . . . . 0.489 ' HA2' ' CE1' ' A' ' 82' ' ' PHE . . . 144.16 -177.75 22.6 Favored Glycine 0 N--CA 1.478 1.478 0 O-C-N 129.992 3.995 . . . . 10.47 107.056 177.233 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . 0.272 11.0 mt -125.7 84.73 2.31 Favored 'General case' 0 C--N 1.272 -2.787 2 C-N-CA 150.211 11.404 . . . . 7.55 107.974 178.171 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' A' A ' 86' ' ' LYS . . . . . 0.742 ' HA ' ' HZ3' ' A' ' 86' ' ' LYS . 0.0 OUTLIER -78.58 -23.18 46.19 Favored 'General case' 0 C--O 1.264 1.84 1 O-C-N 113.898 -5.501 . . . . 27.57 110.796 -179.352 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 87' ' ' LYS . . . . . 0.674 ' HB2' ' OD1' ' A' ' 90' ' ' ASP . 13.8 mttp -78.76 121.91 25.36 Favored 'General case' 0 C--O 1.258 1.549 0 O-C-N 124.484 1.115 . . . . 17.16 109.768 178.774 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -63.65 -36.8 85.03 Favored 'General case' 0 C--O 1.274 2.347 0 CA-C-O 125.257 2.456 . . . . 16.84 108.606 177.645 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' LYS . . . . . 0.432 ' HE3' ' O ' ' A' ' 118' ' ' HOH 0.296 0.9 OUTLIER -59.25 -46.79 87.54 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-O 112.358 -3.686 . . . . 16.35 109.141 178.623 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 90' ' ' ASP . . . . . 0.674 ' OD1' ' HB2' ' A' ' 87' ' ' LYS . 25.9 m-20 -65.18 -41.6 94.44 Favored 'General case' 0 C--O 1.252 1.22 0 CA-C-N 123.094 2.679 . . . . 20.01 113.406 -178.659 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 11.6 mtm180 -56.48 -45.68 80.83 Favored 'General case' 0 N--CA 1.421 -1.896 0 C-N-CA 127.856 2.462 . . . . 23.48 106.524 177.184 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . 0.31 77.8 m-20 -62.55 -50.8 69.91 Favored 'General case' 0 C--O 1.268 2.042 0 C-N-CA 116.068 -2.253 . . . . 14.01 112.735 -179.402 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 93' ' ' ASP . . . . . 0.403 ' OD2' ' HG3' ' A' ' 5' ' ' LYS . 92.9 m-20 -52.87 -56.72 13.75 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-O 124.906 2.288 . . . . 12.51 111.027 179.064 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 40.5 tp -53.79 -45.15 70.61 Favored 'General case' 0 C--O 1.26 1.608 0 CA-C-N 111.761 -2.472 . . . . 5.61 111.48 -176.734 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . 0.26 91.2 mt -68.75 -31.19 49.81 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 O-C-N 126.229 2.206 . . . . 8.97 112.184 -179.411 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 96' ' ' THR . . . . . 0.694 ' O ' ' NZ ' ' A' ' 99' ' ' LYS 0.345 22.7 m -65.79 -39.55 91.07 Favored 'General case' 0 C--N 1.298 -1.655 0 N-CA-C 103.369 -2.826 . . . . 17.68 103.369 178.291 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 97' ' ' TYR . . . . . 0.58 ' HB2' ' HA3' ' A' ' 6' ' ' GLY . 81.3 t80 -66.04 -48.36 71.35 Favored 'General case' 0 C--O 1.255 1.35 0 CA-C-N 115.32 -0.855 . . . . 15.94 111.763 176.681 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 5.7 mt -70.13 -38.21 75.49 Favored 'General case' 0 N--CA 1.491 1.58 0 CA-C-O 116.891 -1.528 . . . . 14.97 109.931 -176.028 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' LYS . . . . . 0.77 ' NZ ' ' HG2' ' A' ' 100' ' ' LYS . 1.7 ttpm? -53.73 -36.06 61.88 Favored 'General case' 0 C--O 1.267 1.988 1 O-C-N 129.237 4.086 . . . . 15.1 107.355 179.397 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 100' ' ' LYS . . . . . 0.77 ' HG2' ' NZ ' ' A' ' 99' ' ' LYS . 17.6 mmmt -80.77 -51.14 8.98 Favored 'General case' 0 C--O 1.251 1.154 0 CA-C-O 114.036 -2.887 . . . . 24.93 118.533 -178.32 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 101' ' ' ALA . . . . . 0.578 ' C ' ' H ' ' A' ' 103' ' ' GLU . . . -82.56 -36.08 26.59 Favored 'General case' 0 N--CA 1.486 1.353 0 O-C-N 127.169 2.793 . . . . 18.77 115.814 -177.273 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 3.6 m -73.05 16.54 0.16 Allowed 'General case' 0 N--CA 1.485 1.306 0 CA-C-O 123.529 1.633 . . . . 22.7 107.459 178.369 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' GLU . . . . . 0.578 ' H ' ' C ' ' A' ' 101' ' ' ALA . 29.1 tp10 . . . . . 0 C--O 1.256 1.423 0 CA-C-O 112.537 -3.601 . . . . 21.21 113.689 179.862 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' SO4 . . . . . 0.417 ' O1 ' ' HG3' ' A' ' 4' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' HEM . . . . . 0.67 ' O2A' ' HA ' ' A' ' 40' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 113' ' ' HOH . . . . . 0.464 ' O ' ' HB3' ' A' ' 47' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 118' ' ' HOH . . . . . 0.432 ' O ' ' HE3' ' A' ' 89' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 125' ' ' HOH . . . . . 0.741 ' O ' ' HD2' ' A' ' 27' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 151' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 152' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 153' ' ' HOH . . . . . 0.639 ' O ' HD11 ' A' ' 53' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 154' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 155' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 157' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 158' ' ' HOH . . . . . 0.513 ' O ' ' HG3' ' A' ' 87' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 160' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 161' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 162' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 163' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 167' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 168' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 169' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 172' ' ' HOH . . . . . 0.697 ' O ' ' HG2' ' A' ' 72' ' ' M3L . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 175' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 182' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 184' ' ' HOH . . . . . 0.553 ' O ' ' HG2' ' A' ' 61' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 185' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 188' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 189' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 195' ' ' HOH . . . . . 0.494 ' O ' ' HA ' ' A' ' 19' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 196' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 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 ' 200' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 300' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' -5' ' ' THR . . . . . . . . . . . . . 8.8 t . . . . . 0 N--CA 1.483 1.179 0 N-CA-C 106.946 -1.502 . . . . 41.76 106.946 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' -4' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -151.56 2.2 0.39 Allowed 'General case' 0 C--O 1.254 1.3 0 CA-C-O 117.63 -1.176 . . . . 42.7 112.399 -178.239 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 18.9 t80 -133.03 127.09 33.32 Favored 'General case' 0 N--CA 1.483 1.204 0 CA-C-O 116.367 -1.778 . . . . 42.27 106.429 178.511 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -120.08 147.23 45.11 Favored 'General case' 0 C--N 1.303 -1.427 1 O-C-N 129.986 4.554 . . . . 39.71 106.307 -178.232 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -77.21 126.74 31.43 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 119.898 3.296 . . . . 31.52 119.898 -176.359 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -93.5 -166.36 37.8 Favored Glycine 0 C--N 1.317 -0.504 0 C-N-CA 127.643 2.544 . . . . 25.72 110.815 -179.736 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' SER . . . . . 0.49 ' HB3' ' HB3' ' A' ' 5' ' ' LYS . 22.4 t -92.8 119.44 32.15 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-O 115.666 -2.111 . . . . 17.72 110.247 -179.313 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -65.92 -41.19 91.73 Favored 'General case' 0 C--O 1.267 1.999 0 O-C-N 126.467 2.354 . . . . 12.61 109.572 177.281 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.417 ' HG3' ' O1 ' ' A' ' 117' ' ' SO4 . 1.2 mttm -58.99 -45.45 90.57 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 117.772 -1.571 . . . . 18.77 107.749 175.989 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.49 ' HB3' ' HB3' ' A' ' 2' ' ' SER . 2.2 tppp? -68.78 -32.98 73.1 Favored 'General case' 0 N--CA 1.507 2.406 0 CA-C-O 123.23 1.49 . . . . 17.07 107.361 -178.841 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' GLY . . . . . 0.58 ' HA3' ' HB2' ' A' ' 97' ' ' TYR . . . -61.89 -54.32 36.18 Favored Glycine 0 CA--C 1.559 2.825 0 CA-C-O 116.754 -2.137 . . . . 10.35 107.765 176.598 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.46 ' HB2' ' CE1' ' A' ' 97' ' ' TYR . . . -51.5 -38.52 54.4 Favored 'General case' 0 C--O 1.263 1.792 0 N-CA-C 116.918 2.192 . . . . 11.15 116.918 179.681 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' THR . . . . . 0.426 ' HA ' ' HD2' ' A' ' 11' ' ' LYS . 75.5 p -81.85 -24.13 35.98 Favored 'General case' 0 C--N 1.297 -1.717 0 CA-C-O 123.3 1.524 . . . . 15.36 112.01 -178.61 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.84 -45.38 61.63 Favored 'General case' 0 C--O 1.222 -0.38 0 N-CA-C 103.026 -2.953 . . . . 20.35 103.026 179.366 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.587 ' CZ ' HG13 ' A' ' 20' ' ' VAL . 42.6 t80 -55.68 -56.98 14.0 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 128.24 3.462 . . . . 10.19 109.63 177.994 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.426 ' HD2' ' HA ' ' A' ' 8' ' ' THR . 26.9 mttt -49.93 -41.75 46.83 Favored 'General case' 0 CA--C 1.545 0.754 0 O-C-N 125.482 1.739 . . . . 14.86 112.701 178.478 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 21.2 p -91.3 -19.01 23.42 Favored 'General case' 0 CA--C 1.5 -0.96 0 O-C-N 117.284 -3.385 . . . . 13.84 111.725 -178.765 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.8 mtp180 -118.02 -8.91 10.66 Favored 'General case' 0 C--O 1.268 2.058 1 CA-C-N 126.723 4.329 . . . . 26.14 118.034 -179.49 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 7.1 m -132.81 -23.18 2.04 Favored 'General case' 0 CA--C 1.501 -0.919 0 CA-C-O 112.739 -3.505 . . . . 6.51 114.256 -176.465 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 33.9 tp -57.24 -44.81 84.15 Favored 'General case' 0 C--N 1.306 -1.297 0 C-N-CA 128.809 2.844 . . . . 5.64 112.256 -177.359 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 54.7 tt0 -41.26 -35.35 0.61 Allowed 'General case' 0 C--N 1.287 -2.113 0 O-C-N 127.399 2.937 . . . . 16.81 109.897 174.512 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 77.5 m -118.7 -20.58 8.23 Favored 'General case' 0 C--O 1.24 0.573 0 O-C-N 127.065 2.728 . . . . 11.53 117.303 -174.684 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.413 ' CE1' ' HD2' ' A' ' 30' ' ' PRO . 93.8 m-70 -131.32 154.07 48.94 Favored 'General case' 0 N--CA 1.49 1.533 1 O-C-N 129.91 4.506 . . . . 8.28 115.035 -177.847 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' THR . . . . . 0.57 HG21 ' HD2' ' A' ' 25' ' ' PRO . 18.5 p -107.86 153.59 22.8 Favored 'General case' 0 CA--C 1.559 1.293 0 N-CA-C 102.699 -3.074 . . . . 6.54 102.699 172.867 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.587 HG13 ' CZ ' ' A' ' 10' ' ' PHE . 33.7 m -117.27 -12.81 11.2 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.01 0 O-C-N 127.127 2.767 . . . . 13.26 117.6 177.088 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.5 ' OE1' ' HB ' ' A' ' 19' ' ' THR . 0.1 OUTLIER -72.44 148.08 45.5 Favored 'General case' 0 C--N 1.319 -0.757 0 O-C-N 117.45 -3.281 . . . . 27.29 115.228 -178.972 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.5 tptm -56.88 118.25 4.75 Favored 'General case' 0 N--CA 1.503 2.182 0 CA-C-O 116.429 -1.748 . . . . 14.55 107.269 176.839 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 82.8 7.83 86.77 Favored Glycine 0 N--CA 1.503 3.125 0 C-N-CA 114.779 -3.581 . . . . 5.48 111.501 179.167 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -72.18 148.15 42.17 Favored Glycine 0 N--CA 1.491 2.357 1 N-CA-C 100.704 -4.958 . . . . 11.54 100.704 171.993 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.57 ' HD2' HG21 ' A' ' 19' ' ' THR . 40.1 Cg_endo -81.16 164.18 19.72 Favored 'Trans proline' 0 C--N 1.311 -1.432 0 C-N-CA 121.029 1.153 . . . . 8.21 115.077 -177.926 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 27.1 m-70 -83.14 159.13 22.13 Favored 'General case' 0 N--CA 1.511 2.594 0 N-CA-C 103.139 -2.911 . . . . 5.63 103.139 173.924 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.741 ' HD2' ' O ' ' A' ' 125' ' ' HOH . 17.6 mtmt -138.02 -137.85 0.14 Allowed 'General case' 0 C--O 1.266 1.954 0 C-N-CA 129.744 3.218 . . . . 7.76 107.818 177.918 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 3.5 t -56.92 -45.29 83.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 CA-C-O 124.498 2.094 . . . . 7.4 105.615 178.113 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -107.14 158.52 15.05 Favored Glycine 0 N--CA 1.488 2.157 0 N-CA-C 103.939 -3.664 . . . . 6.44 103.939 -179.461 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.413 ' HD2' ' CE1' ' A' ' 18' ' ' HIS . 78.2 Cg_endo -72.73 160.68 45.75 Favored 'Trans proline' 0 C--O 1.269 2.049 0 O-C-N 126.824 3.013 . . . . 6.95 114.494 -178.136 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.269 18.9 t-20 -67.04 139.89 57.64 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 126.859 2.599 . . . . 6.32 104.592 174.228 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 8.5 mt -106.82 14.99 26.03 Favored 'General case' 0 C--O 1.261 1.659 0 CA-C-N 120.798 1.635 . . . . 5.76 109.96 -176.987 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 11.3 t60 -66.15 142.78 57.63 Favored 'General case' 0 N--CA 1.513 2.71 0 C-N-CA 113.364 -3.334 . . . . 13.22 104.854 -178.109 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 69.42 15.84 70.87 Favored Glycine 0 CA--C 1.535 1.324 1 O-C-N 129.388 4.18 . . . . 9.86 115.731 -177.788 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.457 HD11 HBA2 ' A' ' 104' ' ' HEM . 4.0 tp -58.67 -37.39 65.28 Favored 'Isoleucine or valine' 0 C--O 1.246 0.915 0 CA-C-N 123.706 3.753 . . . . 11.19 115.302 -178.803 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.505 ' HA ' ' O ' ' A' ' 59' ' ' TRP . 74.5 m-85 -69.14 134.92 49.93 Favored 'General case' 0 C--O 1.237 0.408 0 O-C-N 119.538 -1.976 . . . . 24.11 106.865 179.829 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 89.05 -21.25 28.56 Favored Glycine 0 C--N 1.308 -0.997 0 CA-C-N 112.685 -2.052 . . . . 21.13 110.566 178.972 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 49.6 ttp180 -83.84 160.21 21.21 Favored 'General case' 0 N--CA 1.506 2.328 0 CA-C-N 112.114 -2.043 . . . . 29.92 107.506 -179.422 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' HIS . . . . . 0.706 ' CD2' HD23 ' A' ' 58' ' ' LEU . 65.4 m80 -98.65 159.17 15.13 Favored 'General case' 0 C--O 1.267 1.994 0 N-CA-C 106.403 -1.703 . . . . 18.02 106.403 178.636 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' SER . . . . . 0.67 ' HA ' ' O2A' ' A' ' 104' ' ' HEM . 19.9 p -67.69 141.56 56.62 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-O 123.474 1.607 . . . . 14.95 112.665 178.593 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.532 ' HA2' ' CE2' ' A' ' 48' ' ' TYR . . . 73.63 32.73 59.09 Favored Glycine 0 C--O 1.277 2.797 0 N-CA-C 118.339 2.095 . . . . 14.14 118.339 -179.637 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.48 HE21 ' HB3' ' A' ' 42' ' ' GLN . 0.7 OUTLIER -122.94 8.47 9.32 Favored 'General case' 0 C--O 1.252 1.192 0 CA-C-N 122.061 2.93 . . . . 15.98 115.489 -177.172 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -83.9 128.83 34.82 Favored 'General case' 0 CA--C 1.561 1.366 0 N-CA-C 101.444 -3.539 . . . . 15.88 101.444 175.914 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -82.98 148.45 27.58 Favored 'General case' 0 C--O 1.247 0.939 0 CA-C-O 124.908 2.29 . . . . 25.73 108.53 -179.319 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 85.43 18.42 60.48 Favored Glycine 0 C--O 1.257 1.543 2 CA-C-N 106.728 -4.76 . . . . 14.41 107.081 178.455 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 39.4 t80 -132.53 131.58 41.73 Favored 'General case' 0 C--N 1.307 -1.277 0 O-C-N 129.616 3.774 . . . . 11.98 112.075 176.708 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' SER . . . . . 0.464 ' HB3' ' O ' ' A' ' 113' ' ' HOH . 47.1 t -95.16 105.41 17.34 Favored 'General case' 0 C--O 1.269 2.122 0 O-C-N 118.983 -2.323 . . . . 12.47 107.975 179.195 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.532 ' CE2' ' HA2' ' A' ' 41' ' ' GLY . 97.6 m-85 -97.56 154.05 17.78 Favored 'General case' 0 C--N 1.309 -1.164 0 C-N-CA 129.663 3.185 . . . . 9.78 109.515 178.311 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' THR . . . . . 0.556 HG23 ' CD ' ' A' ' 79' ' ' LYS . 60.8 p -65.64 164.98 13.26 Favored 'General case' 0 C--N 1.301 -1.526 0 CA-C-O 123.494 1.616 . . . . 16.47 111.137 174.868 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . 0.303 67.5 m-20 -60.7 -50.88 71.72 Favored 'General case' 0 CA--C 1.514 -0.414 0 N-CA-C 107.393 -1.336 . . . . 22.96 107.393 179.527 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -45.7 -49.47 14.6 Favored 'General case' 0 C--O 1.26 1.632 0 O-C-N 127.649 3.093 . . . . 18.32 116.338 -179.851 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.461 ' CG2' ' HB3' ' A' ' 48' ' ' TYR 0.256 4.4 tt -67.24 -49.98 67.36 Favored 'Isoleucine or valine' 0 C--O 1.247 0.948 0 C-N-CA 117.675 -1.61 . . . . 15.67 112.398 -179.675 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.639 HD11 ' O ' ' A' ' 153' ' ' HOH . 1.5 mt -53.74 -47.46 62.37 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.34 0 O-C-N 118.004 -2.935 . . . . 21.24 109.185 178.813 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.14 -33.33 69.06 Favored 'General case' 0 C--N 1.306 -1.312 0 CA-C-N 111.905 -2.407 . . . . 20.57 114.943 -176.11 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.94 ' HG3' HG23 ' A' ' 57' ' ' VAL 0.303 5.1 tptm -76.96 -32.33 57.21 Favored 'General case' 0 C--N 1.312 -1.047 0 O-C-N 126.544 2.402 . . . . 27.71 110.187 -178.536 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 40.53 65.87 0.71 Allowed 'General case' 0 C--N 1.316 -0.877 0 CA-C-O 118.135 -0.936 . . . . 30.23 111.251 178.093 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.94 HG23 ' HG3' ' A' ' 55' ' ' LYS . 60.3 t -86.92 133.4 30.04 Favored 'Isoleucine or valine' 0 C--O 1.255 1.367 0 C-N-CA 128.22 2.608 . . . . 26.74 110.764 179.82 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.706 HD23 ' CD2' ' A' ' 39' ' ' HIS . 0.2 OUTLIER -82.95 132.01 35.17 Favored 'General case' 0 N--CA 1.493 1.701 0 N-CA-C 102.2 -3.259 . . . . 26.99 102.2 178.541 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' TRP . . . . . 0.505 ' O ' ' HA ' ' A' ' 36' ' ' PHE . 5.7 m95 -96.18 110.5 22.77 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 125.071 2.367 . . . . 18.59 110.536 -174.626 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.493 ' OD1' ' N ' ' A' ' 62' ' ' ASN . 0.7 OUTLIER -140.71 166.55 24.43 Favored 'General case' 0 C--O 1.26 1.633 0 C-N-CA 131.291 3.836 . . . . 22.45 107.582 -177.104 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.553 ' HG2' ' O ' ' A' ' 184' ' ' HOH . 0.0 OUTLIER -59.07 -40.03 83.94 Favored 'General case' 0 C--O 1.27 2.16 0 O-C-N 127.679 3.112 . . . . 31.53 113.502 -177.911 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.493 ' N ' ' OD1' ' A' ' 60' ' ' ASP . 1.0 OUTLIER -59.52 -46.86 87.63 Favored 'General case' 0 C--O 1.25 1.093 0 N-CA-C 115.471 1.656 . . . . 28.65 115.471 -176.026 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . 0.255 1.5 t-20 -70.43 -42.42 71.59 Favored 'General case' 0 C--N 1.282 -2.346 2 CA-C-O 129.473 4.463 . . . . 30.94 113.169 179.972 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 29.5 tpp -65.94 -24.31 66.79 Favored 'General case' 0 N--CA 1.485 1.28 0 CA-C-N 111.737 -2.483 . . . . 24.13 110.388 -177.608 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.8 t -74.42 -45.23 47.86 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 115.202 -0.908 . . . . 21.07 111.451 178.687 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . 0.359 1.0 OUTLIER -74.7 -36.45 62.74 Favored 'General case' 0 C--O 1.245 0.836 0 O-C-N 126.13 2.144 . . . . 25.32 106.574 -179.111 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.513 ' CE2' ' HB3' ' A' ' 71' ' ' PRO . 44.2 t80 -59.31 -38.86 81.3 Favored 'General case' 0 N--CA 1.498 1.968 0 C-N-CA 116.265 -2.174 . . . . 23.65 106.721 178.62 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . 0.403 8.9 mt -68.01 -27.81 66.88 Favored 'General case' 0 C--O 1.264 1.863 0 O-C-N 127.015 2.697 . . . . 20.7 112.796 -176.016 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' THR . . . . . 0.627 HG22 ' HZ1' ' A' ' 86' ' ' LYS . 2.4 m -68.9 -39.76 79.54 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 114.784 -2.766 . . . . 23.26 111.557 179.268 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -169.38 91.82 0.55 Allowed Pre-proline 0 C--N 1.309 -1.161 0 CA-C-O 115.654 -2.117 . . . . 26.46 106.439 -174.69 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.513 ' HB3' ' CE2' ' A' ' 67' ' ' TYR 0.409 3.3 Cg_endo -61.4 -49.34 7.72 Favored 'Trans proline' 0 C--O 1.26 1.576 1 O-C-N 129.866 4.614 . . . . 17.29 116.009 -176.49 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' M3L . . . . . 0.697 ' HG2' ' O ' ' A' ' 172' ' ' HOH . . . . . . . . 0 N--CA 1.496 1.852 0 CA-C-O 126.06 2.838 . . . . 19.83 111.146 178.995 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 7.9 tptm -74.35 -65.84 0.8 Allowed 'General case' 0 C--O 1.257 1.464 0 CA-C-N 111.257 -2.701 . . . . 25.39 104.431 178.303 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 51.4 t80 -49.9 -40.27 42.57 Favored 'General case' 0 C--O 1.269 2.124 0 O-C-N 127.486 2.991 . . . . 16.38 115.381 179.785 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -138.77 90.33 12.57 Favored Pre-proline 0 C--O 1.264 1.84 1 C-N-CA 133.457 4.703 . . . . 18.42 114.606 177.75 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -66.9 141.81 60.16 Favored 'Trans proline' 0 C--O 1.266 1.906 0 N-CA-C 103.316 -3.379 . . . . 16.34 103.316 -179.863 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 98.9 -18.74 56.41 Favored Glycine 0 C--O 1.252 1.277 0 CA-C-O 114.537 -3.368 . . . . 14.93 111.417 -179.01 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 9.4 t -58.26 142.13 48.72 Favored 'General case' 0 N--CA 1.483 1.201 0 O-C-N 126.238 1.787 . . . . 11.73 110.861 179.243 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.556 ' CD ' HG23 ' A' ' 49' ' ' THR . 0.0 OUTLIER -87.89 -0.24 56.72 Favored 'General case' 0 C--N 1.297 -1.689 0 O-C-N 125.023 1.452 . . . . 17.94 109.53 -179.784 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 2.4 ttt -65.61 106.95 1.58 Allowed 'General case' 0 C--O 1.258 1.516 0 CA-C-O 115.091 -2.385 . . . . 11.32 108.403 176.554 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -85.97 67.86 10.14 Favored 'General case' 0 N--CA 1.494 1.737 1 O-C-N 130.759 5.037 . . . . 12.99 112.616 177.123 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' PHE . . . . . 0.489 ' CE1' ' HA2' ' A' ' 84' ' ' GLY 0.346 42.6 t80 -132.44 128.52 37.65 Favored 'General case' 0 N--CA 1.493 1.689 0 CA-C-O 127.973 3.749 . . . . 11.02 110.15 178.18 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -61.19 -55.77 27.56 Favored Glycine 0 CA--C 1.553 2.425 0 O-C-N 118.212 -2.805 . . . . 10.79 108.234 -177.186 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.489 ' HA2' ' CE1' ' A' ' 82' ' ' PHE . . . 144.16 -177.75 22.6 Favored Glycine 0 N--CA 1.478 1.478 0 O-C-N 129.992 3.995 . . . . 10.47 107.056 177.233 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . 0.272 11.0 mt -125.7 84.73 2.31 Favored 'General case' 0 C--N 1.272 -2.787 2 C-N-CA 150.211 11.404 . . . . 7.55 107.974 178.171 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.742 ' HA ' ' HZ3' ' A' ' 86' ' ' LYS . 0.0 OUTLIER -78.58 -23.18 46.19 Favored 'General case' 0 C--O 1.264 1.84 1 O-C-N 113.898 -5.501 . . . . 27.57 110.796 -179.352 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.674 ' HB2' ' OD1' ' A' ' 90' ' ' ASP . 13.8 mttp -78.76 121.91 25.36 Favored 'General case' 0 C--O 1.258 1.549 0 O-C-N 124.484 1.115 . . . . 17.16 109.768 178.774 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -63.65 -36.8 85.03 Favored 'General case' 0 C--O 1.274 2.347 0 CA-C-O 125.257 2.456 . . . . 16.84 108.606 177.645 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.432 ' HE3' ' O ' ' A' ' 118' ' ' HOH 0.296 0.9 OUTLIER -59.25 -46.79 87.54 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-O 112.358 -3.686 . . . . 16.35 109.141 178.623 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' ASP . . . . . 0.674 ' OD1' ' HB2' ' A' ' 87' ' ' LYS . 25.9 m-20 -65.18 -41.6 94.44 Favored 'General case' 0 C--O 1.252 1.22 0 CA-C-N 123.094 2.679 . . . . 20.01 113.406 -178.659 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 11.6 mtm180 -56.48 -45.68 80.83 Favored 'General case' 0 N--CA 1.421 -1.896 0 C-N-CA 127.856 2.462 . . . . 23.48 106.524 177.184 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . 0.31 77.8 m-20 -62.55 -50.8 69.91 Favored 'General case' 0 C--O 1.268 2.042 0 C-N-CA 116.068 -2.253 . . . . 14.01 112.735 -179.402 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.403 ' OD2' ' HG3' ' A' ' 5' ' ' LYS . 92.9 m-20 -52.87 -56.72 13.75 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-O 124.906 2.288 . . . . 12.51 111.027 179.064 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 40.5 tp -53.79 -45.15 70.61 Favored 'General case' 0 C--O 1.26 1.608 0 CA-C-N 111.761 -2.472 . . . . 5.61 111.48 -176.734 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . 0.26 91.2 mt -68.75 -31.19 49.81 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 O-C-N 126.229 2.206 . . . . 8.97 112.184 -179.411 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' THR . . . . . 0.694 ' O ' ' NZ ' ' A' ' 99' ' ' LYS 0.345 22.7 m -65.79 -39.55 91.07 Favored 'General case' 0 C--N 1.298 -1.655 0 N-CA-C 103.369 -2.826 . . . . 17.68 103.369 178.291 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.58 ' HB2' ' HA3' ' A' ' 6' ' ' GLY . 81.3 t80 -66.04 -48.36 71.35 Favored 'General case' 0 C--O 1.255 1.35 0 CA-C-N 115.32 -0.855 . . . . 15.94 111.763 176.681 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 5.7 mt -70.13 -38.21 75.49 Favored 'General case' 0 N--CA 1.491 1.58 0 CA-C-O 116.891 -1.528 . . . . 14.97 109.931 -176.028 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.77 ' NZ ' ' HG2' ' A' ' 100' ' ' LYS . 1.7 ttpm? -53.73 -36.06 61.88 Favored 'General case' 0 C--O 1.267 1.988 1 O-C-N 129.237 4.086 . . . . 15.1 107.355 179.397 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' LYS . . . . . 0.77 ' HG2' ' NZ ' ' A' ' 99' ' ' LYS . 17.6 mmmt -80.77 -51.14 8.98 Favored 'General case' 0 C--O 1.251 1.154 0 CA-C-O 114.036 -2.887 . . . . 24.93 118.533 -178.32 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.578 ' C ' ' H ' ' A' ' 103' ' ' GLU . . . -82.56 -36.08 26.59 Favored 'General case' 0 N--CA 1.486 1.353 0 O-C-N 127.169 2.793 . . . . 18.77 115.814 -177.273 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' CYS . . . . . . . . . . . . . 3.6 m -73.05 16.54 0.16 Allowed 'General case' 0 N--CA 1.485 1.306 0 CA-C-O 123.529 1.633 . . . . 22.7 107.459 178.369 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.578 ' H ' ' C ' ' A' ' 101' ' ' ALA . 29.1 tp10 . . . . . 0 C--O 1.256 1.423 0 CA-C-O 112.537 -3.601 . . . . 21.21 113.689 179.862 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' SO4 . . . . . 0.417 ' O1 ' ' HG3' ' A' ' 4' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' HEM . . . . . 0.67 ' O2A' ' HA ' ' A' ' 40' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' HOH . . . . . 0.464 ' O ' ' HB3' ' A' ' 47' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' HOH . . . . . 0.432 ' O ' ' HE3' ' A' ' 89' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' HOH . . . . . 0.741 ' O ' ' HD2' ' A' ' 27' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' HOH . . . . . 0.639 ' O ' HD11 ' A' ' 53' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' HOH . . . . . 0.448 ' O ' ' NE2' ' A' ' 42' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 158' ' ' HOH . . . . . 0.513 ' O ' ' HG3' ' A' ' 87' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 160' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 161' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 162' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 163' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 167' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 168' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 169' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 172' ' ' HOH . . . . . 0.697 ' O ' ' HG2' ' A' ' 72' ' ' M3L . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 175' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 182' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 184' ' ' HOH . . . . . 0.553 ' O ' ' HG2' ' A' ' 61' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 185' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 188' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 189' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 195' ' ' HOH . . . . . 0.494 ' O ' ' HA ' ' A' ' 19' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 196' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 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 ' 200' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 300' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_