data_1csu_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 1csu _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 . . . . . . . . . . . . . 34.8 p . . . . . 0 N--CA 1.483 1.219 0 N-CA-C 106.152 -1.796 . . . . 51.07 106.152 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' -4' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -155.43 20.51 0.41 Allowed 'General case' 0 C--N 1.308 -1.235 0 CA-C-O 125.156 2.408 . . . . 54.69 104.822 177.734 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 15.8 t80 -136.03 139.18 42.9 Favored 'General case' 0 C--O 1.252 1.197 0 C-N-CA 130.127 3.371 . . . . 44.65 106.995 -179.251 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 5.1 mtmm -135.84 137.35 41.42 Favored 'General case' 0 C--N 1.315 -0.913 0 O-C-N 126.53 2.394 . . . . 38.32 108.153 -179.457 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -56.59 151.52 13.51 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-O 125.367 2.508 . . . . 29.24 111.337 -179.092 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -127.97 -146.17 6.26 Favored Glycine 0 N--CA 1.433 -1.521 0 CA-C-N 111.125 -2.761 . . . . 26.0 108.4 179.302 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 29.9 t -98.54 113.97 26.21 Favored 'General case' 0 C--O 1.252 1.203 0 CA-C-N 111.727 -2.237 . . . . 22.85 109.938 -178.854 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -66.69 -34.21 77.35 Favored 'General case' 0 N--CA 1.484 1.227 0 O-C-N 127.317 2.886 . . . . 19.9 107.24 176.327 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.2 mttt -64.99 -46.55 80.98 Favored 'General case' 0 C--O 1.254 1.327 0 C-N-CA 119.082 -1.047 . . . . 27.63 109.808 179.702 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 7.6 tttp -61.24 -40.83 95.49 Favored 'General case' 0 C--O 1.254 1.318 0 CA-C-O 124.22 1.962 . . . . 27.49 111.015 179.623 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -63.04 -40.49 99.33 Favored Glycine 0 C--O 1.278 2.851 0 CA-C-O 115.404 -2.886 . . . . 15.67 109.839 179.567 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.91 -41.47 82.74 Favored 'General case' 0 N--CA 1.498 1.959 0 CA-C-N 119.412 1.606 . . . . 14.88 111.93 177.774 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . 0.309 27.0 p -79.61 -27.25 41.05 Favored 'General case' 0 C--O 1.24 0.604 0 O-C-N 120.41 -1.431 . . . . 18.28 110.804 -179.887 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 12.6 mt -66.77 -46.25 75.94 Favored 'General case' 0 CA--C 1.571 1.775 0 N-CA-C 104.405 -2.443 . . . . 20.96 104.405 174.201 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -53.95 -51.29 64.31 Favored 'General case' 0 N--CA 1.492 1.673 0 C-N-CA 117.943 -1.503 . . . . 15.76 110.708 -178.306 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 31.4 mtmt -57.59 -47.01 83.3 Favored 'General case' 0 C--O 1.257 1.475 0 C-N-CA 124.666 1.186 . . . . 35.01 111.309 -179.648 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 64.8 p -78.63 -24.02 45.5 Favored 'General case' 0 C--O 1.263 1.783 0 CA-C-O 116.267 -1.825 . . . . 20.45 113.808 179.882 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.0 mmm180 -119.24 -18.9 8.52 Favored 'General case' 0 C--O 1.285 2.962 0 N-CA-C 119.659 3.207 . . . . 42.98 119.659 -177.15 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 8.3 m -123.11 -23.62 4.89 Favored 'General case' 0 C--N 1.294 -1.818 0 CA-C-N 123.857 3.026 . . . . 12.2 117.283 -179.753 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 19.8 tp -58.39 -34.13 70.39 Favored 'General case' 0 CA--C 1.554 1.097 0 C-N-CA 127.469 2.307 . . . . 16.19 111.748 -174.586 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 37.8 tt0 -49.54 -38.0 29.12 Favored 'General case' 0 N--CA 1.489 1.48 1 O-C-N 130.904 5.128 . . . . 20.08 109.87 178.75 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 58.9 m -120.06 -4.5 10.06 Favored 'General case' 0 CA--C 1.48 -1.73 0 N-CA-C 118.556 2.799 . . . . 16.25 118.556 -177.783 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 94.7 m-70 -140.63 158.73 43.56 Favored 'General case' 0 C--N 1.308 -1.205 0 CA-C-O 125.547 2.594 . . . . 15.72 115.262 -177.404 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 33.4 p -122.83 156.15 35.15 Favored 'General case' 0 C--N 1.299 -1.606 0 C-N-CA 128.093 2.557 . . . . 14.56 104.237 177.198 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 16.1 m -121.81 -14.76 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 O-C-N 126.901 2.626 . . . . 15.78 114.834 -178.458 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 21.0 pm0 -74.9 143.23 43.88 Favored 'General case' 0 C--N 1.294 -1.843 0 CA-C-O 127.458 3.504 . . . . 33.28 114.32 -176.08 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.9 tptt -59.52 124.26 19.51 Favored 'General case' 0 N--CA 1.521 3.1 0 CA-C-N 112.302 -2.226 . . . . 31.33 107.092 176.411 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' GLY . . . . . 0.48 ' N ' ' O ' ' A' ' 133' ' ' HOH . . . 89.2 6.71 70.98 Favored Glycine 0 C--N 1.369 2.406 0 O-C-N 117.545 -3.222 . . . . 18.13 112.312 -178.559 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -86.81 148.97 22.02 Favored Glycine 0 CA--C 1.548 2.123 0 N-CA-C 103.976 -3.65 . . . . 19.42 103.976 177.963 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -86.36 160.73 9.71 Favored 'Trans proline' 0 C--N 1.321 -0.917 0 CA-C-O 128.641 3.517 . . . . 17.34 114.115 -179.322 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 30.1 m-70 -74.02 147.04 43.27 Favored 'General case' 0 C--O 1.261 1.677 0 N-CA-C 102.496 -3.15 . . . . 20.49 102.496 173.832 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 42.2 mtmt -128.27 -128.02 0.22 Allowed 'General case' 0 N--CA 1.504 2.249 0 CA-C-O 113.986 -2.911 . . . . 23.16 103.659 174.799 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 61.8 t -59.73 -47.59 90.7 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.777 0 CA-C-O 124.602 2.144 . . . . 14.54 109.055 174.03 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -106.71 162.8 13.53 Favored Glycine 0 N--CA 1.492 2.386 0 N-CA-C 107.12 -2.392 . . . . 15.95 107.12 179.465 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_endo -70.69 155.73 62.32 Favored 'Trans proline' 0 N--CA 1.488 1.149 0 O-C-N 122.296 0.629 . . . . 15.47 112.737 -177.663 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -63.56 140.92 58.92 Favored 'General case' 0 N--CA 1.514 2.763 0 N-CA-C 103.142 -2.91 . . . . 15.32 103.142 173.932 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 18.1 mt -98.46 7.28 46.38 Favored 'General case' 0 C--O 1.268 2.052 0 CA-C-O 115.238 -2.315 . . . . 16.81 115.076 -178.277 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 7.7 t60 -55.56 133.35 50.27 Favored 'General case' 0 N--CA 1.493 1.698 0 CA-C-N 121.289 1.858 . . . . 25.99 108.559 178.925 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 63.51 29.08 73.56 Favored Glycine 0 N--CA 1.41 -3.087 0 C-N-CA 126.211 1.862 . . . . 17.53 117.585 179.369 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 4.4 tp -68.42 -29.97 45.96 Favored 'Isoleucine or valine' 0 C--O 1.262 1.727 0 N-CA-C 114.437 1.273 . . . . 22.03 114.437 178.48 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . 0.29 94.4 m-85 -72.86 131.64 42.51 Favored 'General case' 0 N--CA 1.505 2.293 0 C-N-CA 115.842 -2.343 . . . . 29.05 109.414 -178.524 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 88.4 -9.09 76.85 Favored Glycine 0 C--O 1.254 1.359 0 O-C-N 126.614 2.446 . . . . 27.11 114.09 -179.177 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ARG . . . . . 0.512 ' NH2' ' O ' ' A' ' 168' ' ' HOH . 8.8 ttp180 -90.3 154.36 19.77 Favored 'General case' 0 C--N 1.297 -1.698 0 C-N-CA 125.078 1.351 . . . . 31.32 107.575 178.986 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 39.2 m80 -93.05 162.76 13.91 Favored 'General case' 0 CA--C 1.564 1.508 0 N-CA-C 103.229 -2.878 . . . . 24.43 103.229 176.816 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 66.8 p -65.22 147.67 53.04 Favored 'General case' 0 C--N 1.285 -2.208 0 O-C-N 128.409 3.568 . . . . 18.25 109.723 178.451 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 71.14 29.82 68.27 Favored Glycine 0 C--O 1.263 1.941 0 C-N-CA 126.512 2.006 . . . . 19.8 118.036 178.515 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 3.1 mm100 -115.26 7.23 15.17 Favored 'General case' 0 C--N 1.299 -1.61 0 CA-C-N 120.071 1.935 . . . . 36.66 115.719 -176.89 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.03 130.83 36.95 Favored 'General case' 0 N--CA 1.504 2.269 0 N-CA-C 104.485 -2.413 . . . . 18.89 104.485 177.419 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -84.68 154.95 22.18 Favored 'General case' 1 N--CA 1.541 4.083 1 C-N-CA 110.263 -4.575 . . . . 40.22 110.111 -179.343 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 78.4 13.42 83.27 Favored Glycine 0 N--CA 1.417 -2.621 0 CA-C-N 111.712 -2.495 . . . . 17.4 113.249 179.474 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 57.3 t80 -117.57 131.25 56.72 Favored 'General case' 0 C--N 1.329 -0.309 0 O-C-N 127.607 2.592 . . . . 17.74 111.165 178.686 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.1 t -97.0 96.72 8.68 Favored 'General case' 0 N--CA 1.496 1.851 1 CA-C-O 129.628 4.537 . . . . 21.43 111.926 179.111 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 67.8 m-85 -80.07 160.33 25.83 Favored 'General case' 0 C--N 1.357 0.913 0 O-C-N 118.252 -2.78 . . . . 19.85 108.751 -178.557 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 68.5 p -78.23 163.86 25.41 Favored 'General case' 0 C--N 1.3 -1.563 0 O-C-N 126.954 2.658 . . . . 18.86 106.769 177.109 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 87.4 m-20 -60.98 -39.32 89.14 Favored 'General case' 0 CA--C 1.559 1.314 0 O-C-N 127.05 2.719 . . . . 31.95 107.84 178.885 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -51.19 -53.47 34.6 Favored 'General case' 0 C--O 1.265 1.9 0 O-C-N 127.292 2.87 . . . . 23.26 115.475 -178.633 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 9.0 t-20 -56.25 -55.67 30.45 Favored 'General case' 0 N--CA 1.491 1.589 0 CA-C-O 123.637 1.684 . . . . 25.28 111.704 -178.94 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 14.7 mt -54.48 -38.7 42.31 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.032 0 N-CA-C 116.828 2.158 . . . . 26.19 116.828 -179.154 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 38.6 mtmt -84.25 -23.69 30.3 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 125.216 1.572 . . . . 34.16 112.808 -176.92 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' LYS . . . . . 0.432 ' CG ' ' CG2' ' A' ' 57' ' ' VAL . 8.9 tptt -64.89 -41.27 95.76 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 104.993 -2.225 . . . . 31.91 104.993 177.783 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 9.4 t-20 45.87 53.76 8.59 Favored 'General case' 0 C--N 1.277 -2.546 0 C-N-CA 129.797 3.239 . . . . 34.55 111.475 178.111 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' VAL . . . . . 0.432 ' CG2' ' CG ' ' A' ' 55' ' ' LYS . 15.0 t -67.9 139.92 20.02 Favored 'Isoleucine or valine' 0 C--O 1.25 1.126 0 CA-C-N 114.464 -1.244 . . . . 31.62 111.649 178.597 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . 0.294 2.9 tm? -97.4 121.5 39.37 Favored 'General case' 0 N--CA 1.493 1.682 0 N-CA-C 100.828 -3.767 . . . . 30.39 100.828 175.463 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 83.0 m95 -74.26 109.07 7.45 Favored 'General case' 0 C--N 1.311 -1.081 0 N-CA-C 114.835 1.42 . . . . 26.61 114.835 -177.277 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ASP . . . . . 0.405 ' OD1' ' N ' ' A' ' 63' ' ' ASN . 3.5 p30 -130.31 159.9 35.54 Favored 'General case' 0 N--CA 1.514 2.762 0 O-C-N 128.674 3.734 . . . . 42.08 104.636 177.585 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.76 -29.25 18.06 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 125.938 2.024 . . . . 34.87 112.986 179.059 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 -78.85 -38.85 36.86 Favored 'General case' 0 C--O 1.241 0.636 0 O-C-N 118.586 -2.571 . . . . 30.91 114.428 -178.559 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' ASN . . . . . 0.405 ' N ' ' OD1' ' A' ' 60' ' ' ASP . 0.6 OUTLIER -67.46 -47.58 69.68 Favored 'General case' 0 C--N 1.306 -1.316 1 CA-C-O 129.415 4.436 . . . . 38.21 108.855 179.698 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 49.0 tpp -54.06 -42.47 69.28 Favored 'General case' 0 CA--C 1.538 0.493 1 CA-C-N 106.593 -4.821 . . . . 28.12 107.068 178.198 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.7 t -64.47 -44.05 92.27 Favored 'General case' 0 C--O 1.257 1.459 0 N-CA-C 114.675 1.361 . . . . 20.24 114.675 179.769 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.86 -42.24 77.35 Favored 'General case' 0 C--O 1.205 -1.25 0 N-CA-C 105.984 -1.858 . . . . 41.11 105.984 -177.969 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 54.0 t80 -57.05 -55.13 38.7 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 128.889 3.868 . . . . 20.77 111.772 -179.458 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 98.5 mt -57.87 -23.65 53.98 Favored 'General case' 0 C--O 1.266 1.943 0 N-CA-C 116.506 2.039 . . . . 20.76 116.506 177.568 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 24.1 m -60.42 -44.3 95.89 Favored 'General case' 0 N--CA 1.44 -0.932 0 CA-C-N 120.021 1.282 . . . . 23.85 110.905 177.979 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -165.9 92.55 0.84 Allowed Pre-proline 0 C--N 1.311 -1.077 0 O-C-N 128.268 3.48 . . . . 28.61 112.455 -178.104 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -55.1 -49.87 15.04 Favored 'Trans proline' 0 CA--C 1.518 -0.294 0 CA-C-O 115.656 -1.893 . . . . 18.03 116.466 -175.646 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 C--N 1.32 -0.685 0 O-C-N 128.977 3.923 . . . . 28.74 113.463 -178.052 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 10.4 tptt -74.98 -38.88 61.55 Favored 'General case' 0 N--CA 1.479 0.994 0 O-C-N 126.528 2.393 . . . . 26.39 105.7 178.618 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 29.7 t80 -76.32 -40.32 51.76 Favored 'General case' 0 C--N 1.312 -1.04 0 C-N-CA 128.632 2.773 . . . . 31.04 112.579 179.293 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . 0.279 24.4 mt -129.81 81.18 69.9 Favored Pre-proline 0 N--CA 1.511 2.602 0 CA-C-O 125.933 2.778 . . . . 23.3 107.145 177.957 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -61.38 125.3 16.54 Favored 'Trans proline' 0 CA--C 1.551 1.357 0 N-CA-C 106.503 -2.153 . . . . 21.86 106.503 -178.238 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 101.87 -5.77 53.9 Favored Glycine 0 CA--C 1.532 1.111 0 O-C-N 126.397 2.311 . . . . 18.8 112.961 179.542 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 5.2 t -65.7 142.03 58.16 Favored 'General case' 0 N--CA 1.493 1.719 0 C-N-CA 118.817 -1.153 . . . . 18.48 109.218 178.905 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 48.9 pttt -87.56 8.5 24.82 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-O 117.056 -1.449 . . . . 20.36 112.098 178.466 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 9.3 ttt -75.83 110.17 10.05 Favored 'General case' 0 N--CA 1.51 2.553 0 N-CA-C 105.302 -2.11 . . . . 16.96 105.302 177.571 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -88.67 61.61 6.11 Favored 'General case' 0 C--N 1.315 -0.897 0 O-C-N 126.481 2.363 . . . . 23.2 113.562 -179.144 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 72.8 t80 -124.93 126.81 46.09 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 104.593 -2.373 . . . . 25.05 104.593 179.13 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -56.12 -60.85 8.2 Favored Glycine 0 C--O 1.265 2.059 1 O-C-N 129.231 4.082 . . . . 25.76 110.614 -178.299 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 144.81 164.95 10.87 Favored Glycine 0 N--CA 1.499 2.845 0 C-N-CA 116.339 -2.839 . . . . 22.24 107.555 -179.434 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' CYS . . . . . . . . . . . . . 1.6 m -116.71 95.97 5.28 Favored 'General case' 0 C--N 1.299 -1.616 0 CA-C-N 110.755 -2.722 . . . . 36.9 106.836 -178.52 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 36.0 mmtt -66.22 -39.07 89.34 Favored 'General case' 0 C--N 1.295 -1.77 0 O-C-N 127.457 2.973 . . . . 34.8 118.299 -177.078 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 25.1 mttp -86.2 127.14 34.69 Favored 'General case' 0 CA--C 1.495 -1.167 0 O-C-N 125.318 1.636 . . . . 37.26 111.731 -176.723 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -59.5 -36.57 76.32 Favored 'General case' 0 C--O 1.203 -1.382 0 O-C-N 126.86 2.6 . . . . 36.14 108.144 179.053 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 28.1 pttt -59.28 -48.45 81.58 Favored 'General case' 0 CA--C 1.563 1.463 0 CA-C-O 114.81 -2.519 . . . . 24.41 108.749 -178.872 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -59.15 -42.42 90.68 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 128.424 3.577 . . . . 19.06 113.418 178.86 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 68.3 mtm-85 -65.32 -42.17 93.27 Favored 'General case' 0 CA--C 1.551 1.008 0 CA-C-O 116.175 -1.869 . . . . 19.04 109.727 179.507 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 98.8 m-20 -60.94 -46.98 88.51 Favored 'General case' 0 N--CA 1.485 1.301 0 O-C-N 127.36 2.912 . . . . 22.53 109.785 -179.353 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 94.3 m-20 -59.84 -49.57 77.2 Favored 'General case' 0 CA--C 1.562 1.407 1 O-C-N 130.81 5.069 . . . . 16.7 109.998 178.939 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 34.6 tp -58.64 -48.34 81.36 Favored 'General case' 0 C--O 1.266 1.923 0 N-CA-C 114.692 1.367 . . . . 19.26 114.692 -177.341 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 96.7 mt -63.19 -33.9 63.67 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.346 0 C-N-CA 127.271 2.229 . . . . 15.77 112.816 179.245 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 32.1 m -64.37 -46.94 81.22 Favored 'General case' 0 C--O 1.246 0.91 0 CA-C-O 115.354 -2.26 . . . . 19.41 106.777 177.015 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 56.0 t80 -60.51 -51.13 70.75 Favored 'General case' 0 N--CA 1.435 -1.184 0 O-C-N 126.069 2.105 . . . . 18.81 109.032 177.634 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 25.5 mt -59.39 -48.25 82.36 Favored 'General case' 0 N--CA 1.495 1.789 0 CA-C-O 115.161 -2.352 . . . . 27.04 112.622 -179.223 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -52.2 -35.87 50.44 Favored 'General case' 0 N--CA 1.482 1.125 0 CA-C-O 124.817 2.246 . . . . 38.03 110.247 179.939 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 7.8 mmmt -84.48 -38.16 20.45 Favored 'General case' 0 C--O 1.25 1.113 0 CA-C-O 114.129 -2.844 . . . . 29.91 116.494 -179.738 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -87.28 -21.83 25.54 Favored 'General case' 0 C--O 1.251 1.173 0 CA-C-O 115.35 -2.262 . . . . 19.72 114.278 -177.056 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 26.9 p -89.28 -0.06 57.17 Favored 'General case' 0 C--N 1.283 -2.295 0 O-C-N 125.813 1.946 . . . . 23.66 113.123 178.866 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 . . . . . 0 C--O 1.265 1.917 0 CA-C-O 113.664 -3.065 . . . . 34.65 111.894 179.679 . . . . . . . . 0 0 . 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 ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' 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 ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' 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 ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' HOH . . . . . 0.48 ' O ' ' N ' ' A' ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' 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 ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' 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 ' 158' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 160' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 163' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 166' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 167' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 168' ' ' HOH . . . . . 0.512 ' O ' ' NH2' ' A' ' 38' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 170' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 172' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 174' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 175' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 177' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 180' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 181' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 182' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 183' ' ' 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 ' 191' ' ' 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 ' 199' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 252' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' -5' ' ' THR . . . . . 0.547 ' HB ' ' OD1' ' A' ' 62' ' ' ASN . 34.8 p . . . . . 0 N--CA 1.483 1.219 0 N-CA-C 106.152 -1.796 . . . . 51.07 106.152 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' -4' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -155.43 20.51 0.41 Allowed 'General case' 0 C--N 1.308 -1.235 0 CA-C-O 125.156 2.408 . . . . 54.69 104.822 177.734 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' -3' ' ' PHE . . . . . 0.52 ' HB3' ' ND2' ' A' ' 62' ' ' ASN . 15.8 t80 -136.03 139.18 42.9 Favored 'General case' 0 C--O 1.252 1.197 0 C-N-CA 130.127 3.371 . . . . 44.65 106.995 -179.251 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 5.1 mtmm -135.84 137.35 41.42 Favored 'General case' 0 C--N 1.315 -0.913 0 O-C-N 126.53 2.394 . . . . 38.32 108.153 -179.457 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -56.59 151.52 13.51 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-O 125.367 2.508 . . . . 29.24 111.337 -179.092 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -127.97 -146.17 6.26 Favored Glycine 0 N--CA 1.433 -1.521 0 CA-C-N 111.125 -2.761 . . . . 26.0 108.4 179.302 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 29.9 t -98.54 113.97 26.21 Favored 'General case' 0 C--O 1.252 1.203 0 CA-C-N 111.727 -2.237 . . . . 22.85 109.938 -178.854 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -66.69 -34.21 77.35 Favored 'General case' 0 N--CA 1.484 1.227 0 O-C-N 127.317 2.886 . . . . 19.9 107.24 176.327 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' LYS . . . . . 0.651 ' HG3' ' O1 ' ' A' ' 117' ' ' SO4 . 6.2 mttt -64.99 -46.55 80.98 Favored 'General case' 0 C--O 1.254 1.327 0 C-N-CA 119.082 -1.047 . . . . 27.63 109.808 179.702 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 5' ' ' LYS . . . . . 0.468 ' HE3' ' O ' ' A' ' 160' ' ' HOH . 7.6 tttp -61.24 -40.83 95.49 Favored 'General case' 0 C--O 1.254 1.318 0 CA-C-O 124.22 1.962 . . . . 27.49 111.015 179.623 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -63.04 -40.49 99.33 Favored Glycine 0 C--O 1.278 2.851 0 CA-C-O 115.404 -2.886 . . . . 15.67 109.839 179.567 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.91 -41.47 82.74 Favored 'General case' 0 N--CA 1.498 1.959 0 CA-C-N 119.412 1.606 . . . . 14.88 111.93 177.774 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . 0.309 27.0 p -79.61 -27.25 41.05 Favored 'General case' 0 C--O 1.24 0.604 0 O-C-N 120.41 -1.431 . . . . 18.28 110.804 -179.887 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 12.6 mt -66.77 -46.25 75.94 Favored 'General case' 0 CA--C 1.571 1.775 0 N-CA-C 104.405 -2.443 . . . . 20.96 104.405 174.201 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' PHE . . . . . 0.409 ' CZ ' HG13 ' A' ' 20' ' ' VAL . 41.6 t80 -53.95 -51.29 64.31 Favored 'General case' 0 N--CA 1.492 1.673 0 C-N-CA 117.943 -1.503 . . . . 15.76 110.708 -178.306 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 31.4 mtmt -57.59 -47.01 83.3 Favored 'General case' 0 C--O 1.257 1.475 0 C-N-CA 124.666 1.186 . . . . 35.01 111.309 -179.648 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 64.8 p -78.63 -24.02 45.5 Favored 'General case' 0 C--O 1.263 1.783 0 CA-C-O 116.267 -1.825 . . . . 20.45 113.808 179.882 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.0 mmm180 -119.24 -18.9 8.52 Favored 'General case' 0 C--O 1.285 2.962 0 N-CA-C 119.659 3.207 . . . . 42.98 119.659 -177.15 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 8.3 m -123.11 -23.62 4.89 Favored 'General case' 0 C--N 1.294 -1.818 0 CA-C-N 123.857 3.026 . . . . 12.2 117.283 -179.753 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 19.8 tp -58.39 -34.13 70.39 Favored 'General case' 0 CA--C 1.554 1.097 0 C-N-CA 127.469 2.307 . . . . 16.19 111.748 -174.586 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 37.8 tt0 -49.54 -38.0 29.12 Favored 'General case' 0 N--CA 1.489 1.48 1 O-C-N 130.904 5.128 . . . . 20.08 109.87 178.75 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 58.9 m -120.06 -4.5 10.06 Favored 'General case' 0 CA--C 1.48 -1.73 0 N-CA-C 118.556 2.799 . . . . 16.25 118.556 -177.783 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 94.7 m-70 -140.63 158.73 43.56 Favored 'General case' 0 C--N 1.308 -1.205 0 CA-C-O 125.547 2.594 . . . . 15.72 115.262 -177.404 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' THR . . . . . 0.455 ' HA ' ' O ' ' A' ' 195' ' ' HOH . 33.4 p -122.83 156.15 35.15 Favored 'General case' 0 C--N 1.299 -1.606 0 C-N-CA 128.093 2.557 . . . . 14.56 104.237 177.198 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 20' ' ' VAL . . . . . 0.409 HG13 ' CZ ' ' A' ' 10' ' ' PHE . 16.1 m -121.81 -14.76 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 O-C-N 126.901 2.626 . . . . 15.78 114.834 -178.458 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 21.0 pm0 -74.9 143.23 43.88 Favored 'General case' 0 C--N 1.294 -1.843 0 CA-C-O 127.458 3.504 . . . . 33.28 114.32 -176.08 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.9 tptt -59.52 124.26 19.51 Favored 'General case' 0 N--CA 1.521 3.1 0 CA-C-N 112.302 -2.226 . . . . 31.33 107.092 176.411 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 89.2 6.71 70.98 Favored Glycine 0 C--N 1.369 2.406 0 O-C-N 117.545 -3.222 . . . . 18.13 112.312 -178.559 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -86.81 148.97 22.02 Favored Glycine 0 CA--C 1.548 2.123 0 N-CA-C 103.976 -3.65 . . . . 19.42 103.976 177.963 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -86.36 160.73 9.71 Favored 'Trans proline' 0 C--N 1.321 -0.917 0 CA-C-O 128.641 3.517 . . . . 17.34 114.115 -179.322 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 30.1 m-70 -74.02 147.04 43.27 Favored 'General case' 0 C--O 1.261 1.677 0 N-CA-C 102.496 -3.15 . . . . 20.49 102.496 173.832 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 42.2 mtmt -128.27 -128.02 0.22 Allowed 'General case' 0 N--CA 1.504 2.249 0 CA-C-O 113.986 -2.911 . . . . 23.16 103.659 174.799 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 61.8 t -59.73 -47.59 90.7 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.777 0 CA-C-O 124.602 2.144 . . . . 14.54 109.055 174.03 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -106.71 162.8 13.53 Favored Glycine 0 N--CA 1.492 2.386 0 N-CA-C 107.12 -2.392 . . . . 15.95 107.12 179.465 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_endo -70.69 155.73 62.32 Favored 'Trans proline' 0 N--CA 1.488 1.149 0 O-C-N 122.296 0.629 . . . . 15.47 112.737 -177.663 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -63.56 140.92 58.92 Favored 'General case' 0 N--CA 1.514 2.763 0 N-CA-C 103.142 -2.91 . . . . 15.32 103.142 173.932 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 18.1 mt -98.46 7.28 46.38 Favored 'General case' 0 C--O 1.268 2.052 0 CA-C-O 115.238 -2.315 . . . . 16.81 115.076 -178.277 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 7.7 t60 -55.56 133.35 50.27 Favored 'General case' 0 N--CA 1.493 1.698 0 CA-C-N 121.289 1.858 . . . . 25.99 108.559 178.925 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 63.51 29.08 73.56 Favored Glycine 0 N--CA 1.41 -3.087 0 C-N-CA 126.211 1.862 . . . . 17.53 117.585 179.369 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 4.4 tp -68.42 -29.97 45.96 Favored 'Isoleucine or valine' 0 C--O 1.262 1.727 0 N-CA-C 114.437 1.273 . . . . 22.03 114.437 178.48 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . 0.29 94.4 m-85 -72.86 131.64 42.51 Favored 'General case' 0 N--CA 1.505 2.293 0 C-N-CA 115.842 -2.343 . . . . 29.05 109.414 -178.524 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 37' ' ' GLY . . . . . 0.584 ' O ' HD21 ' A' ' 58' ' ' LEU . . . 88.4 -9.09 76.85 Favored Glycine 0 C--O 1.254 1.359 0 O-C-N 126.614 2.446 . . . . 27.11 114.09 -179.177 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ARG . . . . . 0.432 ' NH2' ' O ' ' A' ' 168' ' ' HOH . 8.8 ttp180 -90.3 154.36 19.77 Favored 'General case' 0 C--N 1.297 -1.698 0 C-N-CA 125.078 1.351 . . . . 31.32 107.575 178.986 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 39' ' ' HIS . . . . . 0.513 ' CE1' HD23 ' A' ' 58' ' ' LEU . 39.2 m80 -93.05 162.76 13.91 Favored 'General case' 0 CA--C 1.564 1.508 0 N-CA-C 103.229 -2.878 . . . . 24.43 103.229 176.816 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 66.8 p -65.22 147.67 53.04 Favored 'General case' 0 C--N 1.285 -2.208 0 O-C-N 128.409 3.568 . . . . 18.25 109.723 178.451 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' GLY . . . . . 0.498 ' HA2' ' CZ ' ' A' ' 48' ' ' TYR . . . 71.14 29.82 68.27 Favored Glycine 0 C--O 1.263 1.941 0 C-N-CA 126.512 2.006 . . . . 19.8 118.036 178.515 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 36.4 mm-40 -115.26 7.23 15.17 Favored 'General case' 0 C--N 1.299 -1.61 0 CA-C-N 120.071 1.935 . . . . 36.66 115.719 -176.89 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.03 130.83 36.95 Favored 'General case' 0 N--CA 1.504 2.269 0 N-CA-C 104.485 -2.413 . . . . 18.89 104.485 177.419 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -84.68 154.95 22.18 Favored 'General case' 1 N--CA 1.541 4.083 1 C-N-CA 110.263 -4.575 . . . . 40.22 110.111 -179.343 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 78.4 13.42 83.27 Favored Glycine 0 N--CA 1.417 -2.621 0 CA-C-N 111.712 -2.495 . . . . 17.4 113.249 179.474 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 57.3 t80 -117.57 131.25 56.72 Favored 'General case' 0 C--N 1.329 -0.309 0 O-C-N 127.607 2.592 . . . . 17.74 111.165 178.686 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.1 t -97.0 96.72 8.68 Favored 'General case' 0 N--CA 1.496 1.851 1 CA-C-O 129.628 4.537 . . . . 21.43 111.926 179.111 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 48' ' ' TYR . . . . . 0.498 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 67.8 m-85 -80.07 160.33 25.83 Favored 'General case' 0 C--N 1.357 0.913 0 O-C-N 118.252 -2.78 . . . . 19.85 108.751 -178.557 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 49' ' ' THR . . . . . 0.462 HG23 ' HG2' ' A' ' 79' ' ' LYS . 68.5 p -78.23 163.86 25.41 Favored 'General case' 0 C--N 1.3 -1.563 0 O-C-N 126.954 2.658 . . . . 18.86 106.769 177.109 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 87.4 m-20 -60.98 -39.32 89.14 Favored 'General case' 0 CA--C 1.559 1.314 0 O-C-N 127.05 2.719 . . . . 31.95 107.84 178.885 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -51.19 -53.47 34.6 Favored 'General case' 0 C--O 1.265 1.9 0 O-C-N 127.292 2.87 . . . . 23.26 115.475 -178.633 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 9.0 t-20 -56.25 -55.67 30.45 Favored 'General case' 0 N--CA 1.491 1.589 0 CA-C-O 123.637 1.684 . . . . 25.28 111.704 -178.94 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 14.7 mt -54.48 -38.7 42.31 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.032 0 N-CA-C 116.828 2.158 . . . . 26.19 116.828 -179.154 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 38.6 mtmt -84.25 -23.69 30.3 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 125.216 1.572 . . . . 34.16 112.808 -176.92 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' LYS . . . . . 0.53 ' HD3' HG12 ' A' ' 75' ' ' ILE . 8.9 tptt -64.89 -41.27 95.76 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 104.993 -2.225 . . . . 31.91 104.993 177.783 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 60.3 t30 45.87 53.76 8.59 Favored 'General case' 0 C--N 1.277 -2.546 0 C-N-CA 129.797 3.239 . . . . 34.55 111.475 178.111 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' VAL . . . . . 0.432 ' CG2' ' CG ' ' A' ' 55' ' ' LYS . 15.0 t -67.9 139.92 20.02 Favored 'Isoleucine or valine' 0 C--O 1.25 1.126 0 CA-C-N 114.464 -1.244 . . . . 31.62 111.649 178.597 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 58' ' ' LEU . . . . . 0.584 HD21 ' O ' ' A' ' 37' ' ' GLY 0.294 2.9 tm? -97.4 121.5 39.37 Favored 'General case' 0 N--CA 1.493 1.682 0 N-CA-C 100.828 -3.767 . . . . 30.39 100.828 175.463 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 83.0 m95 -74.26 109.07 7.45 Favored 'General case' 0 C--N 1.311 -1.081 0 N-CA-C 114.835 1.42 . . . . 26.61 114.835 -177.277 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ASP . . . . . 0.524 ' HB3' ' O ' ' A' ' 124' ' ' HOH . 3.5 p30 -130.31 159.9 35.54 Favored 'General case' 0 N--CA 1.514 2.762 0 O-C-N 128.674 3.734 . . . . 42.08 104.636 177.585 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 61' ' ' GLU . . . . . 0.721 ' HG2' ' O ' ' A' ' 184' ' ' HOH . 0.0 OUTLIER -51.76 -29.25 18.06 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 125.938 2.024 . . . . 34.87 112.986 179.059 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 62' ' ' ASN . . . . . 0.547 ' OD1' ' HB ' ' A' ' -5' ' ' THR . 9.1 m120 -78.85 -38.85 36.86 Favored 'General case' 0 C--O 1.241 0.636 0 O-C-N 118.586 -2.571 . . . . 30.91 114.428 -178.559 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -67.46 -47.58 69.68 Favored 'General case' 0 C--N 1.306 -1.316 1 CA-C-O 129.415 4.436 . . . . 38.21 108.855 179.698 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 49.0 tpp -54.06 -42.47 69.28 Favored 'General case' 0 CA--C 1.538 0.493 1 CA-C-N 106.593 -4.821 . . . . 28.12 107.068 178.198 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.7 t -64.47 -44.05 92.27 Favored 'General case' 0 C--O 1.257 1.459 0 N-CA-C 114.675 1.361 . . . . 20.24 114.675 179.769 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.86 -42.24 77.35 Favored 'General case' 0 C--O 1.205 -1.25 0 N-CA-C 105.984 -1.858 . . . . 41.11 105.984 -177.969 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 54.0 t80 -57.05 -55.13 38.7 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 128.889 3.868 . . . . 20.77 111.772 -179.458 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 98.5 mt -57.87 -23.65 53.98 Favored 'General case' 0 C--O 1.266 1.943 0 N-CA-C 116.506 2.039 . . . . 20.76 116.506 177.568 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 24.1 m -60.42 -44.3 95.89 Favored 'General case' 0 N--CA 1.44 -0.932 0 CA-C-N 120.021 1.282 . . . . 23.85 110.905 177.979 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -165.9 92.55 0.84 Allowed Pre-proline 0 C--N 1.311 -1.077 0 O-C-N 128.268 3.48 . . . . 28.61 112.455 -178.104 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -55.1 -49.87 15.04 Favored 'Trans proline' 0 CA--C 1.518 -0.294 0 CA-C-O 115.656 -1.893 . . . . 18.03 116.466 -175.646 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' M3L . . . . . 0.414 HM13 ' HD2' ' A' ' 72' ' ' M3L . . . . . . . . 0 C--N 1.32 -0.685 0 O-C-N 128.977 3.923 . . . . 28.74 113.463 -178.052 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 10.4 tptt -74.98 -38.88 61.55 Favored 'General case' 0 N--CA 1.479 0.994 0 O-C-N 126.528 2.393 . . . . 26.39 105.7 178.618 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 29.7 t80 -76.32 -40.32 51.76 Favored 'General case' 0 C--N 1.312 -1.04 0 C-N-CA 128.632 2.773 . . . . 31.04 112.579 179.293 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ILE . . . . . 0.645 ' O ' HG22 ' A' ' 78' ' ' THR 0.279 24.4 mt -129.81 81.18 69.9 Favored Pre-proline 0 N--CA 1.511 2.602 0 CA-C-O 125.933 2.778 . . . . 23.3 107.145 177.957 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -61.38 125.3 16.54 Favored 'Trans proline' 0 CA--C 1.551 1.357 0 N-CA-C 106.503 -2.153 . . . . 21.86 106.503 -178.238 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 101.87 -5.77 53.9 Favored Glycine 0 CA--C 1.532 1.111 0 O-C-N 126.397 2.311 . . . . 18.8 112.961 179.542 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' THR . . . . . 0.645 HG22 ' O ' ' A' ' 75' ' ' ILE . 5.2 t -65.7 142.03 58.16 Favored 'General case' 0 N--CA 1.493 1.719 0 C-N-CA 118.817 -1.153 . . . . 18.48 109.218 178.905 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 79' ' ' LYS . . . . . 0.462 ' HG2' HG23 ' A' ' 49' ' ' THR . 48.9 pttt -87.56 8.5 24.82 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-O 117.056 -1.449 . . . . 20.36 112.098 178.466 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 9.3 ttt -75.83 110.17 10.05 Favored 'General case' 0 N--CA 1.51 2.553 0 N-CA-C 105.302 -2.11 . . . . 16.96 105.302 177.571 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -88.67 61.61 6.11 Favored 'General case' 0 C--N 1.315 -0.897 0 O-C-N 126.481 2.363 . . . . 23.2 113.562 -179.144 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 72.8 t80 -124.93 126.81 46.09 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 104.593 -2.373 . . . . 25.05 104.593 179.13 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -56.12 -60.85 8.2 Favored Glycine 0 C--O 1.265 2.059 1 O-C-N 129.231 4.082 . . . . 25.76 110.614 -178.299 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 144.81 164.95 10.87 Favored Glycine 0 N--CA 1.499 2.845 0 C-N-CA 116.339 -2.839 . . . . 22.24 107.555 -179.434 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' CYS . . . . . . . . . . . . . 1.6 m -116.71 95.97 5.28 Favored 'General case' 0 C--N 1.299 -1.616 0 CA-C-N 110.755 -2.722 . . . . 36.9 106.836 -178.52 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' LYS . . . . . 0.447 ' HA ' ' HD3' ' A' ' 86' ' ' LYS . 36.0 mmtt -66.22 -39.07 89.34 Favored 'General case' 0 C--N 1.295 -1.77 0 O-C-N 127.457 2.973 . . . . 34.8 118.299 -177.078 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 25.1 mttp -86.2 127.14 34.69 Favored 'General case' 0 CA--C 1.495 -1.167 0 O-C-N 125.318 1.636 . . . . 37.26 111.731 -176.723 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -59.5 -36.57 76.32 Favored 'General case' 0 C--O 1.203 -1.382 0 O-C-N 126.86 2.6 . . . . 36.14 108.144 179.053 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 28.1 pttt -59.28 -48.45 81.58 Favored 'General case' 0 CA--C 1.563 1.463 0 CA-C-O 114.81 -2.519 . . . . 24.41 108.749 -178.872 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -59.15 -42.42 90.68 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 128.424 3.577 . . . . 19.06 113.418 178.86 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 68.3 mtm-85 -65.32 -42.17 93.27 Favored 'General case' 0 CA--C 1.551 1.008 0 CA-C-O 116.175 -1.869 . . . . 19.04 109.727 179.507 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 98.8 m-20 -60.94 -46.98 88.51 Favored 'General case' 0 N--CA 1.485 1.301 0 O-C-N 127.36 2.912 . . . . 22.53 109.785 -179.353 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 94.3 m-20 -59.84 -49.57 77.2 Favored 'General case' 0 CA--C 1.562 1.407 1 O-C-N 130.81 5.069 . . . . 16.7 109.998 178.939 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 34.6 tp -58.64 -48.34 81.36 Favored 'General case' 0 C--O 1.266 1.923 0 N-CA-C 114.692 1.367 . . . . 19.26 114.692 -177.341 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 96.7 mt -63.19 -33.9 63.67 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.346 0 C-N-CA 127.271 2.229 . . . . 15.77 112.816 179.245 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 32.1 m -64.37 -46.94 81.22 Favored 'General case' 0 C--O 1.246 0.91 0 CA-C-O 115.354 -2.26 . . . . 19.41 106.777 177.015 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 56.0 t80 -60.51 -51.13 70.75 Favored 'General case' 0 N--CA 1.435 -1.184 0 O-C-N 126.069 2.105 . . . . 18.81 109.032 177.634 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 25.5 mt -59.39 -48.25 82.36 Favored 'General case' 0 N--CA 1.495 1.789 0 CA-C-O 115.161 -2.352 . . . . 27.04 112.622 -179.223 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -52.2 -35.87 50.44 Favored 'General case' 0 N--CA 1.482 1.125 0 CA-C-O 124.817 2.246 . . . . 38.03 110.247 179.939 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 7.8 mmmt -84.48 -38.16 20.45 Favored 'General case' 0 C--O 1.25 1.113 0 CA-C-O 114.129 -2.844 . . . . 29.91 116.494 -179.738 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -87.28 -21.83 25.54 Favored 'General case' 0 C--O 1.251 1.173 0 CA-C-O 115.35 -2.262 . . . . 19.72 114.278 -177.056 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 26.9 p -89.28 -0.06 57.17 Favored 'General case' 0 C--N 1.283 -2.295 0 O-C-N 125.813 1.946 . . . . 23.66 113.123 178.866 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 . . . . . 0 C--O 1.265 1.917 0 CA-C-O 113.664 -3.065 . . . . 34.65 111.894 179.679 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 117' ' ' SO4 . . . . . 0.651 ' O1 ' ' HG3' ' A' ' 4' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 108' ' ' 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 0 . 1 . 001 ecloud build full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 124' ' ' HOH . . . . . 0.524 ' O ' ' HB3' ' A' ' 60' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 138' ' ' 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 ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 148' ' ' 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 0 . 1 . 001 ecloud build full ' A' A ' 154' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 158' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 160' ' ' HOH . . . . . 0.468 ' O ' ' HE3' ' A' ' 5' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 163' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 166' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 167' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 168' ' ' HOH . . . . . 0.432 ' O ' ' NH2' ' A' ' 38' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 170' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 172' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 174' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 175' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 177' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 180' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 181' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 182' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 183' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 184' ' ' HOH . . . . . 0.721 ' 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 ' 191' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 195' ' ' HOH . . . . . 0.455 ' 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 ' 199' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 252' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' -5' ' ' THR . . . . . 0.86 ' HB ' HD21 ' A' ' 62' ' ' ASN . 34.8 p . . . . . 0 N--CA 1.483 1.219 0 N-CA-C 106.152 -1.796 . . . . 51.07 106.152 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' -4' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -155.43 20.51 0.41 Allowed 'General case' 0 C--N 1.308 -1.235 0 CA-C-O 125.156 2.408 . . . . 54.69 104.822 177.734 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 15.8 t80 -136.03 139.18 42.9 Favored 'General case' 0 C--O 1.252 1.197 0 C-N-CA 130.127 3.371 . . . . 44.65 106.995 -179.251 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 5.1 mtmm -135.84 137.35 41.42 Favored 'General case' 0 C--N 1.315 -0.913 0 O-C-N 126.53 2.394 . . . . 38.32 108.153 -179.457 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -56.59 151.52 13.51 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-O 125.367 2.508 . . . . 29.24 111.337 -179.092 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -127.97 -146.17 6.26 Favored Glycine 0 N--CA 1.433 -1.521 0 CA-C-N 111.125 -2.761 . . . . 26.0 108.4 179.302 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 29.9 t -98.54 113.97 26.21 Favored 'General case' 0 C--O 1.252 1.203 0 CA-C-N 111.727 -2.237 . . . . 22.85 109.938 -178.854 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -66.69 -34.21 77.35 Favored 'General case' 0 N--CA 1.484 1.227 0 O-C-N 127.317 2.886 . . . . 19.9 107.24 176.327 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.651 ' HG3' ' O1 ' ' A' ' 117' ' ' SO4 . 6.2 mttt -64.99 -46.55 80.98 Favored 'General case' 0 C--O 1.254 1.327 0 C-N-CA 119.082 -1.047 . . . . 27.63 109.808 179.702 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.468 ' HE3' ' O ' ' A' ' 160' ' ' HOH . 7.6 tttp -61.24 -40.83 95.49 Favored 'General case' 0 C--O 1.254 1.318 0 CA-C-O 124.22 1.962 . . . . 27.49 111.015 179.623 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -63.04 -40.49 99.33 Favored Glycine 0 C--O 1.278 2.851 0 CA-C-O 115.404 -2.886 . . . . 15.67 109.839 179.567 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.91 -41.47 82.74 Favored 'General case' 0 N--CA 1.498 1.959 0 CA-C-N 119.412 1.606 . . . . 14.88 111.93 177.774 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . 0.309 27.0 p -79.61 -27.25 41.05 Favored 'General case' 0 C--O 1.24 0.604 0 O-C-N 120.41 -1.431 . . . . 18.28 110.804 -179.887 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 12.6 mt -66.77 -46.25 75.94 Favored 'General case' 0 CA--C 1.571 1.775 0 N-CA-C 104.405 -2.443 . . . . 20.96 104.405 174.201 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.409 ' CZ ' HG13 ' A' ' 20' ' ' VAL . 41.6 t80 -53.95 -51.29 64.31 Favored 'General case' 0 N--CA 1.492 1.673 0 C-N-CA 117.943 -1.503 . . . . 15.76 110.708 -178.306 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 31.4 mtmt -57.59 -47.01 83.3 Favored 'General case' 0 C--O 1.257 1.475 0 C-N-CA 124.666 1.186 . . . . 35.01 111.309 -179.648 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 64.8 p -78.63 -24.02 45.5 Favored 'General case' 0 C--O 1.263 1.783 0 CA-C-O 116.267 -1.825 . . . . 20.45 113.808 179.882 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.0 mmm180 -119.24 -18.9 8.52 Favored 'General case' 0 C--O 1.285 2.962 0 N-CA-C 119.659 3.207 . . . . 42.98 119.659 -177.15 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 8.3 m -123.11 -23.62 4.89 Favored 'General case' 0 C--N 1.294 -1.818 0 CA-C-N 123.857 3.026 . . . . 12.2 117.283 -179.753 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 19.8 tp -58.39 -34.13 70.39 Favored 'General case' 0 CA--C 1.554 1.097 0 C-N-CA 127.469 2.307 . . . . 16.19 111.748 -174.586 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 37.8 tt0 -49.54 -38.0 29.12 Favored 'General case' 0 N--CA 1.489 1.48 1 O-C-N 130.904 5.128 . . . . 20.08 109.87 178.75 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 58.9 m -120.06 -4.5 10.06 Favored 'General case' 0 CA--C 1.48 -1.73 0 N-CA-C 118.556 2.799 . . . . 16.25 118.556 -177.783 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 94.7 m-70 -140.63 158.73 43.56 Favored 'General case' 0 C--N 1.308 -1.205 0 CA-C-O 125.547 2.594 . . . . 15.72 115.262 -177.404 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' THR . . . . . 0.455 ' HA ' ' O ' ' A' ' 195' ' ' HOH . 33.4 p -122.83 156.15 35.15 Favored 'General case' 0 C--N 1.299 -1.606 0 C-N-CA 128.093 2.557 . . . . 14.56 104.237 177.198 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.409 HG13 ' CZ ' ' A' ' 10' ' ' PHE . 16.1 m -121.81 -14.76 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 O-C-N 126.901 2.626 . . . . 15.78 114.834 -178.458 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 21.0 pm0 -74.9 143.23 43.88 Favored 'General case' 0 C--N 1.294 -1.843 0 CA-C-O 127.458 3.504 . . . . 33.28 114.32 -176.08 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.9 tptt -59.52 124.26 19.51 Favored 'General case' 0 N--CA 1.521 3.1 0 CA-C-N 112.302 -2.226 . . . . 31.33 107.092 176.411 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 89.2 6.71 70.98 Favored Glycine 0 C--N 1.369 2.406 0 O-C-N 117.545 -3.222 . . . . 18.13 112.312 -178.559 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -86.81 148.97 22.02 Favored Glycine 0 CA--C 1.548 2.123 0 N-CA-C 103.976 -3.65 . . . . 19.42 103.976 177.963 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -86.36 160.73 9.71 Favored 'Trans proline' 0 C--N 1.321 -0.917 0 CA-C-O 128.641 3.517 . . . . 17.34 114.115 -179.322 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 30.1 m-70 -74.02 147.04 43.27 Favored 'General case' 0 C--O 1.261 1.677 0 N-CA-C 102.496 -3.15 . . . . 20.49 102.496 173.832 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 42.2 mtmt -128.27 -128.02 0.22 Allowed 'General case' 0 N--CA 1.504 2.249 0 CA-C-O 113.986 -2.911 . . . . 23.16 103.659 174.799 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 61.8 t -59.73 -47.59 90.7 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.777 0 CA-C-O 124.602 2.144 . . . . 14.54 109.055 174.03 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -106.71 162.8 13.53 Favored Glycine 0 N--CA 1.492 2.386 0 N-CA-C 107.12 -2.392 . . . . 15.95 107.12 179.465 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_endo -70.69 155.73 62.32 Favored 'Trans proline' 0 N--CA 1.488 1.149 0 O-C-N 122.296 0.629 . . . . 15.47 112.737 -177.663 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -63.56 140.92 58.92 Favored 'General case' 0 N--CA 1.514 2.763 0 N-CA-C 103.142 -2.91 . . . . 15.32 103.142 173.932 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 18.1 mt -98.46 7.28 46.38 Favored 'General case' 0 C--O 1.268 2.052 0 CA-C-O 115.238 -2.315 . . . . 16.81 115.076 -178.277 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 7.7 t60 -55.56 133.35 50.27 Favored 'General case' 0 N--CA 1.493 1.698 0 CA-C-N 121.289 1.858 . . . . 25.99 108.559 178.925 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 63.51 29.08 73.56 Favored Glycine 0 N--CA 1.41 -3.087 0 C-N-CA 126.211 1.862 . . . . 17.53 117.585 179.369 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 4.4 tp -68.42 -29.97 45.96 Favored 'Isoleucine or valine' 0 C--O 1.262 1.727 0 N-CA-C 114.437 1.273 . . . . 22.03 114.437 178.48 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . 0.29 94.4 m-85 -72.86 131.64 42.51 Favored 'General case' 0 N--CA 1.505 2.293 0 C-N-CA 115.842 -2.343 . . . . 29.05 109.414 -178.524 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.584 ' O ' HD21 ' A' ' 58' ' ' LEU . . . 88.4 -9.09 76.85 Favored Glycine 0 C--O 1.254 1.359 0 O-C-N 126.614 2.446 . . . . 27.11 114.09 -179.177 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.432 ' NH2' ' O ' ' A' ' 168' ' ' HOH . 8.8 ttp180 -90.3 154.36 19.77 Favored 'General case' 0 C--N 1.297 -1.698 0 C-N-CA 125.078 1.351 . . . . 31.32 107.575 178.986 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' HIS . . . . . 0.513 ' CE1' HD23 ' A' ' 58' ' ' LEU . 39.2 m80 -93.05 162.76 13.91 Favored 'General case' 0 CA--C 1.564 1.508 0 N-CA-C 103.229 -2.878 . . . . 24.43 103.229 176.816 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 66.8 p -65.22 147.67 53.04 Favored 'General case' 0 C--N 1.285 -2.208 0 O-C-N 128.409 3.568 . . . . 18.25 109.723 178.451 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.498 ' HA2' ' CZ ' ' A' ' 48' ' ' TYR . . . 71.14 29.82 68.27 Favored Glycine 0 C--O 1.263 1.941 0 C-N-CA 126.512 2.006 . . . . 19.8 118.036 178.515 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 3.1 mm100 -115.26 7.23 15.17 Favored 'General case' 0 C--N 1.299 -1.61 0 CA-C-N 120.071 1.935 . . . . 36.66 115.719 -176.89 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.03 130.83 36.95 Favored 'General case' 0 N--CA 1.504 2.269 0 N-CA-C 104.485 -2.413 . . . . 18.89 104.485 177.419 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -84.68 154.95 22.18 Favored 'General case' 1 N--CA 1.541 4.083 1 C-N-CA 110.263 -4.575 . . . . 40.22 110.111 -179.343 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 78.4 13.42 83.27 Favored Glycine 0 N--CA 1.417 -2.621 0 CA-C-N 111.712 -2.495 . . . . 17.4 113.249 179.474 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 57.3 t80 -117.57 131.25 56.72 Favored 'General case' 0 C--N 1.329 -0.309 0 O-C-N 127.607 2.592 . . . . 17.74 111.165 178.686 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.1 t -97.0 96.72 8.68 Favored 'General case' 0 N--CA 1.496 1.851 1 CA-C-O 129.628 4.537 . . . . 21.43 111.926 179.111 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.498 ' CZ ' ' HA2' ' A' ' 41' ' ' GLY . 67.8 m-85 -80.07 160.33 25.83 Favored 'General case' 0 C--N 1.357 0.913 0 O-C-N 118.252 -2.78 . . . . 19.85 108.751 -178.557 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' THR . . . . . 0.462 HG23 ' HG2' ' A' ' 79' ' ' LYS . 68.5 p -78.23 163.86 25.41 Favored 'General case' 0 C--N 1.3 -1.563 0 O-C-N 126.954 2.658 . . . . 18.86 106.769 177.109 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 87.4 m-20 -60.98 -39.32 89.14 Favored 'General case' 0 CA--C 1.559 1.314 0 O-C-N 127.05 2.719 . . . . 31.95 107.84 178.885 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -51.19 -53.47 34.6 Favored 'General case' 0 C--O 1.265 1.9 0 O-C-N 127.292 2.87 . . . . 23.26 115.475 -178.633 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 9.0 t-20 -56.25 -55.67 30.45 Favored 'General case' 0 N--CA 1.491 1.589 0 CA-C-O 123.637 1.684 . . . . 25.28 111.704 -178.94 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 14.7 mt -54.48 -38.7 42.31 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.032 0 N-CA-C 116.828 2.158 . . . . 26.19 116.828 -179.154 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 38.6 mtmt -84.25 -23.69 30.3 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 125.216 1.572 . . . . 34.16 112.808 -176.92 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.53 ' HD3' HG12 ' A' ' 75' ' ' ILE . 8.9 tptt -64.89 -41.27 95.76 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 104.993 -2.225 . . . . 31.91 104.993 177.783 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 9.4 t-20 45.87 53.76 8.59 Favored 'General case' 0 C--N 1.277 -2.546 0 C-N-CA 129.797 3.239 . . . . 34.55 111.475 178.111 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.432 ' CG2' ' CG ' ' A' ' 55' ' ' LYS . 15.0 t -67.9 139.92 20.02 Favored 'Isoleucine or valine' 0 C--O 1.25 1.126 0 CA-C-N 114.464 -1.244 . . . . 31.62 111.649 178.597 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.584 HD21 ' O ' ' A' ' 37' ' ' GLY 0.294 2.9 tm? -97.4 121.5 39.37 Favored 'General case' 0 N--CA 1.493 1.682 0 N-CA-C 100.828 -3.767 . . . . 30.39 100.828 175.463 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 83.0 m95 -74.26 109.07 7.45 Favored 'General case' 0 C--N 1.311 -1.081 0 N-CA-C 114.835 1.42 . . . . 26.61 114.835 -177.277 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.524 ' HB3' ' O ' ' A' ' 124' ' ' HOH . 3.5 p30 -130.31 159.9 35.54 Favored 'General case' 0 N--CA 1.514 2.762 0 O-C-N 128.674 3.734 . . . . 42.08 104.636 177.585 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.721 ' HG2' ' O ' ' A' ' 184' ' ' HOH . 0.0 OUTLIER -51.76 -29.25 18.06 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 125.938 2.024 . . . . 34.87 112.986 179.059 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.86 HD21 ' HB ' ' A' ' -5' ' ' THR . 75.9 m-20 -78.85 -38.85 36.86 Favored 'General case' 0 C--O 1.241 0.636 0 O-C-N 118.586 -2.571 . . . . 30.91 114.428 -178.559 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -67.46 -47.58 69.68 Favored 'General case' 0 C--N 1.306 -1.316 1 CA-C-O 129.415 4.436 . . . . 38.21 108.855 179.698 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 49.0 tpp -54.06 -42.47 69.28 Favored 'General case' 0 CA--C 1.538 0.493 1 CA-C-N 106.593 -4.821 . . . . 28.12 107.068 178.198 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.7 t -64.47 -44.05 92.27 Favored 'General case' 0 C--O 1.257 1.459 0 N-CA-C 114.675 1.361 . . . . 20.24 114.675 179.769 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.86 -42.24 77.35 Favored 'General case' 0 C--O 1.205 -1.25 0 N-CA-C 105.984 -1.858 . . . . 41.11 105.984 -177.969 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 54.0 t80 -57.05 -55.13 38.7 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 128.889 3.868 . . . . 20.77 111.772 -179.458 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 98.5 mt -57.87 -23.65 53.98 Favored 'General case' 0 C--O 1.266 1.943 0 N-CA-C 116.506 2.039 . . . . 20.76 116.506 177.568 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 24.1 m -60.42 -44.3 95.89 Favored 'General case' 0 N--CA 1.44 -0.932 0 CA-C-N 120.021 1.282 . . . . 23.85 110.905 177.979 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -165.9 92.55 0.84 Allowed Pre-proline 0 C--N 1.311 -1.077 0 O-C-N 128.268 3.48 . . . . 28.61 112.455 -178.104 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -55.1 -49.87 15.04 Favored 'Trans proline' 0 CA--C 1.518 -0.294 0 CA-C-O 115.656 -1.893 . . . . 18.03 116.466 -175.646 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' M3L . . . . . 0.414 HM13 ' HD2' ' A' ' 72' ' ' M3L . . . . . . . . 0 C--N 1.32 -0.685 0 O-C-N 128.977 3.923 . . . . 28.74 113.463 -178.052 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 10.4 tptt -74.98 -38.88 61.55 Favored 'General case' 0 N--CA 1.479 0.994 0 O-C-N 126.528 2.393 . . . . 26.39 105.7 178.618 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 29.7 t80 -76.32 -40.32 51.76 Favored 'General case' 0 C--N 1.312 -1.04 0 C-N-CA 128.632 2.773 . . . . 31.04 112.579 179.293 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.645 ' O ' HG22 ' A' ' 78' ' ' THR 0.279 24.4 mt -129.81 81.18 69.9 Favored Pre-proline 0 N--CA 1.511 2.602 0 CA-C-O 125.933 2.778 . . . . 23.3 107.145 177.957 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -61.38 125.3 16.54 Favored 'Trans proline' 0 CA--C 1.551 1.357 0 N-CA-C 106.503 -2.153 . . . . 21.86 106.503 -178.238 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 101.87 -5.77 53.9 Favored Glycine 0 CA--C 1.532 1.111 0 O-C-N 126.397 2.311 . . . . 18.8 112.961 179.542 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' THR . . . . . 0.645 HG22 ' O ' ' A' ' 75' ' ' ILE . 5.2 t -65.7 142.03 58.16 Favored 'General case' 0 N--CA 1.493 1.719 0 C-N-CA 118.817 -1.153 . . . . 18.48 109.218 178.905 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.462 ' HG2' HG23 ' A' ' 49' ' ' THR . 48.9 pttt -87.56 8.5 24.82 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-O 117.056 -1.449 . . . . 20.36 112.098 178.466 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 9.3 ttt -75.83 110.17 10.05 Favored 'General case' 0 N--CA 1.51 2.553 0 N-CA-C 105.302 -2.11 . . . . 16.96 105.302 177.571 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -88.67 61.61 6.11 Favored 'General case' 0 C--N 1.315 -0.897 0 O-C-N 126.481 2.363 . . . . 23.2 113.562 -179.144 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 72.8 t80 -124.93 126.81 46.09 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 104.593 -2.373 . . . . 25.05 104.593 179.13 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -56.12 -60.85 8.2 Favored Glycine 0 C--O 1.265 2.059 1 O-C-N 129.231 4.082 . . . . 25.76 110.614 -178.299 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 144.81 164.95 10.87 Favored Glycine 0 N--CA 1.499 2.845 0 C-N-CA 116.339 -2.839 . . . . 22.24 107.555 -179.434 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' CYS . . . . . . . . . . . . . 1.6 m -116.71 95.97 5.28 Favored 'General case' 0 C--N 1.299 -1.616 0 CA-C-N 110.755 -2.722 . . . . 36.9 106.836 -178.52 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.447 ' HA ' ' HD3' ' A' ' 86' ' ' LYS . 36.0 mmtt -66.22 -39.07 89.34 Favored 'General case' 0 C--N 1.295 -1.77 0 O-C-N 127.457 2.973 . . . . 34.8 118.299 -177.078 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 25.1 mttp -86.2 127.14 34.69 Favored 'General case' 0 CA--C 1.495 -1.167 0 O-C-N 125.318 1.636 . . . . 37.26 111.731 -176.723 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -59.5 -36.57 76.32 Favored 'General case' 0 C--O 1.203 -1.382 0 O-C-N 126.86 2.6 . . . . 36.14 108.144 179.053 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 28.1 pttt -59.28 -48.45 81.58 Favored 'General case' 0 CA--C 1.563 1.463 0 CA-C-O 114.81 -2.519 . . . . 24.41 108.749 -178.872 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -59.15 -42.42 90.68 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 128.424 3.577 . . . . 19.06 113.418 178.86 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 68.3 mtm-85 -65.32 -42.17 93.27 Favored 'General case' 0 CA--C 1.551 1.008 0 CA-C-O 116.175 -1.869 . . . . 19.04 109.727 179.507 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 98.8 m-20 -60.94 -46.98 88.51 Favored 'General case' 0 N--CA 1.485 1.301 0 O-C-N 127.36 2.912 . . . . 22.53 109.785 -179.353 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 94.3 m-20 -59.84 -49.57 77.2 Favored 'General case' 0 CA--C 1.562 1.407 1 O-C-N 130.81 5.069 . . . . 16.7 109.998 178.939 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 34.6 tp -58.64 -48.34 81.36 Favored 'General case' 0 C--O 1.266 1.923 0 N-CA-C 114.692 1.367 . . . . 19.26 114.692 -177.341 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 96.7 mt -63.19 -33.9 63.67 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.346 0 C-N-CA 127.271 2.229 . . . . 15.77 112.816 179.245 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 32.1 m -64.37 -46.94 81.22 Favored 'General case' 0 C--O 1.246 0.91 0 CA-C-O 115.354 -2.26 . . . . 19.41 106.777 177.015 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 56.0 t80 -60.51 -51.13 70.75 Favored 'General case' 0 N--CA 1.435 -1.184 0 O-C-N 126.069 2.105 . . . . 18.81 109.032 177.634 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 25.5 mt -59.39 -48.25 82.36 Favored 'General case' 0 N--CA 1.495 1.789 0 CA-C-O 115.161 -2.352 . . . . 27.04 112.622 -179.223 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -52.2 -35.87 50.44 Favored 'General case' 0 N--CA 1.482 1.125 0 CA-C-O 124.817 2.246 . . . . 38.03 110.247 179.939 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 7.8 mmmt -84.48 -38.16 20.45 Favored 'General case' 0 C--O 1.25 1.113 0 CA-C-O 114.129 -2.844 . . . . 29.91 116.494 -179.738 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -87.28 -21.83 25.54 Favored 'General case' 0 C--O 1.251 1.173 0 CA-C-O 115.35 -2.262 . . . . 19.72 114.278 -177.056 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 26.9 p -89.28 -0.06 57.17 Favored 'General case' 0 C--N 1.283 -2.295 0 O-C-N 125.813 1.946 . . . . 23.66 113.123 178.866 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 . . . . . 0 C--O 1.265 1.917 0 CA-C-O 113.664 -3.065 . . . . 34.65 111.894 179.679 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' SO4 . . . . . 0.651 ' O1 ' ' HG3' ' A' ' 4' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' 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 0 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' HOH . . . . . 0.524 ' O ' ' HB3' ' A' ' 60' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' 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 ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' 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 0 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 158' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 160' ' ' HOH . . . . . 0.468 ' O ' ' HE3' ' A' ' 5' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 163' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 166' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 167' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 168' ' ' HOH . . . . . 0.432 ' O ' ' NH2' ' A' ' 38' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 170' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 172' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 174' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 175' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 177' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 180' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 181' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 182' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 183' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 184' ' ' HOH . . . . . 0.721 ' 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 ' 191' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 195' ' ' HOH . . . . . 0.455 ' 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 ' 199' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 252' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_