data_2che_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 2che _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.687 0 N-CA-C 110.673 -0.121 . . . . 27.7 110.673 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 50.0 t0 -58.78 124.98 21.6 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-O 112.745 -3.502 . . . . 25.06 109.143 174.969 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 4.2 tptt -61.87 -16.65 52.11 Favored 'General case' 0 C--N 1.298 -1.666 0 CA-C-N 122.259 2.299 . . . . 24.97 112.676 175.763 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 69.2 mm-40 -92.27 7.67 41.68 Favored 'General case' 0 C--O 1.256 1.445 0 N-CA-C 113.566 0.95 . . . . 17.04 113.566 178.443 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 8.1 tp -52.41 130.33 31.04 Favored 'General case' 0 C--O 1.259 1.573 0 N-CA-C 108.887 -0.783 . . . . 14.85 108.887 174.504 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 34.1 ttpt -84.87 116.64 23.43 Favored 'General case' 0 C--N 1.302 -1.477 0 C-N-CA 125.536 1.534 . . . . 19.44 110.071 179.506 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -98.34 143.2 29.07 Favored 'General case' 0 C--N 1.309 -1.163 0 C-N-CA 126.58 1.952 . . . . 10.37 112.641 179.059 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 60.1 tp -117.34 117.97 30.96 Favored 'General case' 0 C--N 1.354 0.762 0 O-C-N 127.583 3.052 . . . . 7.68 104.167 173.954 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 71.4 t -103.04 121.42 54.21 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.986 0 O-C-N 126.697 2.498 . . . . 7.83 109.211 174.734 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 3.0 t -114.54 117.21 54.89 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.306 0 CA-C-O 115.253 -2.308 . . . . 7.39 112.634 -175.863 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -163.9 144.84 8.7 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 127.907 3.254 . . . . 13.63 104.275 179.541 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 13.1 p-10 -81.86 -3.65 54.59 Favored 'General case' 0 C--O 1.254 1.314 0 O-C-N 128.336 3.522 . . . . 15.55 109.253 178.025 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . 0.26 81.1 m-85 -107.78 119.13 38.58 Favored 'General case' 0 N--CA 1.502 2.155 0 C-N-CA 117.602 -1.639 . . . . 17.06 108.372 176.738 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' SER . . . . . 0.552 ' O ' ' CD ' ' A' ' 19' ' ' ARG . 0.1 OUTLIER -53.45 -44.33 68.8 Favored 'General case' 0 C--N 1.297 -1.696 0 CA-C-N 113.657 -1.61 . . . . 18.49 113.033 178.926 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 23.9 m -63.48 -37.42 87.22 Favored 'General case' 0 C--O 1.252 1.221 0 O-C-N 126.285 2.241 . . . . 13.06 112.84 178.961 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 12.9 tpp -70.52 -35.82 73.38 Favored 'General case' 0 N--CA 1.469 0.509 0 O-C-N 125.315 1.634 . . . . 17.41 109.56 177.078 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ARG . . . . . 0.596 ' NH2' ' NH2' ' A' ' 19' ' ' ARG . 87.4 mtm-85 -63.22 -44.44 95.26 Favored 'General case' 0 N--CA 1.498 1.958 0 CA-C-O 121.3 0.571 . . . . 10.26 111.408 174.796 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ARG . . . . . 0.728 ' NH2' ' OE1' ' A' ' 35' ' ' GLU . 0.0 OUTLIER -61.03 -41.01 95.76 Favored 'General case' 0 C--O 1.253 1.285 0 CA-C-N 114.448 -1.251 . . . . 28.48 111.877 177.696 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 93.9 mt -59.81 -48.63 86.92 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 CA-C-N 119.237 0.926 . . . . 10.24 112.24 177.125 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 51.2 t -63.05 -44.52 99.63 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.218 0 CA-C-N 115.493 -0.776 . . . . 8.14 111.901 -178.413 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -59.5 -41.43 89.89 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 127.428 2.955 . . . . 19.48 110.875 176.389 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ASN . . . . . 0.555 ' CB ' ' O ' ' A' ' 204' ' ' HOH 0.26 20.1 t-20 -67.53 -40.81 85.04 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-O 115.928 -1.987 . . . . 17.24 112.619 -179.761 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.74 -49.16 78.81 Favored 'General case' 0 C--N 1.283 -2.326 0 O-C-N 127.323 2.889 . . . . 12.37 112.054 172.456 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.9 -44.88 91.3 Favored 'General case' 0 C--O 1.198 -1.624 0 O-C-N 124.691 1.244 . . . . 10.46 111.507 178.533 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' LYS . . . . . 0.757 ' CE ' ' O ' ' A' ' 167' ' ' HOH . 0.0 OUTLIER -51.83 -46.82 64.48 Favored 'General case' 0 N--CA 1.504 2.244 0 CA-C-O 126.449 3.024 . . . . 16.43 109.849 179.858 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 67.6 tt0 -59.19 -29.78 67.72 Favored 'General case' 0 C--O 1.284 2.893 0 CA-C-N 113.207 -1.815 . . . . 17.05 112.368 -179.589 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -89.26 -11.59 43.12 Favored 'General case' 0 C--N 1.305 -1.349 0 C-N-CA 126.801 2.04 . . . . 12.62 110.571 -179.202 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 100.12 12.46 39.45 Favored Glycine 0 C--O 1.203 -1.784 0 CA-C-O 117.291 -1.838 . . . . 9.44 114.09 179.922 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -104.55 99.44 9.12 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 115.539 -2.172 . . . . 11.19 105.357 -178.968 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 53.1 m-80 -97.49 -8.13 29.92 Favored 'General case' 0 N--CA 1.452 -0.345 1 O-C-N 129.113 4.008 . . . . 13.09 114.738 -177.073 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . 0.354 0.3 OUTLIER -89.19 79.39 7.15 Favored 'General case' 0 C--N 1.268 -2.961 1 CA-C-O 109.979 -4.82 . . . . 21.27 113.82 -175.603 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 84.9 t -128.05 138.55 54.38 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.128 1 O-C-N 134.354 7.284 . . . . 13.72 111.356 -173.271 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -121.04 160.04 24.43 Favored 'General case' 0 C--O 1.263 1.764 0 N-CA-C 104.697 -2.335 . . . . 27.71 104.697 172.86 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' GLU . . . . . 0.728 ' OE1' ' NH2' ' A' ' 19' ' ' ARG . 58.9 mt-10 -127.41 152.22 47.8 Favored 'General case' 0 C--N 1.297 -1.7 0 O-C-N 125.459 1.724 . . . . 15.47 112.14 -174.693 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -149.16 149.26 30.72 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 104.887 -2.264 . . . . 9.94 104.887 179.508 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 76.5 mt-10 -88.77 -24.7 22.58 Favored 'General case' 0 N--CA 1.426 -1.662 0 O-C-N 127.078 2.736 . . . . 24.7 118.369 -173.337 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 20.0 p30 -165.28 178.86 6.61 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-O 116.76 -1.591 . . . . 13.93 108.259 -178.553 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -57.04 -44.2 93.02 Favored Glycine 0 N--CA 1.429 -1.817 0 O-C-N 124.844 1.34 . . . . 9.55 115.551 -178.444 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . 0.362 2.0 m -70.65 -38.39 73.04 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 C-N-CA 118.22 -1.392 . . . . 13.93 111.62 -177.482 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -58.56 -45.78 88.26 Favored 'General case' 0 N--CA 1.45 -0.454 0 O-C-N 120.234 -1.541 . . . . 12.21 108.418 175.51 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -59.3 -45.12 92.16 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 114.758 1.392 . . . . 9.54 114.758 178.108 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 77.0 mt -62.99 -35.12 79.15 Favored 'General case' 0 C--O 1.252 1.202 0 C-N-CA 125.42 1.488 . . . . 13.05 112.151 179.592 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -62.16 -47.68 83.44 Favored 'General case' 0 C--N 1.31 -1.146 0 O-C-N 125.24 1.588 . . . . 18.14 108.078 177.498 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 4.6 mmtt -70.39 -39.31 74.61 Favored 'General case' 0 CA--C 1.507 -0.705 0 CA-C-O 116.422 -1.751 . . . . 23.72 110.026 -178.348 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 44.9 mt -65.14 -15.63 62.62 Favored 'General case' 0 C--N 1.306 -1.323 0 O-C-N 124.334 1.021 . . . . 21.12 112.013 -175.499 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.4 mm100 -65.97 -39.56 90.49 Favored 'General case' 0 C--N 1.298 -1.643 0 C-N-CA 126.633 1.973 . . . . 29.07 111.435 -179.027 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.43 -15.33 62.5 Favored 'General case' 0 C--O 1.246 0.906 0 O-C-N 127.143 2.777 . . . . 26.63 112.241 179.117 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 76.1 -179.8 47.26 Favored Glycine 0 C--N 1.311 -0.85 0 O-C-N 119.561 -1.962 . . . . 23.39 117.325 177.68 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 73.13 9.48 76.64 Favored Glycine 0 N--CA 1.434 -1.494 0 C-N-CA 129.512 3.434 . . . . 18.46 116.854 179.443 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 60.4 m-85 -70.64 146.85 49.74 Favored 'General case' 0 C--O 1.262 1.726 0 CA-C-N 118.966 1.383 . . . . 14.25 110.563 176.111 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -115.91 -15.85 7.13 Favored Glycine 0 C--O 1.21 -1.373 0 N-CA-C 117.884 1.914 . . . . 10.84 117.884 177.784 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -166.76 136.68 3.07 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 108.358 -0.979 . . . . 9.56 108.358 -169.416 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.7 mt -120.64 135.21 61.58 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.136 0 N-CA-C 106.845 -1.539 . . . . 10.15 106.845 -178.973 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 92.9 mt -117.56 111.89 36.54 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.166 0 O-C-N 128.198 3.436 . . . . 7.44 104.142 172.791 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 32.1 t -123.59 141.41 52.03 Favored 'General case' 0 C--O 1.196 -1.726 0 O-C-N 125.032 1.458 . . . . 10.88 113.156 -175.593 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -77.22 143.92 38.63 Favored 'General case' 0 N--CA 1.485 1.319 0 N-CA-C 105.896 -1.89 . . . . 13.94 105.896 176.519 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 69.1 t-105 -70.39 -47.56 60.3 Favored 'General case' 0 C--N 1.294 -1.842 0 O-C-N 120.453 -1.404 . . . . 13.86 110.963 176.46 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 31.3 t30 -97.01 100.01 11.52 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 114.022 1.119 . . . . 16.69 114.022 -174.045 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 72.6 mtm -141.15 148.41 51.45 Favored Pre-proline 0 N--CA 1.487 1.375 0 CA-C-O 115.845 -2.026 . . . . 9.34 106.516 -178.442 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -76.28 163.41 32.57 Favored 'Trans proline' 0 C--N 1.308 -1.556 0 O-C-N 126.166 2.666 . . . . 8.82 110.333 177.321 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 51.1 m-20 71.9 -59.45 0.55 Allowed 'General case' 0 C--N 1.294 -1.806 0 C-N-CA 127.099 2.159 . . . . 10.65 113.142 176.292 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 45.4 ttm -140.66 112.51 7.61 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-O 115.435 -2.221 . . . . 15.61 106.279 177.061 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 35.9 p30 -82.01 -178.87 7.18 Favored 'General case' 0 N--CA 1.516 2.842 1 O-C-N 129.324 4.14 . . . . 11.74 110.295 -176.146 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -61.87 -41.94 99.69 Favored Glycine 0 C--N 1.361 1.931 0 CA-C-O 116.687 -2.174 . . . . 8.2 111.864 -178.455 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 47.5 tp -62.1 -41.27 98.04 Favored 'General case' 0 C--O 1.247 0.93 0 O-C-N 127.243 2.378 . . . . 9.1 111.656 -178.133 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLU . . . . . 0.423 ' CG ' ' O ' ' A' ' 217' ' ' HOH . 48.5 mt-10 -67.05 -42.33 84.97 Favored 'General case' 0 N--CA 1.476 0.866 0 O-C-N 125.16 1.537 . . . . 19.49 111.491 179.883 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 17.1 tp -61.58 -47.96 83.13 Favored 'General case' 0 C--O 1.246 0.904 0 C-N-CA 119.983 -0.687 . . . . 8.33 109.677 179.733 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 38.5 tp -54.56 -49.64 69.84 Favored 'General case' 0 N--CA 1.516 2.847 0 CA-C-N 113.536 -1.665 . . . . 7.05 111.245 177.225 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 38.3 mttt -61.14 -37.72 83.84 Favored 'General case' 0 C--N 1.281 -2.405 0 CA-C-N 119.559 1.072 . . . . 15.59 112.335 178.117 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 22.2 m -67.57 -40.8 84.89 Favored 'General case' 0 C--N 1.313 -1.013 0 O-C-N 121.288 -0.882 . . . . 11.28 111.607 176.692 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 69.0 mt -64.01 -43.92 97.71 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 CA-C-N 115.868 -0.605 . . . . 10.37 110.267 177.866 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 77.8 mmt-85 -65.64 -32.62 74.29 Favored 'General case' 0 C--N 1.289 -2.025 0 C-N-CA 124.784 1.234 . . . . 12.79 110.142 -176.354 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -81.86 -14.15 56.64 Favored 'General case' 0 C--O 1.255 1.356 0 CA-C-O 115.696 -2.097 . . . . 17.77 111.04 -177.905 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -95.27 121.5 36.99 Favored 'General case' 0 C--N 1.287 -2.11 0 CA-C-O 125.002 2.334 . . . . 22.56 108.931 -175.72 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -52.44 -40.71 62.55 Favored 'General case' 0 C--N 1.294 -1.835 0 CA-C-O 113.594 -3.098 . . . . 24.92 110.205 -178.266 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -80.19 -25.18 39.84 Favored 'General case' 0 C--N 1.307 -1.251 0 O-C-N 126.855 2.597 . . . . 21.13 114.884 -177.283 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 39.4 mtm -117.63 -0.25 11.89 Favored 'General case' 0 C--N 1.295 -1.765 0 N-CA-C 115.808 1.781 . . . . 26.04 115.808 179.642 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . 0.313 46.1 p -57.0 -18.87 15.36 Favored 'General case' 0 C--O 1.261 1.667 0 CA-C-O 113.608 -3.091 . . . . 17.77 116.273 -169.741 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -96.58 -8.04 32.86 Favored 'General case' 0 C--N 1.294 -1.834 0 CA-C-N 121.303 1.865 . . . . 13.78 111.24 -177.394 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.39 134.13 76.4 Favored Pre-proline 0 N--CA 1.481 1.121 0 C-N-CA 119.322 -0.951 . . . . 16.12 110.671 -175.08 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 13.8 Cg_exo -64.51 136.16 49.1 Favored 'Trans proline' 0 C--N 1.307 -1.648 0 O-C-N 125.165 2.139 . . . . 11.21 109.738 174.779 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 99.0 t -128.75 116.31 40.63 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.412 0 O-C-N 127.214 2.822 . . . . 8.21 109.997 178.429 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 39.2 tp -100.88 117.82 35.7 Favored 'General case' 0 C--N 1.303 -1.426 0 CA-C-O 115.664 -2.112 . . . . 8.46 108.559 177.023 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 2.4 tpp -85.73 140.57 30.38 Favored 'General case' 0 C--N 1.297 -1.691 0 O-C-N 126.609 2.443 . . . . 18.21 110.13 179.999 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 60.8 t -116.74 129.18 73.67 Favored 'Isoleucine or valine' 0 C--N 1.265 -3.091 0 C-N-CA 128.457 2.703 . . . . 9.76 110.017 177.691 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 7.0 t -136.36 155.8 49.53 Favored 'General case' 0 N--CA 1.484 1.24 0 CA-C-O 118.275 -0.869 . . . . 13.74 109.975 178.553 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -86.34 -11.74 51.27 Favored 'General case' 0 C--N 1.297 -1.716 0 N-CA-C 106.91 -1.515 . . . . 15.53 106.91 178.439 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' GLU . . . . . 0.484 ' OE1' ' O ' ' A' ' 203' ' ' HOH . 9.9 tt0 -161.75 116.43 1.96 Allowed 'General case' 0 N--CA 1.499 1.982 0 C-N-CA 116.706 -1.998 . . . . 28.74 110.735 -176.224 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -66.35 124.25 22.19 Favored 'General case' 0 C--O 1.261 1.665 0 C-N-CA 127.462 2.305 . . . . 19.18 110.138 -178.276 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 7.8 mtmm -131.69 130.3 41.83 Favored 'General case' 0 C--N 1.314 -0.936 0 O-C-N 126.92 2.637 . . . . 22.68 103.939 177.879 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' LYS . . . . . 0.924 ' CD ' ' O ' ' A' ' 205' ' ' HOH . 0.0 OUTLIER -43.6 -50.88 7.21 Favored 'General case' 0 C--O 1.25 1.113 1 O-C-N 129.531 4.269 . . . . 19.32 113.186 178.536 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -70.48 -29.38 65.9 Favored 'General case' 0 N--CA 1.491 1.598 0 CA-C-N 121.525 1.966 . . . . 21.01 113.36 -176.743 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -66.59 -47.97 71.05 Favored 'General case' 0 CA--C 1.564 1.507 0 O-C-N 119.411 -2.056 . . . . 12.68 109.01 178.76 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 60.3 mt -60.81 -46.14 96.71 Favored 'Isoleucine or valine' 0 C--O 1.265 1.911 0 O-C-N 128.361 3.538 . . . . 12.09 109.59 177.513 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' ILE . . . . . 0.657 ' CG1' ' O ' ' A' ' 205' ' ' HOH . 14.4 mm -65.68 -45.56 91.71 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.867 0 O-C-N 125.996 2.06 . . . . 15.31 108.821 178.446 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -59.52 -42.63 92.72 Favored 'General case' 0 C--N 1.285 -2.209 0 CA-C-N 120.542 1.519 . . . . 9.24 112.082 -177.842 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -66.17 -46.64 76.66 Favored 'General case' 0 C--O 1.208 -1.113 0 CA-C-O 115.402 -2.237 . . . . 8.71 111.605 178.54 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -56.75 -51.02 70.49 Favored 'General case' 0 C--N 1.311 -1.093 0 O-C-N 127.598 3.061 . . . . 11.5 111.36 179.964 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -58.4 -34.33 70.64 Favored 'General case' 0 C--N 1.313 -1.004 0 C-N-CA 125.452 1.501 . . . . 24.52 113.081 174.679 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -82.31 -2.37 52.54 Favored 'General case' 0 C--N 1.292 -1.894 0 CA-C-O 116.336 -1.792 . . . . 11.3 113.69 175.524 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 101.87 12.38 34.78 Favored Glycine 0 C--O 1.26 1.742 0 CA-C-O 116.516 -2.269 . . . . 9.13 118.262 178.333 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.79 142.36 50.47 Favored 'General case' 0 N--CA 1.499 2.018 0 CA-C-N 121.118 2.459 . . . . 7.24 109.929 179.926 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 4.6 m -83.06 -26.72 30.85 Favored 'General case' 0 C--O 1.255 1.378 0 CA-C-N 119.842 1.201 . . . . 9.26 111.045 -179.323 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -170.87 177.36 43.94 Favored Glycine 0 CA--C 1.544 1.849 0 C-N-CA 125.125 1.345 . . . . 9.74 110.43 177.772 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' TYR . . . . . 0.905 ' CD1' ' N ' ' A' ' 106' ' ' TYR 0.266 0.0 OUTLIER -136.07 142.75 44.38 Favored 'General case' 0 C--N 1.299 -1.6 0 C-N-CA 129.142 2.977 . . . . 23.44 109.653 -179.993 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 3.9 p -139.67 136.16 39.57 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.289 1 O-C-N 116.28 -4.013 . . . . 14.86 110.094 175.498 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 55.3 t -95.4 132.57 39.13 Favored 'Isoleucine or valine' 0 C--O 1.256 1.444 0 N-CA-C 108.285 -1.005 . . . . 11.55 108.285 178.46 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 11.7 pttm -93.72 149.19 36.71 Favored Pre-proline 0 C--N 1.266 -3.059 0 N-CA-C 108.83 -0.804 . . . . 22.34 108.83 179.227 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_endo -79.15 152.43 88.25 Favored 'Cis proline' 0 N--CA 1.433 -2.08 0 CA-C-O 116.747 -1.439 . . . . 9.92 110.163 2.963 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 17.7 p90 -138.06 156.41 47.82 Favored 'General case' 0 C--O 1.267 1.984 0 O-C-N 127.301 2.875 . . . . 11.49 108.182 -178.725 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 30.9 p -96.74 172.68 7.74 Favored 'General case' 0 C--N 1.276 -2.611 0 O-C-N 127.707 3.13 . . . . 9.63 108.53 179.594 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -58.65 -42.04 87.45 Favored 'General case' 0 C--N 1.363 1.181 0 CA-C-N 112.313 -2.221 . . . . 10.73 114.079 172.364 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -59.01 -42.42 90.05 Favored 'General case' 0 C--O 1.213 -0.816 0 O-C-N 121.062 -1.024 . . . . 9.94 112.011 177.154 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 65.9 m -68.36 -46.41 70.19 Favored 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 106.023 -1.844 . . . . 10.81 106.023 -178.086 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.53 -46.85 83.36 Favored 'General case' 0 N--CA 1.502 2.172 0 CA-C-O 123.603 1.668 . . . . 11.46 109.532 -176.952 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -54.64 -47.78 73.09 Favored 'General case' 0 C--O 1.241 0.633 0 O-C-N 120.618 -1.302 . . . . 19.76 111.216 -179.307 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -61.7 -41.52 97.72 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 125.122 1.514 . . . . 28.12 110.057 178.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' LYS . . . . . 0.717 ' CE ' ' O ' ' A' ' 184' ' ' HOH . 27.9 mmtt -64.68 -43.28 94.06 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-N 119.275 0.943 . . . . 20.55 109.671 178.356 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 20.3 mt -59.02 -53.2 61.07 Favored 'General case' 0 C--O 1.242 0.68 0 CA-C-N 115.345 -0.843 . . . . 13.14 111.554 179.785 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -59.2 -41.57 88.86 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 115.164 -0.925 . . . . 17.63 111.267 179.529 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.42 -46.58 80.17 Favored 'General case' 0 C--N 1.266 -3.033 0 O-C-N 118.95 -2.344 . . . . 27.09 109.957 177.99 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 37.7 mt -69.96 -47.59 68.14 Favored 'Isoleucine or valine' 0 C--O 1.266 1.935 0 O-C-N 121.271 -0.893 . . . . 15.99 110.009 178.976 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 21.8 m-85 -55.85 -42.5 75.92 Favored 'General case' 0 CA--C 1.563 1.467 0 N-CA-C 106.33 -1.73 . . . . 17.1 106.33 179.689 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -64.96 -46.07 83.08 Favored 'General case' 0 C--O 1.281 2.724 0 CA-C-O 123.597 1.665 . . . . 26.02 113.181 178.508 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 30.9 ttpt -63.51 -33.35 75.39 Favored 'General case' 0 C--O 1.261 1.707 0 CA-C-N 114.296 -1.32 . . . . 20.66 112.043 179.362 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 8.2 mp -97.49 2.31 50.07 Favored 'General case' 0 C--O 1.207 -1.174 0 N-CA-C 113.491 0.923 . . . . 22.6 113.491 -178.104 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 58.19 48.69 81.67 Favored Glycine 0 N--CA 1.49 2.289 0 CA-C-O 118.147 -1.363 . . . . 24.55 111.901 -178.351 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 95.6 mtp . . . . . 0 C--O 1.288 3.101 1 CA-C-O 110.517 -4.563 . . . . 29.97 111.479 176.716 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 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 ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' 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 ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 158' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 159' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 160' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 161' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 162' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 163' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 164' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 165' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 166' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 167' ' ' HOH . . . . . 0.757 ' O ' ' CE ' ' A' ' 26' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 168' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 169' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 170' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 171' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 172' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 173' ' ' 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 ' 176' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 177' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 178' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 179' ' ' 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 . . . . . 0.717 ' O ' ' CE ' ' A' ' 119' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 185' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 186' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 187' ' ' 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 ' 190' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 191' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 192' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 193' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 194' ' ' 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 ' 200' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' HOH . . . . . 0.484 ' O ' ' OE1' ' A' ' 89' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' HOH . . . . . 0.555 ' O ' ' CB ' ' A' ' 23' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' HOH . . . . . 0.924 ' O ' ' CD ' ' A' ' 92' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 217' ' ' HOH . . . . . 0.423 ' O ' ' CG ' ' A' ' 67' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.687 0 N-CA-C 110.673 -0.121 . . . . 27.699999999999999 110.673 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 50.0 t0 -58.78 124.98 21.6 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-O 112.745 -3.502 . . . . 25.059999999999999 109.143 174.969 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' LYS . . . . . 0.564 ' HG3' ' O ' ' A' ' 29' ' ' GLY . 4.2 tptt -61.87 -16.65 52.11 Favored 'General case' 0 C--N 1.298 -1.666 0 CA-C-N 122.259 2.299 . . . . 24.969999999999999 112.676 175.763 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 69.2 mm-40 -92.27 7.67 41.68 Favored 'General case' 0 C--O 1.256 1.445 0 N-CA-C 113.566 0.95 . . . . 17.039999999999999 113.566 178.443 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 8.1 tp -52.41 130.33 31.04 Favored 'General case' 0 C--O 1.259 1.573 0 N-CA-C 108.887 -0.783 . . . . 14.85 108.887 174.504 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' LYS . . . . . 0.518 ' HA ' ' HB3' ' A' ' 32' ' ' ASN . 34.1 ttpt -84.87 116.64 23.43 Favored 'General case' 0 C--N 1.302 -1.477 0 C-N-CA 125.536 1.534 . . . . 19.440000000000001 110.071 179.506 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -98.34 143.2 29.07 Favored 'General case' 0 C--N 1.309 -1.163 0 C-N-CA 126.58 1.952 . . . . 10.369999999999999 112.641 179.059 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 60.1 tp -117.34 117.97 30.96 Favored 'General case' 0 C--N 1.354 0.762 0 O-C-N 127.583 3.052 . . . . 7.6799999999999997 104.167 173.954 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 71.4 t -103.04 121.42 54.21 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.986 0 O-C-N 126.697 2.498 . . . . 7.8300000000000001 109.211 174.734 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 3.0 t -114.54 117.21 54.89 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.306 0 CA-C-O 115.253 -2.308 . . . . 7.3899999999999997 112.634 -175.863 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -163.9 144.84 8.7 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 127.907 3.254 . . . . 13.630000000000001 104.275 179.541 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 13.1 p-10 -81.86 -3.65 54.59 Favored 'General case' 0 C--O 1.254 1.314 0 O-C-N 128.336 3.522 . . . . 15.550000000000001 109.253 178.025 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' PHE . . . . . 0.457 ' HD1' ' O ' ' A' ' 132' ' ' HOH 0.26 81.1 m-85 -107.78 119.13 38.58 Favored 'General case' 0 N--CA 1.502 2.155 0 C-N-CA 117.602 -1.639 . . . . 17.059999999999999 108.372 176.738 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 15' ' ' SER . . . . . 0.877 ' O ' ' HD2' ' A' ' 19' ' ' ARG . 0.1 OUTLIER -53.45 -44.33 68.8 Favored 'General case' 0 C--N 1.297 -1.696 0 CA-C-N 113.657 -1.61 . . . . 18.489999999999998 113.033 178.926 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 23.9 m -63.48 -37.42 87.22 Favored 'General case' 0 C--O 1.252 1.221 0 O-C-N 126.285 2.241 . . . . 13.06 112.84 178.961 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' MET . . . . . 0.455 ' HE3' ' HB2' ' A' ' 17' ' ' MET . 12.9 tpp -70.52 -35.82 73.38 Favored 'General case' 0 N--CA 1.469 0.509 0 O-C-N 125.315 1.634 . . . . 17.41 109.56 177.078 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ARG . . . . . 0.902 HH21 ' NH2' ' A' ' 19' ' ' ARG . 87.4 mtm-85 -63.22 -44.44 95.26 Favored 'General case' 0 N--CA 1.498 1.958 0 CA-C-O 121.3 0.571 . . . . 10.26 111.408 174.796 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ARG . . . . . 0.902 ' NH2' HH21 ' A' ' 18' ' ' ARG . 0.0 OUTLIER -61.03 -41.01 95.76 Favored 'General case' 0 C--O 1.253 1.285 0 CA-C-N 114.448 -1.251 . . . . 28.48 111.877 177.696 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 93.9 mt -59.81 -48.63 86.92 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 CA-C-N 119.237 0.926 . . . . 10.24 112.24 177.125 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 51.2 t -63.05 -44.52 99.63 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.218 0 CA-C-N 115.493 -0.776 . . . . 8.1400000000000006 111.901 -178.413 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -59.5 -41.43 89.89 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 127.428 2.955 . . . . 19.48 110.875 176.389 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ASN . . . . . 0.827 ' HB2' ' O ' ' A' ' 204' ' ' HOH 0.26 20.1 t-20 -67.53 -40.81 85.04 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-O 115.928 -1.987 . . . . 17.239999999999998 112.619 -179.761 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 24' ' ' LEU . . . . . 0.486 ' HB3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -59.74 -49.16 78.81 Favored 'General case' 0 C--N 1.283 -2.326 0 O-C-N 127.323 2.889 . . . . 12.369999999999999 112.054 172.456 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.9 -44.88 91.3 Favored 'General case' 0 C--O 1.198 -1.624 0 O-C-N 124.691 1.244 . . . . 10.460000000000001 111.507 178.533 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 26' ' ' LYS . . . . . 0.757 ' CE ' ' O ' ' A' ' 167' ' ' HOH . 0.0 OUTLIER -51.83 -46.82 64.48 Favored 'General case' 0 N--CA 1.504 2.244 0 CA-C-O 126.449 3.024 . . . . 16.43 109.849 179.858 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 67.6 tt0 -59.19 -29.78 67.72 Favored 'General case' 0 C--O 1.284 2.893 0 CA-C-N 113.207 -1.815 . . . . 17.050000000000001 112.368 -179.589 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -89.26 -11.59 43.12 Favored 'General case' 0 C--N 1.305 -1.349 0 C-N-CA 126.801 2.04 . . . . 12.619999999999999 110.571 -179.202 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 29' ' ' GLY . . . . . 0.564 ' O ' ' HG3' ' A' ' 4' ' ' LYS . . . 100.12 12.46 39.45 Favored Glycine 0 C--O 1.203 -1.784 0 CA-C-O 117.291 -1.838 . . . . 9.4399999999999995 114.09 179.922 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -104.55 99.44 9.12 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 115.539 -2.172 . . . . 11.19 105.357 -178.968 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ASN . . . . . 0.652 ' HA ' ' HE2' ' A' ' 26' ' ' LYS . 14.3 m120 -97.49 -8.13 29.92 Favored 'General case' 0 N--CA 1.452 -0.345 1 O-C-N 129.113 4.008 . . . . 13.09 114.738 -177.073 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ASN . . . . . 0.682 ' HB2' ' O ' ' A' ' 138' ' ' HOH 0.354 0.3 OUTLIER -89.19 79.39 7.15 Favored 'General case' 0 C--N 1.268 -2.961 1 CA-C-O 109.979 -4.82 . . . . 21.27 113.82 -175.603 . . . . . . . . 5 4 . 1 . 001 ecloud build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 84.9 t -128.05 138.55 54.38 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.128 1 O-C-N 134.354 7.284 . . . . 13.720000000000001 111.356 -173.271 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -121.04 160.04 24.43 Favored 'General case' 0 C--O 1.263 1.764 0 N-CA-C 104.697 -2.335 . . . . 27.710000000000001 104.697 172.86 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 35' ' ' GLU . . . . . 0.716 ' OE1' ' NH2' ' A' ' 19' ' ' ARG . 58.9 mt-10 -127.41 152.22 47.8 Favored 'General case' 0 C--N 1.297 -1.7 0 O-C-N 125.459 1.724 . . . . 15.470000000000001 112.14 -174.693 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -149.16 149.26 30.72 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 104.887 -2.264 . . . . 9.9399999999999995 104.887 179.508 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 76.5 mt-10 -88.77 -24.7 22.58 Favored 'General case' 0 N--CA 1.426 -1.662 0 O-C-N 127.078 2.736 . . . . 24.699999999999999 118.369 -173.337 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 20.0 p30 -165.28 178.86 6.61 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-O 116.76 -1.591 . . . . 13.93 108.259 -178.553 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -57.04 -44.2 93.02 Favored Glycine 0 N--CA 1.429 -1.817 0 O-C-N 124.844 1.34 . . . . 9.5500000000000007 115.551 -178.444 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . 0.362 2.0 m -70.65 -38.39 73.04 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 C-N-CA 118.22 -1.392 . . . . 13.93 111.62 -177.482 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ASP . . . . . 0.475 ' O ' ' HG2' ' A' ' 45' ' ' LYS . 25.1 t0 -58.56 -45.78 88.26 Favored 'General case' 0 N--CA 1.45 -0.454 0 O-C-N 120.234 -1.541 . . . . 12.210000000000001 108.418 175.51 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -59.3 -45.12 92.16 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 114.758 1.392 . . . . 9.5399999999999991 114.758 178.108 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 77.0 mt -62.99 -35.12 79.15 Favored 'General case' 0 C--O 1.252 1.202 0 C-N-CA 125.42 1.488 . . . . 13.050000000000001 112.151 179.592 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 33.7 m-20 -62.16 -47.68 83.44 Favored 'General case' 0 C--N 1.31 -1.146 0 O-C-N 125.24 1.588 . . . . 18.140000000000001 108.078 177.498 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' LYS . . . . . 0.475 ' HG2' ' O ' ' A' ' 41' ' ' ASP . 4.6 mmtt -70.39 -39.31 74.61 Favored 'General case' 0 CA--C 1.507 -0.705 0 CA-C-O 116.422 -1.751 . . . . 23.719999999999999 110.026 -178.348 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 44.9 mt -65.14 -15.63 62.62 Favored 'General case' 0 C--N 1.306 -1.323 0 O-C-N 124.334 1.021 . . . . 21.120000000000001 112.013 -175.499 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.4 mm100 -65.97 -39.56 90.49 Favored 'General case' 0 C--N 1.298 -1.643 0 C-N-CA 126.633 1.973 . . . . 29.07 111.435 -179.027 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.43 -15.33 62.5 Favored 'General case' 0 C--O 1.246 0.906 0 O-C-N 127.143 2.777 . . . . 26.629999999999999 112.241 179.117 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 76.1 -179.8 47.26 Favored Glycine 0 C--N 1.311 -0.85 0 O-C-N 119.561 -1.962 . . . . 23.390000000000001 117.325 177.68 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 73.13 9.48 76.64 Favored Glycine 0 N--CA 1.434 -1.494 0 C-N-CA 129.512 3.434 . . . . 18.460000000000001 116.854 179.443 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 60.4 m-85 -70.64 146.85 49.74 Favored 'General case' 0 C--O 1.262 1.726 0 CA-C-N 118.966 1.383 . . . . 14.25 110.563 176.111 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -115.91 -15.85 7.13 Favored Glycine 0 C--O 1.21 -1.373 0 N-CA-C 117.884 1.914 . . . . 10.84 117.884 177.784 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -166.76 136.68 3.07 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 108.358 -0.979 . . . . 9.5600000000000005 108.358 -169.416 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' ILE . . . . . 0.751 HD13 HD13 ' A' ' 72' ' ' ILE . 7.7 mt -120.64 135.21 61.58 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.136 0 N-CA-C 106.845 -1.539 . . . . 10.15 106.845 -178.973 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 92.9 mt -117.56 111.89 36.54 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.166 0 O-C-N 128.198 3.436 . . . . 7.4400000000000004 104.142 172.791 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 32.1 t -123.59 141.41 52.03 Favored 'General case' 0 C--O 1.196 -1.726 0 O-C-N 125.032 1.458 . . . . 10.880000000000001 113.156 -175.593 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -77.22 143.92 38.63 Favored 'General case' 0 N--CA 1.485 1.319 0 N-CA-C 105.896 -1.89 . . . . 13.94 105.896 176.519 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 69.1 t-105 -70.39 -47.56 60.3 Favored 'General case' 0 C--N 1.294 -1.842 0 O-C-N 120.453 -1.404 . . . . 13.859999999999999 110.963 176.46 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 31.3 t30 -97.01 100.01 11.52 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 114.022 1.119 . . . . 16.690000000000001 114.022 -174.045 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 72.6 mtm -141.15 148.41 51.45 Favored Pre-proline 0 N--CA 1.487 1.375 0 CA-C-O 115.845 -2.026 . . . . 9.3399999999999999 106.516 -178.442 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -76.28 163.41 32.57 Favored 'Trans proline' 0 C--N 1.308 -1.556 0 O-C-N 126.166 2.666 . . . . 8.8200000000000003 110.333 177.321 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 51.1 m-20 71.9 -59.45 0.55 Allowed 'General case' 0 C--N 1.294 -1.806 0 C-N-CA 127.099 2.159 . . . . 10.65 113.142 176.292 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 45.4 ttm -140.66 112.51 7.61 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-O 115.435 -2.221 . . . . 15.609999999999999 106.279 177.061 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ASP . . . . . 0.417 ' OD1' ' HG3' ' A' ' 67' ' ' GLU . 35.9 p30 -82.01 -178.87 7.18 Favored 'General case' 0 N--CA 1.516 2.842 1 O-C-N 129.324 4.14 . . . . 11.74 110.295 -176.146 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -61.87 -41.94 99.69 Favored Glycine 0 C--N 1.361 1.931 0 CA-C-O 116.687 -2.174 . . . . 8.1999999999999993 111.864 -178.455 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' LEU . . . . . 0.46 ' HG ' ' HE3' ' A' ' 70' ' ' LYS . 47.5 tp -62.1 -41.27 98.04 Favored 'General case' 0 C--O 1.247 0.93 0 O-C-N 127.243 2.378 . . . . 9.0999999999999996 111.656 -178.133 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLU . . . . . 0.656 ' HG3' ' O ' ' A' ' 217' ' ' HOH . 48.5 mt-10 -67.05 -42.33 84.97 Favored 'General case' 0 N--CA 1.476 0.866 0 O-C-N 125.16 1.537 . . . . 19.489999999999998 111.491 179.883 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 17.1 tp -61.58 -47.96 83.13 Favored 'General case' 0 C--O 1.246 0.904 0 C-N-CA 119.983 -0.687 . . . . 8.3300000000000001 109.677 179.733 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 38.5 tp -54.56 -49.64 69.84 Favored 'General case' 0 N--CA 1.516 2.847 0 CA-C-N 113.536 -1.665 . . . . 7.0499999999999998 111.245 177.225 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' LYS . . . . . 0.46 ' HE3' ' HG ' ' A' ' 66' ' ' LEU . 38.3 mttt -61.14 -37.72 83.84 Favored 'General case' 0 C--N 1.281 -2.405 0 CA-C-N 119.559 1.072 . . . . 15.59 112.335 178.117 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 22.2 m -67.57 -40.8 84.89 Favored 'General case' 0 C--N 1.313 -1.013 0 O-C-N 121.288 -0.882 . . . . 11.279999999999999 111.607 176.692 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' ILE . . . . . 0.751 HD13 HD13 ' A' ' 54' ' ' ILE . 69.0 mt -64.01 -43.92 97.71 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 CA-C-N 115.868 -0.605 . . . . 10.369999999999999 110.267 177.866 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 77.8 mmt-85 -65.64 -32.62 74.29 Favored 'General case' 0 C--N 1.289 -2.025 0 C-N-CA 124.784 1.234 . . . . 12.789999999999999 110.142 -176.354 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -81.86 -14.15 56.64 Favored 'General case' 0 C--O 1.255 1.356 0 CA-C-O 115.696 -2.097 . . . . 17.77 111.04 -177.905 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -95.27 121.5 36.99 Favored 'General case' 0 C--N 1.287 -2.11 0 CA-C-O 125.002 2.334 . . . . 22.559999999999999 108.931 -175.72 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -52.44 -40.71 62.55 Favored 'General case' 0 C--N 1.294 -1.835 0 CA-C-O 113.594 -3.098 . . . . 24.920000000000002 110.205 -178.266 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -80.19 -25.18 39.84 Favored 'General case' 0 C--N 1.307 -1.251 0 O-C-N 126.855 2.597 . . . . 21.129999999999999 114.884 -177.283 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' MET . . . . . 0.409 ' HB3' HD22 ' A' ' 81' ' ' LEU . 39.4 mtm -117.63 -0.25 11.89 Favored 'General case' 0 C--N 1.295 -1.765 0 N-CA-C 115.808 1.781 . . . . 26.039999999999999 115.808 179.642 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . 0.313 46.1 p -57.0 -18.87 15.36 Favored 'General case' 0 C--O 1.261 1.667 0 CA-C-O 113.608 -3.091 . . . . 17.77 116.273 -169.741 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -96.58 -8.04 32.86 Favored 'General case' 0 C--N 1.294 -1.834 0 CA-C-N 121.303 1.865 . . . . 13.779999999999999 111.24 -177.394 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' LEU . . . . . 0.409 HD22 ' HB3' ' A' ' 78' ' ' MET . 0.0 OUTLIER -56.39 134.13 76.4 Favored Pre-proline 0 N--CA 1.481 1.121 0 C-N-CA 119.322 -0.951 . . . . 16.120000000000001 110.671 -175.08 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 13.8 Cg_exo -64.51 136.16 49.1 Favored 'Trans proline' 0 C--N 1.307 -1.648 0 O-C-N 125.165 2.139 . . . . 11.210000000000001 109.738 174.779 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 99.0 t -128.75 116.31 40.63 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.412 0 O-C-N 127.214 2.822 . . . . 8.2100000000000009 109.997 178.429 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 39.2 tp -100.88 117.82 35.7 Favored 'General case' 0 C--N 1.303 -1.426 0 CA-C-O 115.664 -2.112 . . . . 8.4600000000000009 108.559 177.023 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 2.4 tpp -85.73 140.57 30.38 Favored 'General case' 0 C--N 1.297 -1.691 0 O-C-N 126.609 2.443 . . . . 18.210000000000001 110.13 179.999 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 60.8 t -116.74 129.18 73.67 Favored 'Isoleucine or valine' 0 C--N 1.265 -3.091 0 C-N-CA 128.457 2.703 . . . . 9.7599999999999998 110.017 177.691 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 7.0 t -136.36 155.8 49.53 Favored 'General case' 0 N--CA 1.484 1.24 0 CA-C-O 118.275 -0.869 . . . . 13.74 109.975 178.553 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ALA . . . . . 0.637 ' HB2' ' NZ ' ' A' ' 109' ' ' LYS . . . -86.34 -11.74 51.27 Favored 'General case' 0 C--N 1.297 -1.716 0 N-CA-C 106.91 -1.515 . . . . 15.529999999999999 106.91 178.439 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 89' ' ' GLU . . . . . 0.484 ' OE1' ' O ' ' A' ' 203' ' ' HOH . 9.9 tt0 -161.75 116.43 1.96 Allowed 'General case' 0 N--CA 1.499 1.982 0 C-N-CA 116.706 -1.998 . . . . 28.739999999999998 110.735 -176.224 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 90' ' ' ALA . . . . . 0.458 ' HA ' ' O ' ' A' ' 177' ' ' HOH . . . -66.35 124.25 22.19 Favored 'General case' 0 C--O 1.261 1.665 0 C-N-CA 127.462 2.305 . . . . 19.18 110.138 -178.276 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 91' ' ' LYS . . . . . 0.528 ' HE3' ' O ' ' A' ' 189' ' ' HOH . 7.8 mtmm -131.69 130.3 41.83 Favored 'General case' 0 C--N 1.314 -0.936 0 O-C-N 126.92 2.637 . . . . 22.68 103.939 177.879 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 92' ' ' LYS . . . . . 1.302 ' HD2' ' O ' ' A' ' 205' ' ' HOH . 0.0 OUTLIER -43.6 -50.88 7.21 Favored 'General case' 0 C--O 1.25 1.113 1 O-C-N 129.531 4.269 . . . . 19.32 113.186 178.536 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 93' ' ' GLU . . . . . 0.527 ' N ' ' HG3' ' A' ' 92' ' ' LYS . 0.9 OUTLIER -70.48 -29.38 65.9 Favored 'General case' 0 N--CA 1.491 1.598 0 CA-C-N 121.525 1.966 . . . . 21.010000000000002 113.36 -176.743 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -66.59 -47.97 71.05 Favored 'General case' 0 CA--C 1.564 1.507 0 O-C-N 119.411 -2.056 . . . . 12.68 109.01 178.76 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 60.3 mt -60.81 -46.14 96.71 Favored 'Isoleucine or valine' 0 C--O 1.265 1.911 0 O-C-N 128.361 3.538 . . . . 12.09 109.59 177.513 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' ILE . . . . . 0.657 ' CG1' ' O ' ' A' ' 205' ' ' HOH . 14.4 mm -65.68 -45.56 91.71 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.867 0 O-C-N 125.996 2.06 . . . . 15.31 108.821 178.446 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -59.52 -42.63 92.72 Favored 'General case' 0 C--N 1.285 -2.209 0 CA-C-N 120.542 1.519 . . . . 9.2400000000000002 112.082 -177.842 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -66.17 -46.64 76.66 Favored 'General case' 0 C--O 1.208 -1.113 0 CA-C-O 115.402 -2.237 . . . . 8.7100000000000009 111.605 178.54 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -56.75 -51.02 70.49 Favored 'General case' 0 C--N 1.311 -1.093 0 O-C-N 127.598 3.061 . . . . 11.5 111.36 179.964 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -58.4 -34.33 70.64 Favored 'General case' 0 C--N 1.313 -1.004 0 C-N-CA 125.452 1.501 . . . . 24.52 113.081 174.679 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -82.31 -2.37 52.54 Favored 'General case' 0 C--N 1.292 -1.894 0 CA-C-O 116.336 -1.792 . . . . 11.300000000000001 113.69 175.524 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 101.87 12.38 34.78 Favored Glycine 0 C--O 1.26 1.742 0 CA-C-O 116.516 -2.269 . . . . 9.1300000000000008 118.262 178.333 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.79 142.36 50.47 Favored 'General case' 0 N--CA 1.499 2.018 0 CA-C-N 121.118 2.459 . . . . 7.2400000000000002 109.929 179.926 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 4.6 m -83.06 -26.72 30.85 Favored 'General case' 0 C--O 1.255 1.378 0 CA-C-N 119.842 1.201 . . . . 9.2599999999999998 111.045 -179.323 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -170.87 177.36 43.94 Favored Glycine 0 CA--C 1.544 1.849 0 C-N-CA 125.125 1.345 . . . . 9.7400000000000002 110.43 177.772 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' TYR . . . . . 1.086 ' O ' ' HD1' ' A' ' 106' ' ' TYR 0.266 0.0 OUTLIER -136.07 142.75 44.38 Favored 'General case' 0 C--N 1.299 -1.6 0 C-N-CA 129.142 2.977 . . . . 23.440000000000001 109.653 -179.993 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 3.9 p -139.67 136.16 39.57 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.289 1 O-C-N 116.28 -4.013 . . . . 14.859999999999999 110.094 175.498 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 55.3 t -95.4 132.57 39.13 Favored 'Isoleucine or valine' 0 C--O 1.256 1.444 0 N-CA-C 108.285 -1.005 . . . . 11.550000000000001 108.285 178.46 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' LYS . . . . . 0.637 ' NZ ' ' HB2' ' A' ' 88' ' ' ALA . 11.7 pttm -93.72 149.19 36.71 Favored Pre-proline 0 C--N 1.266 -3.059 0 N-CA-C 108.83 -0.804 . . . . 22.34 108.83 179.227 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_endo -79.15 152.43 88.25 Favored 'Cis proline' 0 N--CA 1.433 -2.08 0 CA-C-O 116.747 -1.439 . . . . 9.9199999999999999 110.163 2.963 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 17.7 p90 -138.06 156.41 47.82 Favored 'General case' 0 C--O 1.267 1.984 0 O-C-N 127.301 2.875 . . . . 11.49 108.182 -178.725 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 30.9 p -96.74 172.68 7.74 Favored 'General case' 0 C--N 1.276 -2.611 0 O-C-N 127.707 3.13 . . . . 9.6300000000000008 108.53 179.594 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -58.65 -42.04 87.45 Favored 'General case' 0 C--N 1.363 1.181 0 CA-C-N 112.313 -2.221 . . . . 10.73 114.079 172.364 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -59.01 -42.42 90.05 Favored 'General case' 0 C--O 1.213 -0.816 0 O-C-N 121.062 -1.024 . . . . 9.9399999999999995 112.011 177.154 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 65.9 m -68.36 -46.41 70.19 Favored 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 106.023 -1.844 . . . . 10.81 106.023 -178.086 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' LEU . . . . . 0.486 HD12 ' HB3' ' A' ' 24' ' ' LEU . 0.1 OUTLIER -57.53 -46.85 83.36 Favored 'General case' 0 N--CA 1.502 2.172 0 CA-C-O 123.603 1.668 . . . . 11.460000000000001 109.532 -176.952 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -54.64 -47.78 73.09 Favored 'General case' 0 C--O 1.241 0.633 0 O-C-N 120.618 -1.302 . . . . 19.760000000000002 111.216 -179.307 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -61.7 -41.52 97.72 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 125.122 1.514 . . . . 28.120000000000001 110.057 178.921 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' LYS . . . . . 0.717 ' CE ' ' O ' ' A' ' 184' ' ' HOH . 27.9 mmtt -64.68 -43.28 94.06 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-N 119.275 0.943 . . . . 20.550000000000001 109.671 178.356 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 120' ' ' LEU . . . . . 0.452 ' HG ' ' O ' ' A' ' 116' ' ' LEU . 20.3 mt -59.02 -53.2 61.07 Favored 'General case' 0 C--O 1.242 0.68 0 CA-C-N 115.345 -0.843 . . . . 13.140000000000001 111.554 179.785 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -59.2 -41.57 88.86 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 115.164 -0.925 . . . . 17.629999999999999 111.267 179.529 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.42 -46.58 80.17 Favored 'General case' 0 C--N 1.266 -3.033 0 O-C-N 118.95 -2.344 . . . . 27.09 109.957 177.99 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 37.7 mt -69.96 -47.59 68.14 Favored 'Isoleucine or valine' 0 C--O 1.266 1.935 0 O-C-N 121.271 -0.893 . . . . 15.99 110.009 178.976 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 21.8 m-85 -55.85 -42.5 75.92 Favored 'General case' 0 CA--C 1.563 1.467 0 N-CA-C 106.33 -1.73 . . . . 17.100000000000001 106.33 179.689 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -64.96 -46.07 83.08 Favored 'General case' 0 C--O 1.281 2.724 0 CA-C-O 123.597 1.665 . . . . 26.02 113.181 178.508 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 30.9 ttpt -63.51 -33.35 75.39 Favored 'General case' 0 C--O 1.261 1.707 0 CA-C-N 114.296 -1.32 . . . . 20.66 112.043 179.362 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 8.2 mp -97.49 2.31 50.07 Favored 'General case' 0 C--O 1.207 -1.174 0 N-CA-C 113.491 0.923 . . . . 22.600000000000001 113.491 -178.104 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 58.19 48.69 81.67 Favored Glycine 0 N--CA 1.49 2.289 0 CA-C-O 118.147 -1.363 . . . . 24.550000000000001 111.901 -178.351 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 95.6 mtp . . . . . 0 C--O 1.288 3.101 1 CA-C-O 110.517 -4.563 . . . . 29.969999999999999 111.479 176.716 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 132' ' ' HOH . . . . . 0.457 ' O ' ' HD1' ' A' ' 14' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 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 . . . . . 0.682 ' O ' ' HB2' ' A' ' 32' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 143' ' ' 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 ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 149' ' ' 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 ' 155' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 156' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 157' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 158' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 159' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 160' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 161' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 162' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 163' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 164' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 165' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 166' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 167' ' ' HOH . . . . . 0.757 ' O ' ' CE ' ' A' ' 26' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 168' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 169' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 170' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 171' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 172' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 173' ' ' 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 ' 176' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 177' ' ' HOH . . . . . 0.458 ' O ' ' HA ' ' A' ' 90' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 178' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 179' ' ' 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 . . . . . 0.717 ' O ' ' CE ' ' A' ' 119' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 185' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 186' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 187' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 188' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 189' ' ' HOH . . . . . 0.528 ' O ' ' HE3' ' A' ' 91' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 190' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 191' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 192' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 193' ' ' HOH . . . . . 0.407 ' O ' ' HB3' ' A' ' 92' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 194' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 195' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 ' 200' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' HOH . . . . . 0.484 ' O ' ' OE1' ' A' ' 89' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 204' ' ' HOH . . . . . 0.827 ' O ' ' HB2' ' A' ' 23' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 205' ' ' HOH . . . . . 1.302 ' O ' ' HD2' ' A' ' 92' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 217' ' ' HOH . . . . . 0.656 ' O ' ' HG3' ' A' ' 67' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 224' ' ' HOH . . . . . 0.614 ' O ' ' HE3' ' A' ' 109' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.687 0 N-CA-C 110.673 -0.121 . . . . 27.699999999999999 110.673 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 50.0 t0 -58.78 124.98 21.6 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-O 112.745 -3.502 . . . . 25.059999999999999 109.143 174.969 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.564 ' HG3' ' O ' ' A' ' 29' ' ' GLY . 4.2 tptt -61.87 -16.65 52.11 Favored 'General case' 0 C--N 1.298 -1.666 0 CA-C-N 122.259 2.299 . . . . 24.969999999999999 112.676 175.763 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 69.2 mm-40 -92.27 7.67 41.68 Favored 'General case' 0 C--O 1.256 1.445 0 N-CA-C 113.566 0.95 . . . . 17.039999999999999 113.566 178.443 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 8.1 tp -52.41 130.33 31.04 Favored 'General case' 0 C--O 1.259 1.573 0 N-CA-C 108.887 -0.783 . . . . 14.85 108.887 174.504 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.518 ' HA ' ' HB3' ' A' ' 32' ' ' ASN . 34.1 ttpt -84.87 116.64 23.43 Favored 'General case' 0 C--N 1.302 -1.477 0 C-N-CA 125.536 1.534 . . . . 19.440000000000001 110.071 179.506 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -98.34 143.2 29.07 Favored 'General case' 0 C--N 1.309 -1.163 0 C-N-CA 126.58 1.952 . . . . 10.369999999999999 112.641 179.059 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 60.1 tp -117.34 117.97 30.96 Favored 'General case' 0 C--N 1.354 0.762 0 O-C-N 127.583 3.052 . . . . 7.6799999999999997 104.167 173.954 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 71.4 t -103.04 121.42 54.21 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.986 0 O-C-N 126.697 2.498 . . . . 7.8300000000000001 109.211 174.734 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 3.0 t -114.54 117.21 54.89 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.306 0 CA-C-O 115.253 -2.308 . . . . 7.3899999999999997 112.634 -175.863 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -163.9 144.84 8.7 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 127.907 3.254 . . . . 13.630000000000001 104.275 179.541 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 13.1 p-10 -81.86 -3.65 54.59 Favored 'General case' 0 C--O 1.254 1.314 0 O-C-N 128.336 3.522 . . . . 15.550000000000001 109.253 178.025 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.457 ' HD1' ' O ' ' A' ' 132' ' ' HOH 0.26 81.1 m-85 -107.78 119.13 38.58 Favored 'General case' 0 N--CA 1.502 2.155 0 C-N-CA 117.602 -1.639 . . . . 17.059999999999999 108.372 176.738 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' SER . . . . . 0.877 ' O ' ' HD2' ' A' ' 19' ' ' ARG . 0.1 OUTLIER -53.45 -44.33 68.8 Favored 'General case' 0 C--N 1.297 -1.696 0 CA-C-N 113.657 -1.61 . . . . 18.489999999999998 113.033 178.926 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 23.9 m -63.48 -37.42 87.22 Favored 'General case' 0 C--O 1.252 1.221 0 O-C-N 126.285 2.241 . . . . 13.06 112.84 178.961 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' MET . . . . . 0.455 ' HE3' ' HB2' ' A' ' 17' ' ' MET . 12.9 tpp -70.52 -35.82 73.38 Favored 'General case' 0 N--CA 1.469 0.509 0 O-C-N 125.315 1.634 . . . . 17.41 109.56 177.078 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.902 HH21 ' NH2' ' A' ' 19' ' ' ARG . 87.4 mtm-85 -63.22 -44.44 95.26 Favored 'General case' 0 N--CA 1.498 1.958 0 CA-C-O 121.3 0.571 . . . . 10.26 111.408 174.796 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.902 ' NH2' HH21 ' A' ' 18' ' ' ARG . 0.0 OUTLIER -61.03 -41.01 95.76 Favored 'General case' 0 C--O 1.253 1.285 0 CA-C-N 114.448 -1.251 . . . . 28.48 111.877 177.696 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 93.9 mt -59.81 -48.63 86.92 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 CA-C-N 119.237 0.926 . . . . 10.24 112.24 177.125 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 51.2 t -63.05 -44.52 99.63 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.218 0 CA-C-N 115.493 -0.776 . . . . 8.1400000000000006 111.901 -178.413 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -59.5 -41.43 89.89 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 127.428 2.955 . . . . 19.48 110.875 176.389 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.827 ' HB2' ' O ' ' A' ' 204' ' ' HOH 0.26 20.1 t-20 -67.53 -40.81 85.04 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-O 115.928 -1.987 . . . . 17.239999999999998 112.619 -179.761 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.486 ' HB3' HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -59.74 -49.16 78.81 Favored 'General case' 0 C--N 1.283 -2.326 0 O-C-N 127.323 2.889 . . . . 12.369999999999999 112.054 172.456 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.9 -44.88 91.3 Favored 'General case' 0 C--O 1.198 -1.624 0 O-C-N 124.691 1.244 . . . . 10.460000000000001 111.507 178.533 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.757 ' CE ' ' O ' ' A' ' 167' ' ' HOH . 0.0 OUTLIER -51.83 -46.82 64.48 Favored 'General case' 0 N--CA 1.504 2.244 0 CA-C-O 126.449 3.024 . . . . 16.43 109.849 179.858 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 67.6 tt0 -59.19 -29.78 67.72 Favored 'General case' 0 C--O 1.284 2.893 0 CA-C-N 113.207 -1.815 . . . . 17.050000000000001 112.368 -179.589 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -89.26 -11.59 43.12 Favored 'General case' 0 C--N 1.305 -1.349 0 C-N-CA 126.801 2.04 . . . . 12.619999999999999 110.571 -179.202 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' GLY . . . . . 0.564 ' O ' ' HG3' ' A' ' 4' ' ' LYS . . . 100.12 12.46 39.45 Favored Glycine 0 C--O 1.203 -1.784 0 CA-C-O 117.291 -1.838 . . . . 9.4399999999999995 114.09 179.922 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -104.55 99.44 9.12 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 115.539 -2.172 . . . . 11.19 105.357 -178.968 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.652 ' HA ' ' HE2' ' A' ' 26' ' ' LYS . 53.1 m-80 -97.49 -8.13 29.92 Favored 'General case' 0 N--CA 1.452 -0.345 1 O-C-N 129.113 4.008 . . . . 13.09 114.738 -177.073 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.682 ' HB2' ' O ' ' A' ' 138' ' ' HOH 0.354 0.3 OUTLIER -89.19 79.39 7.15 Favored 'General case' 0 C--N 1.268 -2.961 1 CA-C-O 109.979 -4.82 . . . . 21.27 113.82 -175.603 . . . . . . . . 5 4 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 84.9 t -128.05 138.55 54.38 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.128 1 O-C-N 134.354 7.284 . . . . 13.720000000000001 111.356 -173.271 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -121.04 160.04 24.43 Favored 'General case' 0 C--O 1.263 1.764 0 N-CA-C 104.697 -2.335 . . . . 27.710000000000001 104.697 172.86 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.716 ' OE1' ' NH2' ' A' ' 19' ' ' ARG . 58.9 mt-10 -127.41 152.22 47.8 Favored 'General case' 0 C--N 1.297 -1.7 0 O-C-N 125.459 1.724 . . . . 15.470000000000001 112.14 -174.693 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -149.16 149.26 30.72 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 104.887 -2.264 . . . . 9.9399999999999995 104.887 179.508 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 76.5 mt-10 -88.77 -24.7 22.58 Favored 'General case' 0 N--CA 1.426 -1.662 0 O-C-N 127.078 2.736 . . . . 24.699999999999999 118.369 -173.337 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 20.0 p30 -165.28 178.86 6.61 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-O 116.76 -1.591 . . . . 13.93 108.259 -178.553 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -57.04 -44.2 93.02 Favored Glycine 0 N--CA 1.429 -1.817 0 O-C-N 124.844 1.34 . . . . 9.5500000000000007 115.551 -178.444 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . 0.362 2.0 m -70.65 -38.39 73.04 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 C-N-CA 118.22 -1.392 . . . . 13.93 111.62 -177.482 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ASP . . . . . 0.475 ' O ' ' HG2' ' A' ' 45' ' ' LYS . 25.1 t0 -58.56 -45.78 88.26 Favored 'General case' 0 N--CA 1.45 -0.454 0 O-C-N 120.234 -1.541 . . . . 12.210000000000001 108.418 175.51 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -59.3 -45.12 92.16 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 114.758 1.392 . . . . 9.5399999999999991 114.758 178.108 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 77.0 mt -62.99 -35.12 79.15 Favored 'General case' 0 C--O 1.252 1.202 0 C-N-CA 125.42 1.488 . . . . 13.050000000000001 112.151 179.592 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -62.16 -47.68 83.44 Favored 'General case' 0 C--N 1.31 -1.146 0 O-C-N 125.24 1.588 . . . . 18.140000000000001 108.078 177.498 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.475 ' HG2' ' O ' ' A' ' 41' ' ' ASP . 4.6 mmtt -70.39 -39.31 74.61 Favored 'General case' 0 CA--C 1.507 -0.705 0 CA-C-O 116.422 -1.751 . . . . 23.719999999999999 110.026 -178.348 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 44.9 mt -65.14 -15.63 62.62 Favored 'General case' 0 C--N 1.306 -1.323 0 O-C-N 124.334 1.021 . . . . 21.120000000000001 112.013 -175.499 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.4 mm100 -65.97 -39.56 90.49 Favored 'General case' 0 C--N 1.298 -1.643 0 C-N-CA 126.633 1.973 . . . . 29.07 111.435 -179.027 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.43 -15.33 62.5 Favored 'General case' 0 C--O 1.246 0.906 0 O-C-N 127.143 2.777 . . . . 26.629999999999999 112.241 179.117 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 76.1 -179.8 47.26 Favored Glycine 0 C--N 1.311 -0.85 0 O-C-N 119.561 -1.962 . . . . 23.390000000000001 117.325 177.68 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 73.13 9.48 76.64 Favored Glycine 0 N--CA 1.434 -1.494 0 C-N-CA 129.512 3.434 . . . . 18.460000000000001 116.854 179.443 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 60.4 m-85 -70.64 146.85 49.74 Favored 'General case' 0 C--O 1.262 1.726 0 CA-C-N 118.966 1.383 . . . . 14.25 110.563 176.111 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -115.91 -15.85 7.13 Favored Glycine 0 C--O 1.21 -1.373 0 N-CA-C 117.884 1.914 . . . . 10.84 117.884 177.784 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -166.76 136.68 3.07 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 108.358 -0.979 . . . . 9.5600000000000005 108.358 -169.416 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.751 HD13 HD13 ' A' ' 72' ' ' ILE . 7.7 mt -120.64 135.21 61.58 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.136 0 N-CA-C 106.845 -1.539 . . . . 10.15 106.845 -178.973 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 92.9 mt -117.56 111.89 36.54 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.166 0 O-C-N 128.198 3.436 . . . . 7.4400000000000004 104.142 172.791 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 32.1 t -123.59 141.41 52.03 Favored 'General case' 0 C--O 1.196 -1.726 0 O-C-N 125.032 1.458 . . . . 10.880000000000001 113.156 -175.593 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -77.22 143.92 38.63 Favored 'General case' 0 N--CA 1.485 1.319 0 N-CA-C 105.896 -1.89 . . . . 13.94 105.896 176.519 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 69.1 t-105 -70.39 -47.56 60.3 Favored 'General case' 0 C--N 1.294 -1.842 0 O-C-N 120.453 -1.404 . . . . 13.859999999999999 110.963 176.46 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 31.3 t30 -97.01 100.01 11.52 Favored 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 114.022 1.119 . . . . 16.690000000000001 114.022 -174.045 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 72.6 mtm -141.15 148.41 51.45 Favored Pre-proline 0 N--CA 1.487 1.375 0 CA-C-O 115.845 -2.026 . . . . 9.3399999999999999 106.516 -178.442 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -76.28 163.41 32.57 Favored 'Trans proline' 0 C--N 1.308 -1.556 0 O-C-N 126.166 2.666 . . . . 8.8200000000000003 110.333 177.321 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 51.1 m-20 71.9 -59.45 0.55 Allowed 'General case' 0 C--N 1.294 -1.806 0 C-N-CA 127.099 2.159 . . . . 10.65 113.142 176.292 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 45.4 ttm -140.66 112.51 7.61 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-O 115.435 -2.221 . . . . 15.609999999999999 106.279 177.061 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.417 ' OD1' ' HG3' ' A' ' 67' ' ' GLU . 35.9 p30 -82.01 -178.87 7.18 Favored 'General case' 0 N--CA 1.516 2.842 1 O-C-N 129.324 4.14 . . . . 11.74 110.295 -176.146 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -61.87 -41.94 99.69 Favored Glycine 0 C--N 1.361 1.931 0 CA-C-O 116.687 -2.174 . . . . 8.1999999999999993 111.864 -178.455 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.46 ' HG ' ' HE3' ' A' ' 70' ' ' LYS . 47.5 tp -62.1 -41.27 98.04 Favored 'General case' 0 C--O 1.247 0.93 0 O-C-N 127.243 2.378 . . . . 9.0999999999999996 111.656 -178.133 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.656 ' HG3' ' O ' ' A' ' 217' ' ' HOH . 48.5 mt-10 -67.05 -42.33 84.97 Favored 'General case' 0 N--CA 1.476 0.866 0 O-C-N 125.16 1.537 . . . . 19.489999999999998 111.491 179.883 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 17.1 tp -61.58 -47.96 83.13 Favored 'General case' 0 C--O 1.246 0.904 0 C-N-CA 119.983 -0.687 . . . . 8.3300000000000001 109.677 179.733 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 38.5 tp -54.56 -49.64 69.84 Favored 'General case' 0 N--CA 1.516 2.847 0 CA-C-N 113.536 -1.665 . . . . 7.0499999999999998 111.245 177.225 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.46 ' HE3' ' HG ' ' A' ' 66' ' ' LEU . 38.3 mttt -61.14 -37.72 83.84 Favored 'General case' 0 C--N 1.281 -2.405 0 CA-C-N 119.559 1.072 . . . . 15.59 112.335 178.117 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 22.2 m -67.57 -40.8 84.89 Favored 'General case' 0 C--N 1.313 -1.013 0 O-C-N 121.288 -0.882 . . . . 11.279999999999999 111.607 176.692 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.751 HD13 HD13 ' A' ' 54' ' ' ILE . 69.0 mt -64.01 -43.92 97.71 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 CA-C-N 115.868 -0.605 . . . . 10.369999999999999 110.267 177.866 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 77.8 mmt-85 -65.64 -32.62 74.29 Favored 'General case' 0 C--N 1.289 -2.025 0 C-N-CA 124.784 1.234 . . . . 12.789999999999999 110.142 -176.354 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -81.86 -14.15 56.64 Favored 'General case' 0 C--O 1.255 1.356 0 CA-C-O 115.696 -2.097 . . . . 17.77 111.04 -177.905 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -95.27 121.5 36.99 Favored 'General case' 0 C--N 1.287 -2.11 0 CA-C-O 125.002 2.334 . . . . 22.559999999999999 108.931 -175.72 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -52.44 -40.71 62.55 Favored 'General case' 0 C--N 1.294 -1.835 0 CA-C-O 113.594 -3.098 . . . . 24.920000000000002 110.205 -178.266 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -80.19 -25.18 39.84 Favored 'General case' 0 C--N 1.307 -1.251 0 O-C-N 126.855 2.597 . . . . 21.129999999999999 114.884 -177.283 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' MET . . . . . 0.409 ' HB3' HD22 ' A' ' 81' ' ' LEU . 39.4 mtm -117.63 -0.25 11.89 Favored 'General case' 0 C--N 1.295 -1.765 0 N-CA-C 115.808 1.781 . . . . 26.039999999999999 115.808 179.642 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . 0.313 46.1 p -57.0 -18.87 15.36 Favored 'General case' 0 C--O 1.261 1.667 0 CA-C-O 113.608 -3.091 . . . . 17.77 116.273 -169.741 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -96.58 -8.04 32.86 Favored 'General case' 0 C--N 1.294 -1.834 0 CA-C-N 121.303 1.865 . . . . 13.779999999999999 111.24 -177.394 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.409 HD22 ' HB3' ' A' ' 78' ' ' MET . 0.0 OUTLIER -56.39 134.13 76.4 Favored Pre-proline 0 N--CA 1.481 1.121 0 C-N-CA 119.322 -0.951 . . . . 16.120000000000001 110.671 -175.08 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 13.8 Cg_exo -64.51 136.16 49.1 Favored 'Trans proline' 0 C--N 1.307 -1.648 0 O-C-N 125.165 2.139 . . . . 11.210000000000001 109.738 174.779 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 99.0 t -128.75 116.31 40.63 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.412 0 O-C-N 127.214 2.822 . . . . 8.2100000000000009 109.997 178.429 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 39.2 tp -100.88 117.82 35.7 Favored 'General case' 0 C--N 1.303 -1.426 0 CA-C-O 115.664 -2.112 . . . . 8.4600000000000009 108.559 177.023 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 2.4 tpp -85.73 140.57 30.38 Favored 'General case' 0 C--N 1.297 -1.691 0 O-C-N 126.609 2.443 . . . . 18.210000000000001 110.13 179.999 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 60.8 t -116.74 129.18 73.67 Favored 'Isoleucine or valine' 0 C--N 1.265 -3.091 0 C-N-CA 128.457 2.703 . . . . 9.7599999999999998 110.017 177.691 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 7.0 t -136.36 155.8 49.53 Favored 'General case' 0 N--CA 1.484 1.24 0 CA-C-O 118.275 -0.869 . . . . 13.74 109.975 178.553 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.637 ' HB2' ' NZ ' ' A' ' 109' ' ' LYS . . . -86.34 -11.74 51.27 Favored 'General case' 0 C--N 1.297 -1.716 0 N-CA-C 106.91 -1.515 . . . . 15.529999999999999 106.91 178.439 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.484 ' OE1' ' O ' ' A' ' 203' ' ' HOH . 9.9 tt0 -161.75 116.43 1.96 Allowed 'General case' 0 N--CA 1.499 1.982 0 C-N-CA 116.706 -1.998 . . . . 28.739999999999998 110.735 -176.224 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.458 ' HA ' ' O ' ' A' ' 177' ' ' HOH . . . -66.35 124.25 22.19 Favored 'General case' 0 C--O 1.261 1.665 0 C-N-CA 127.462 2.305 . . . . 19.18 110.138 -178.276 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.528 ' HE3' ' O ' ' A' ' 189' ' ' HOH . 7.8 mtmm -131.69 130.3 41.83 Favored 'General case' 0 C--N 1.314 -0.936 0 O-C-N 126.92 2.637 . . . . 22.68 103.939 177.879 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' LYS . . . . . 1.302 ' HD2' ' O ' ' A' ' 205' ' ' HOH . 0.0 OUTLIER -43.6 -50.88 7.21 Favored 'General case' 0 C--O 1.25 1.113 1 O-C-N 129.531 4.269 . . . . 19.32 113.186 178.536 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.527 ' N ' ' HG3' ' A' ' 92' ' ' LYS . 0.9 OUTLIER -70.48 -29.38 65.9 Favored 'General case' 0 N--CA 1.491 1.598 0 CA-C-N 121.525 1.966 . . . . 21.010000000000002 113.36 -176.743 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -66.59 -47.97 71.05 Favored 'General case' 0 CA--C 1.564 1.507 0 O-C-N 119.411 -2.056 . . . . 12.68 109.01 178.76 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 60.3 mt -60.81 -46.14 96.71 Favored 'Isoleucine or valine' 0 C--O 1.265 1.911 0 O-C-N 128.361 3.538 . . . . 12.09 109.59 177.513 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.657 ' CG1' ' O ' ' A' ' 205' ' ' HOH . 14.4 mm -65.68 -45.56 91.71 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.867 0 O-C-N 125.996 2.06 . . . . 15.31 108.821 178.446 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -59.52 -42.63 92.72 Favored 'General case' 0 C--N 1.285 -2.209 0 CA-C-N 120.542 1.519 . . . . 9.2400000000000002 112.082 -177.842 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -66.17 -46.64 76.66 Favored 'General case' 0 C--O 1.208 -1.113 0 CA-C-O 115.402 -2.237 . . . . 8.7100000000000009 111.605 178.54 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -56.75 -51.02 70.49 Favored 'General case' 0 C--N 1.311 -1.093 0 O-C-N 127.598 3.061 . . . . 11.5 111.36 179.964 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -58.4 -34.33 70.64 Favored 'General case' 0 C--N 1.313 -1.004 0 C-N-CA 125.452 1.501 . . . . 24.52 113.081 174.679 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -82.31 -2.37 52.54 Favored 'General case' 0 C--N 1.292 -1.894 0 CA-C-O 116.336 -1.792 . . . . 11.300000000000001 113.69 175.524 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 101.87 12.38 34.78 Favored Glycine 0 C--O 1.26 1.742 0 CA-C-O 116.516 -2.269 . . . . 9.1300000000000008 118.262 178.333 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.79 142.36 50.47 Favored 'General case' 0 N--CA 1.499 2.018 0 CA-C-N 121.118 2.459 . . . . 7.2400000000000002 109.929 179.926 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 4.6 m -83.06 -26.72 30.85 Favored 'General case' 0 C--O 1.255 1.378 0 CA-C-N 119.842 1.201 . . . . 9.2599999999999998 111.045 -179.323 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -170.87 177.36 43.94 Favored Glycine 0 CA--C 1.544 1.849 0 C-N-CA 125.125 1.345 . . . . 9.7400000000000002 110.43 177.772 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' TYR . . . . . 1.086 ' O ' ' HD1' ' A' ' 106' ' ' TYR 0.266 0.0 OUTLIER -136.07 142.75 44.38 Favored 'General case' 0 C--N 1.299 -1.6 0 C-N-CA 129.142 2.977 . . . . 23.440000000000001 109.653 -179.993 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 3.9 p -139.67 136.16 39.57 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.289 1 O-C-N 116.28 -4.013 . . . . 14.859999999999999 110.094 175.498 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 55.3 t -95.4 132.57 39.13 Favored 'Isoleucine or valine' 0 C--O 1.256 1.444 0 N-CA-C 108.285 -1.005 . . . . 11.550000000000001 108.285 178.46 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' LYS . . . . . 0.637 ' NZ ' ' HB2' ' A' ' 88' ' ' ALA . 11.7 pttm -93.72 149.19 36.71 Favored Pre-proline 0 C--N 1.266 -3.059 0 N-CA-C 108.83 -0.804 . . . . 22.34 108.83 179.227 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_endo -79.15 152.43 88.25 Favored 'Cis proline' 0 N--CA 1.433 -2.08 0 CA-C-O 116.747 -1.439 . . . . 9.9199999999999999 110.163 2.963 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 17.7 p90 -138.06 156.41 47.82 Favored 'General case' 0 C--O 1.267 1.984 0 O-C-N 127.301 2.875 . . . . 11.49 108.182 -178.725 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 30.9 p -96.74 172.68 7.74 Favored 'General case' 0 C--N 1.276 -2.611 0 O-C-N 127.707 3.13 . . . . 9.6300000000000008 108.53 179.594 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -58.65 -42.04 87.45 Favored 'General case' 0 C--N 1.363 1.181 0 CA-C-N 112.313 -2.221 . . . . 10.73 114.079 172.364 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -59.01 -42.42 90.05 Favored 'General case' 0 C--O 1.213 -0.816 0 O-C-N 121.062 -1.024 . . . . 9.9399999999999995 112.011 177.154 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 65.9 m -68.36 -46.41 70.19 Favored 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 106.023 -1.844 . . . . 10.81 106.023 -178.086 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.486 HD12 ' HB3' ' A' ' 24' ' ' LEU . 0.1 OUTLIER -57.53 -46.85 83.36 Favored 'General case' 0 N--CA 1.502 2.172 0 CA-C-O 123.603 1.668 . . . . 11.460000000000001 109.532 -176.952 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -54.64 -47.78 73.09 Favored 'General case' 0 C--O 1.241 0.633 0 O-C-N 120.618 -1.302 . . . . 19.760000000000002 111.216 -179.307 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -61.7 -41.52 97.72 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 125.122 1.514 . . . . 28.120000000000001 110.057 178.921 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.717 ' CE ' ' O ' ' A' ' 184' ' ' HOH . 27.9 mmtt -64.68 -43.28 94.06 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-N 119.275 0.943 . . . . 20.550000000000001 109.671 178.356 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' LEU . . . . . 0.452 ' HG ' ' O ' ' A' ' 116' ' ' LEU . 20.3 mt -59.02 -53.2 61.07 Favored 'General case' 0 C--O 1.242 0.68 0 CA-C-N 115.345 -0.843 . . . . 13.140000000000001 111.554 179.785 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -59.2 -41.57 88.86 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 115.164 -0.925 . . . . 17.629999999999999 111.267 179.529 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.42 -46.58 80.17 Favored 'General case' 0 C--N 1.266 -3.033 0 O-C-N 118.95 -2.344 . . . . 27.09 109.957 177.99 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 37.7 mt -69.96 -47.59 68.14 Favored 'Isoleucine or valine' 0 C--O 1.266 1.935 0 O-C-N 121.271 -0.893 . . . . 15.99 110.009 178.976 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' PHE . . . . . . . . . . . . . 21.8 m-85 -55.85 -42.5 75.92 Favored 'General case' 0 CA--C 1.563 1.467 0 N-CA-C 106.33 -1.73 . . . . 17.100000000000001 106.33 179.689 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -64.96 -46.07 83.08 Favored 'General case' 0 C--O 1.281 2.724 0 CA-C-O 123.597 1.665 . . . . 26.02 113.181 178.508 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 30.9 ttpt -63.51 -33.35 75.39 Favored 'General case' 0 C--O 1.261 1.707 0 CA-C-N 114.296 -1.32 . . . . 20.66 112.043 179.362 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 8.2 mp -97.49 2.31 50.07 Favored 'General case' 0 C--O 1.207 -1.174 0 N-CA-C 113.491 0.923 . . . . 22.600000000000001 113.491 -178.104 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 58.19 48.69 81.67 Favored Glycine 0 N--CA 1.49 2.289 0 CA-C-O 118.147 -1.363 . . . . 24.550000000000001 111.901 -178.351 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 95.6 mtp . . . . . 0 C--O 1.288 3.101 1 CA-C-O 110.517 -4.563 . . . . 29.969999999999999 111.479 176.716 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' HOH . . . . . 0.457 ' O ' ' HD1' ' A' ' 14' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 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 . . . . . 0.682 ' O ' ' HB2' ' A' ' 32' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' 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 ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' 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 ' 155' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 158' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 159' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 160' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 161' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 162' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 163' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 164' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 165' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 166' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 167' ' ' HOH . . . . . 0.757 ' O ' ' CE ' ' A' ' 26' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 168' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 169' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 170' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 171' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 172' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 173' ' ' 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 ' 176' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 177' ' ' HOH . . . . . 0.458 ' O ' ' HA ' ' A' ' 90' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 178' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 179' ' ' 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 . . . . . 0.717 ' O ' ' CE ' ' A' ' 119' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 185' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 186' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 187' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 188' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 189' ' ' HOH . . . . . 0.528 ' O ' ' HE3' ' A' ' 91' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 190' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 191' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 192' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 193' ' ' HOH . . . . . 0.407 ' O ' ' HB3' ' A' ' 92' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 194' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 195' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 ' 200' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' HOH . . . . . 0.484 ' O ' ' OE1' ' A' ' 89' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' HOH . . . . . 0.827 ' O ' ' HB2' ' A' ' 23' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' HOH . . . . . 1.302 ' O ' ' HD2' ' A' ' 92' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 217' ' ' HOH . . . . . 0.656 ' O ' ' HG3' ' A' ' 67' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 224' ' ' HOH . . . . . 0.614 ' O ' ' HE3' ' A' ' 109' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_