data_3m8v_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 3m8v _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 ' 4' ' ' ARG . . . . . 0.427 ' CA ' ' NE ' ' A' ' 4' ' ' ARG . 1.7 tpm_? . . . . . 0 CA--C 1.551 1.0 0 N-CA-C 112.802 0.667 . . . . 150.37 112.802 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 13.2 pttt -154.66 155.1 34.04 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 113.492 0.923 . . . . 68.5 113.492 -176.894 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 43.9 mt -108.77 134.86 50.9 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-O 121.496 0.665 . . . . 58.52 112.545 175.321 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 45.6 mm -111.68 133.59 56.82 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.566 0 CA-C-N 115.329 -0.85 . . . . 57.86 112.031 -179.896 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 28.4 m -125.18 140.97 52.39 Favored 'General case' 0 CA--C 1.506 -0.721 0 N-CA-C 107.224 -1.398 . . . . 58.92 107.224 171.491 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -135.8 142.57 44.89 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 109.206 -0.664 . . . . 57.72 109.206 174.73 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 97.2 m -120.74 132.21 54.93 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-N 116.058 -0.519 . . . . 50.96 110.562 174.744 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 57.2 t0 -94.14 95.62 9.1 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 108.651 -0.87 . . . . 57.2 108.651 177.555 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -55.84 -32.22 31.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 N-CA-C 113.199 0.814 . . . . 80.51 113.199 -178.614 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -91.79 -0.86 57.56 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 113.851 1.056 . . . . 93.93 113.851 -177.362 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 70.5 t80 -57.99 -58.59 7.76 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 119.981 -0.688 . . . . 53.14 112.529 -172.191 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 27.9 m -46.63 -50.7 17.2 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 114.083 1.142 . . . . 71.96 114.083 -178.657 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -59.1 -42.14 96.91 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 116.065 1.186 . . . . 61.09 116.065 176.639 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 11.0 t -71.91 -44.89 62.93 Favored 'General case' 0 C--N 1.328 -0.363 0 O-C-N 121.949 -0.736 . . . . 58.37 109.617 -177.812 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 35.6 tp -51.9 -58.58 6.05 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.025 -0.534 . . . . 48.31 111.586 175.343 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 17.7 mt -54.43 -44.13 72.19 Favored 'General case' 0 CA--C 1.508 -0.657 0 CA-C-N 115.74 -0.664 . . . . 49.77 112.109 -179.198 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 21.7 t30 -64.4 -42.68 95.97 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.755 0.65 . . . . 55.6 112.755 178.714 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 66.1 m -60.75 -37.96 83.56 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 119.549 -0.86 . . . . 51.62 109.967 173.811 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 62.1 mt -69.46 -37.5 77.34 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 121.394 0.616 . . . . 52.82 110.887 -177.293 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 57.5 t30 -66.66 -43.12 85.4 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.594 -0.73 . . . . 54.77 110.793 178.68 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -59.17 -42.88 91.84 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.306 0.484 . . . . 88.47 112.306 172.491 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 82.0 mt-30 -53.86 -46.68 71.36 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.105 0.479 . . . . 60.76 110.818 176.508 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ARG . . . . . 0.807 ' NH1' ' O ' ' A' ' 142' ' ' HOH . 5.9 ptt180 -75.48 -18.32 59.87 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 119.074 -1.051 . . . . 54.27 111.489 -174.928 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -70.74 -26.22 74.41 Favored Glycine 0 N--CA 1.452 -0.273 0 N-CA-C 109.299 -1.52 . . . . 64.68 109.299 177.648 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 88.1 m-70 -110.48 2.98 19.2 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 113.037 0.755 . . . . 85.67 113.037 179.005 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 76.59 6.95 85.32 Favored Glycine 0 C--N 1.333 0.409 0 N-CA-C 113.918 0.327 . . . . 48.58 113.918 178.843 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.81 122.2 13.61 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-O 120.875 0.369 . . . . 69.21 111.564 -179.372 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 60.0 m-85 67.55 2.97 3.16 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 123.935 0.894 . . . . 56.06 113.305 176.591 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 84.9 m -70.16 127.95 34.58 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.268 0.556 . . . . 58.33 111.621 -178.611 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 28.5 p-10 -119.18 13.06 12.8 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.845 -0.616 . . . . 52.84 112.441 -175.2 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 9.1 p -148.13 152.03 12.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 C-N-CA 119.077 -1.049 . . . . 52.18 110.554 173.085 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 56.9 m -122.64 126.08 46.92 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.291 -1.003 . . . . 50.31 108.291 175.051 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 34.0 t -107.25 126.87 63.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.2 0.524 . . . . 53.57 111.036 176.121 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 76.5 mt -108.12 114.18 45.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.543 -0.753 . . . . 55.41 111.49 -176.949 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 19.4 t -124.79 132.8 70.84 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.64 0 CA-C-N 115.83 -0.623 . . . . 57.89 109.384 179.989 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 81.9 mt-10 45.64 -123.13 1.12 Allowed 'General case' 0 CA--C 1.515 -0.401 0 N-CA-C 103.799 -2.667 . . . . 68.97 103.799 -163.223 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -115.4 15.01 16.84 Favored 'General case' 0 C--N 1.316 -0.848 0 C-N-CA 113.003 -3.479 . . . . 91.74 113.984 177.062 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 7.8 tpt85 -86.26 142.71 28.36 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 114.301 -1.318 . . . . 119.8 108.278 179.345 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -114.33 125.08 53.47 Favored 'General case' 0 CA--C 1.51 -0.559 0 CA-C-O 119.556 -0.259 . . . . 93.96 110.442 -179.239 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 39.7 m-85 -108.66 123.88 49.65 Favored 'General case' 0 N--CA 1.452 -0.363 0 O-C-N 123.369 0.418 . . . . 54.08 110.051 174.861 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 32.8 mtm180 -87.65 142.28 27.96 Favored 'General case' 0 C--O 1.222 -0.355 0 N-CA-C 108.543 -0.91 . . . . 100.35 108.543 173.411 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -161.2 -179.07 7.15 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 114.64 1.348 . . . . 54.49 114.64 -176.282 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 29.9 m80 -109.49 119.31 39.05 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.574 -0.739 . . . . 51.91 112.744 178.988 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -51.94 -36.99 51.09 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 114.899 1.444 . . . . 57.92 114.899 176.802 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 48.7 p-10 -65.39 -35.89 82.3 Favored 'General case' 0 CA--C 1.517 -0.296 0 C-N-CA 119.609 -0.836 . . . . 48.81 111.238 -177.161 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 23.0 mm -73.27 -47.01 48.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.963 -0.562 . . . . 45.49 111.62 178.23 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 26.5 mt -69.72 -39.74 76.65 Favored 'General case' 0 C--O 1.241 0.635 0 C-N-CA 120.548 -0.461 . . . . 45.95 111.679 -176.916 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 40.2 t -57.12 -46.43 82.64 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 120.137 -0.625 . . . . 55.9 111.424 173.871 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.08 -30.29 71.36 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.322 -0.399 . . . . 50.12 112.023 -174.709 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 71.4 m -111.39 -14.34 13.77 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.665 -0.698 . . . . 46.54 112.641 -164.603 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.8 t -130.42 125.41 34.44 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 116.105 -0.498 . . . . 41.15 111.866 -178.162 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 21.4 p -70.31 -27.97 64.81 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 119.467 -0.893 . . . . 57.9 110.647 -178.522 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 73.3 t80 -71.25 -50.89 28.13 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 120.071 -0.652 . . . . 67.16 110.223 -179.356 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 25.2 m-85 -62.59 -30.91 71.68 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 113.294 0.85 . . . . 43.57 113.294 173.192 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 64.4 t-80 -58.03 -45.74 86.47 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.858 0.837 . . . . 53.51 109.517 175.681 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -59.74 -53.37 58.81 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 114.37 -1.286 . . . . 128.47 112.226 177.572 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.23 -45.46 83.86 Favored 'General case' 0 C--O 1.238 0.448 0 N-CA-C 113.286 0.847 . . . . 56.1 113.286 -177.876 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 22.1 m-30 -87.09 5.67 36.51 Favored 'General case' 0 CA--C 1.518 -0.266 0 N-CA-C 113.707 1.003 . . . . 63.92 113.707 -165.525 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 79.4 p -82.74 5.59 20.86 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.335 0.588 . . . . 69.6 109.804 170.95 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 26.2 m -141.77 164.98 18.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.039 -0.528 . . . . 73.89 109.737 175.963 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.29 146.48 19.11 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 115.897 -0.592 . . . . 84.1 111.683 178.556 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 156.74 121.84 0.71 Allowed Glycine 0 N--CA 1.447 -0.628 0 N-CA-C 111.098 -0.801 . . . . 73.32 111.098 -177.025 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' GLN . . . . . 0.511 ' NE2' ' O ' ' A' ' 136' ' ' HOH . 94.0 mm-40 -109.77 -11.5 14.71 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 123.026 0.53 . . . . 151.24 110.631 -179.544 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 69.0 t -136.03 131.92 49.83 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.358 0 CA-C-N 116.082 -0.508 . . . . 71.6 111.056 179.354 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 1.1 m -125.69 134.3 67.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 C-N-CA 119.736 -0.786 . . . . 56.75 111.894 171.667 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' GLU . . . . . 0.765 ' O ' ' O ' ' A' ' 127' ' ' HOH . 0.0 OUTLIER -106.97 120.33 41.78 Favored 'General case' 0 N--CA 1.438 -1.035 0 CA-C-N 115.341 -0.845 . . . . 89.22 109.277 -178.661 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 84.8 mt -104.24 146.41 28.83 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 114.305 1.224 . . . . 60.18 114.305 177.433 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 52.3 p -124.41 169.97 11.31 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.659 -0.701 . . . . 52.07 109.763 176.147 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 24.8 m-85 74.12 3.67 4.43 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 113.483 0.92 . . . . 60.0 113.483 173.965 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 8.0 mt -134.86 129.47 51.42 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.362 0 N-CA-C 110.008 -0.367 . . . . 50.17 110.008 -178.628 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 36.2 mtm105 -76.21 149.67 37.2 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.273 0.559 . . . . 80.22 111.392 179.851 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -54.32 -50.93 66.21 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 112.643 0.609 . . . . 56.09 112.643 -178.343 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -62.82 -30.42 71.47 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 120.275 -0.57 . . . . 77.36 111.542 -174.983 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 30.9 mm -68.85 -48.76 68.99 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.434 0 CA-C-N 116.114 -0.494 . . . . 57.99 109.822 175.93 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 75.5 t80 -59.96 -42.38 93.96 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 120.537 -0.465 . . . . 56.02 111.203 177.625 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -47.3 -42.82 21.8 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 112.179 0.437 . . . . 49.12 112.179 174.623 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.21 -45.15 89.53 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 123.502 0.721 . . . . 76.74 112.864 177.085 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 5.4 mm -56.84 -40.48 71.49 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.369 0 N-CA-C 109.257 -0.645 . . . . 62.51 109.257 177.575 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 6.2 mt -67.49 -47.76 69.09 Favored 'General case' 0 CA--C 1.506 -0.736 0 C-N-CA 119.21 -0.996 . . . . 51.28 110.613 178.648 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -51.49 -39.15 56.99 Favored 'General case' 0 CA--C 1.508 -0.636 0 C-N-CA 119.264 -0.974 . . . . 50.09 109.842 -177.987 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 17.7 t80 -67.86 -53.74 24.32 Favored 'General case' 0 CA--C 1.508 -0.669 0 CA-C-O 121.671 0.748 . . . . 44.69 109.051 178.213 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 28.0 mt -48.94 -31.65 4.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 C-N-CA 119.553 -0.859 . . . . 49.41 110.84 179.294 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 52.8 m-85 -103.04 12.4 36.02 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 115.573 1.694 . . . . 45.25 115.573 -179.487 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' SER . . . . . 0.423 ' O ' ' OG ' ' A' ' 88' ' ' SER . 54.6 p -147.34 -20.2 0.39 Allowed 'General case' 0 CA--C 1.512 -0.502 0 N-CA-C 113.799 1.037 . . . . 53.02 113.799 178.155 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' SER . . . . . 0.423 ' OG ' ' O ' ' A' ' 87' ' ' SER . 6.8 p 79.02 4.98 2.33 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 111.918 0.34 . . . . 51.23 111.918 -174.115 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 67.7 mttt -132.24 145.94 51.67 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 112.141 0.423 . . . . 82.62 112.141 -176.69 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 34.9 pt -106.82 140.24 25.62 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.681 0 N-CA-C 103.566 -2.753 . . . . 50.18 103.566 158.584 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 48.3 t -128.59 119.16 49.39 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 C-N-CA 120.463 -0.495 . . . . 66.54 110.574 -168.388 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 44.6 mtm105 47.91 45.6 18.85 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 113.908 1.077 . . . . 131.82 113.908 177.473 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 93.1 t -70.87 136.47 25.85 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.813 0 CA-C-N 115.347 -0.842 . . . . 59.09 110.493 170.015 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 5.5 ptm180 -76.48 138.32 40.21 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 113.106 0.78 . . . . 109.57 113.106 -179.775 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 65.1 p -55.69 -26.67 46.17 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 116.459 2.022 . . . . 89.12 116.459 -164.621 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 4.2 p30 -80.71 -33.45 35.3 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 119.173 -1.011 . . . . 84.69 112.647 -178.423 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 30.6 mt -67.15 -9.64 42.0 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-O 121.366 0.603 . . . . 70.43 111.605 177.433 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 11.1 tp -65.69 -49.96 66.64 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.75 -0.659 . . . . 64.32 111.988 -172.789 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -56.96 -37.99 72.35 Favored 'General case' 0 N--CA 1.444 -0.726 0 N-CA-C 108.771 -0.826 . . . . 110.8 108.771 -176.052 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -69.98 -42.65 72.84 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 114.773 -1.103 . . . . 64.11 111.041 -179.25 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 56.9 tp -60.47 -47.48 85.94 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 115.631 -0.713 . . . . 52.32 110.211 176.888 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 54.8 mt -52.01 -40.42 28.88 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 CA-C-N 116.284 -0.416 . . . . 50.11 111.112 176.937 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 32.4 mttp -71.59 -34.76 70.16 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 112.476 0.547 . . . . 80.22 112.476 -175.056 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 21.9 p -74.29 -34.36 63.5 Favored 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 107.878 -1.156 . . . . 64.67 107.878 -178.567 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -59.89 -39.92 96.14 Favored Glycine 0 N--CA 1.447 -0.632 0 N-CA-C 111.023 -0.831 . . . . 49.13 111.023 170.244 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 33.0 mt-30 -64.34 -48.21 76.45 Favored 'General case' 0 C--N 1.329 -0.299 0 O-C-N 122.473 -0.427 . . . . 70.82 111.477 175.492 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 86.1 mt -60.11 -38.4 82.89 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 113.099 0.778 . . . . 52.09 113.099 179.971 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 34.2 mt -91.76 -12.61 33.38 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 112.834 0.679 . . . . 49.3 112.834 -174.699 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 74.97 42.53 29.65 Favored Glycine 0 C--N 1.331 0.284 0 O-C-N 123.408 0.442 . . . . 44.42 112.121 177.094 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 15.8 t -102.04 92.03 2.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 N-CA-C 107.169 -1.419 . . . . 45.86 107.169 174.959 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 58.9 tttp -47.99 -40.96 24.04 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 114.853 1.427 . . . . 85.29 114.853 -166.144 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 87.6 t80 -69.43 -37.48 77.43 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.407 -0.361 . . . . 48.53 111.156 -173.379 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 32.5 mm -74.24 -46.21 45.06 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.111 0 O-C-N 123.675 0.61 . . . . 53.51 109.804 177.881 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -50.87 -32.46 20.48 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.502 0.556 . . . . 55.27 112.502 176.286 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -108.99 22.33 16.06 Favored 'General case' 0 CA--C 1.514 -0.426 0 N-CA-C 114.507 1.299 . . . . 72.91 114.507 -169.125 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 90.7 mt -65.42 -17.01 64.21 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 119.184 -1.006 . . . . 82.27 113.126 172.064 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.543 0 C-N-CA 121.31 -0.472 . . . . 86.85 112.545 173.236 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' HOH . . . . . 0.765 ' O ' ' O ' ' A' ' 69' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 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 . . . . . 0.511 ' O ' ' NE2' ' A' ' 66' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 . . . . . 0.807 ' O ' ' NH1' ' A' ' 26' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' ARG . . . . . 0.644 ' HA ' ' NE ' ' A' ' 4' ' ' ARG . 1.7 tpm_? . . . . . 0 CA--C 1.551 1.0 0 N-CA-C 112.802 0.667 . . . . 150.37 112.802 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 13.2 pttt -154.66 155.1 34.04 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 113.492 0.923 . . . . 68.5 113.492 -176.894 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 43.9 mt -108.77 134.86 50.9 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-O 121.496 0.665 . . . . 58.520000000000003 112.545 175.321 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 45.6 mm -111.68 133.59 56.82 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.566 0 CA-C-N 115.329 -0.85 . . . . 57.859999999999999 112.031 -179.896 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 28.4 m -125.18 140.97 52.39 Favored 'General case' 0 CA--C 1.506 -0.721 0 N-CA-C 107.224 -1.398 . . . . 58.920000000000002 107.224 171.491 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -135.8 142.57 44.89 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 109.206 -0.664 . . . . 57.719999999999999 109.206 174.73 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 97.2 m -120.74 132.21 54.93 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-N 116.058 -0.519 . . . . 50.960000000000001 110.562 174.744 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 57.2 t0 -94.14 95.62 9.1 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 108.651 -0.87 . . . . 57.200000000000003 108.651 177.555 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ILE . . . . . 0.444 HD12 ' HA ' ' A' ' 12' ' ' ILE . 0.2 OUTLIER -55.84 -32.22 31.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 N-CA-C 113.199 0.814 . . . . 80.510000000000005 113.199 -178.614 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -91.79 -0.86 57.56 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 113.851 1.056 . . . . 93.930000000000007 113.851 -177.362 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 70.5 t80 -57.99 -58.59 7.76 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 119.981 -0.688 . . . . 53.140000000000001 112.529 -172.191 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 27.9 m -46.63 -50.7 17.2 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 114.083 1.142 . . . . 71.959999999999994 114.083 -178.657 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -59.1 -42.14 96.91 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 116.065 1.186 . . . . 61.090000000000003 116.065 176.639 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 11.0 t -71.91 -44.89 62.93 Favored 'General case' 0 C--N 1.328 -0.363 0 O-C-N 121.949 -0.736 . . . . 58.369999999999997 109.617 -177.812 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 35.6 tp -51.9 -58.58 6.05 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.025 -0.534 . . . . 48.310000000000002 111.586 175.343 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 17.7 mt -54.43 -44.13 72.19 Favored 'General case' 0 CA--C 1.508 -0.657 0 CA-C-N 115.74 -0.664 . . . . 49.770000000000003 112.109 -179.198 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 21.7 t30 -64.4 -42.68 95.97 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.755 0.65 . . . . 55.600000000000001 112.755 178.714 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 66.1 m -60.75 -37.96 83.56 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 119.549 -0.86 . . . . 51.619999999999997 109.967 173.811 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 62.1 mt -69.46 -37.5 77.34 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 121.394 0.616 . . . . 52.82 110.887 -177.293 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 57.5 t30 -66.66 -43.12 85.4 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.594 -0.73 . . . . 54.770000000000003 110.793 178.68 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -59.17 -42.88 91.84 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.306 0.484 . . . . 88.469999999999999 112.306 172.491 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 82.0 mt-30 -53.86 -46.68 71.36 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.105 0.479 . . . . 60.759999999999998 110.818 176.508 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ARG . . . . . 0.489 ' NH1' ' O ' ' A' ' 142' ' ' HOH . 5.9 ptt180 -75.48 -18.32 59.87 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 119.074 -1.051 . . . . 54.270000000000003 111.489 -174.928 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -70.74 -26.22 74.41 Favored Glycine 0 N--CA 1.452 -0.273 0 N-CA-C 109.299 -1.52 . . . . 64.680000000000007 109.299 177.648 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 88.1 m-70 -110.48 2.98 19.2 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 113.037 0.755 . . . . 85.670000000000002 113.037 179.005 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 76.59 6.95 85.32 Favored Glycine 0 C--N 1.333 0.409 0 N-CA-C 113.918 0.327 . . . . 48.579999999999998 113.918 178.843 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.81 122.2 13.61 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-O 120.875 0.369 . . . . 69.209999999999994 111.564 -179.372 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 60.0 m-85 67.55 2.97 3.16 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 123.935 0.894 . . . . 56.060000000000002 113.305 176.591 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 84.9 m -70.16 127.95 34.58 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.268 0.556 . . . . 58.329999999999998 111.621 -178.611 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 28.5 p-10 -119.18 13.06 12.8 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.845 -0.616 . . . . 52.840000000000003 112.441 -175.2 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 9.1 p -148.13 152.03 12.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 C-N-CA 119.077 -1.049 . . . . 52.18 110.554 173.085 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 56.9 m -122.64 126.08 46.92 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.291 -1.003 . . . . 50.310000000000002 108.291 175.051 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 34.0 t -107.25 126.87 63.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.2 0.524 . . . . 53.57 111.036 176.121 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ILE . . . . . 0.401 HG12 ' HG2' ' A' ' 42' ' ' LYS . 76.5 mt -108.12 114.18 45.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.543 -0.753 . . . . 55.409999999999997 111.49 -176.949 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 19.4 t -124.79 132.8 70.84 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.64 0 CA-C-N 115.83 -0.623 . . . . 57.890000000000001 109.384 179.989 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 81.9 mt-10 45.64 -123.13 1.12 Allowed 'General case' 0 CA--C 1.515 -0.401 0 N-CA-C 103.799 -2.667 . . . . 68.969999999999999 103.799 -163.223 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -115.4 15.01 16.84 Favored 'General case' 0 C--N 1.316 -0.848 0 C-N-CA 113.003 -3.479 . . . . 91.739999999999995 113.984 177.062 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ARG . . . . . 0.675 ' HG3' HH11 ' A' ' 41' ' ' ARG . 7.8 tpt85 -86.26 142.71 28.36 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 114.301 -1.318 . . . . 119.8 108.278 179.345 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 42' ' ' LYS . . . . . 0.401 ' HG2' HG12 ' A' ' 37' ' ' ILE . 95.7 mttt -114.33 125.08 53.47 Favored 'General case' 0 CA--C 1.51 -0.559 0 CA-C-O 119.556 -0.259 . . . . 93.959999999999994 110.442 -179.239 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 39.7 m-85 -108.66 123.88 49.65 Favored 'General case' 0 N--CA 1.452 -0.363 0 O-C-N 123.369 0.418 . . . . 54.079999999999998 110.051 174.861 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 32.8 mtm180 -87.65 142.28 27.96 Favored 'General case' 0 C--O 1.222 -0.355 0 N-CA-C 108.543 -0.91 . . . . 100.34999999999999 108.543 173.411 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -161.2 -179.07 7.15 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 114.64 1.348 . . . . 54.490000000000002 114.64 -176.282 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 29.9 m80 -109.49 119.31 39.05 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.574 -0.739 . . . . 51.909999999999997 112.744 178.988 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -51.94 -36.99 51.09 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 114.899 1.444 . . . . 57.920000000000002 114.899 176.802 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 48.7 p-10 -65.39 -35.89 82.3 Favored 'General case' 0 CA--C 1.517 -0.296 0 C-N-CA 119.609 -0.836 . . . . 48.810000000000002 111.238 -177.161 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 23.0 mm -73.27 -47.01 48.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.963 -0.562 . . . . 45.490000000000002 111.62 178.23 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 26.5 mt -69.72 -39.74 76.65 Favored 'General case' 0 C--O 1.241 0.635 0 C-N-CA 120.548 -0.461 . . . . 45.950000000000003 111.679 -176.916 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 40.2 t -57.12 -46.43 82.64 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 120.137 -0.625 . . . . 55.899999999999999 111.424 173.871 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.08 -30.29 71.36 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.322 -0.399 . . . . 50.119999999999997 112.023 -174.709 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 71.4 m -111.39 -14.34 13.77 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.665 -0.698 . . . . 46.539999999999999 112.641 -164.603 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.8 t -130.42 125.41 34.44 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 116.105 -0.498 . . . . 41.149999999999999 111.866 -178.162 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' THR . . . . . 0.475 ' OG1' ' HA3' ' A' ' 109' ' ' GLY . 21.4 p -70.31 -27.97 64.81 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 119.467 -0.893 . . . . 57.899999999999999 110.647 -178.522 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 73.3 t80 -71.25 -50.89 28.13 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 120.071 -0.652 . . . . 67.159999999999997 110.223 -179.356 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 25.2 m-85 -62.59 -30.91 71.68 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 113.294 0.85 . . . . 43.57 113.294 173.192 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 64.4 t-80 -58.03 -45.74 86.47 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.858 0.837 . . . . 53.509999999999998 109.517 175.681 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -59.74 -53.37 58.81 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 114.37 -1.286 . . . . 128.47 112.226 177.572 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.23 -45.46 83.86 Favored 'General case' 0 C--O 1.238 0.448 0 N-CA-C 113.286 0.847 . . . . 56.100000000000001 113.286 -177.876 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 22.1 m-30 -87.09 5.67 36.51 Favored 'General case' 0 CA--C 1.518 -0.266 0 N-CA-C 113.707 1.003 . . . . 63.920000000000002 113.707 -165.525 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 79.4 p -82.74 5.59 20.86 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.335 0.588 . . . . 69.599999999999994 109.804 170.95 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 26.2 m -141.77 164.98 18.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.039 -0.528 . . . . 73.890000000000001 109.737 175.963 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.29 146.48 19.11 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 115.897 -0.592 . . . . 84.099999999999994 111.683 178.556 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 156.74 121.84 0.71 Allowed Glycine 0 N--CA 1.447 -0.628 0 N-CA-C 111.098 -0.801 . . . . 73.319999999999993 111.098 -177.025 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' GLN . . . . . 0.511 ' NE2' ' O ' ' A' ' 136' ' ' HOH . 94.0 mm-40 -109.77 -11.5 14.71 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 123.026 0.53 . . . . 151.24000000000001 110.631 -179.544 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 69.0 t -136.03 131.92 49.83 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.358 0 CA-C-N 116.082 -0.508 . . . . 71.599999999999994 111.056 179.354 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 1.1 m -125.69 134.3 67.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 C-N-CA 119.736 -0.786 . . . . 56.75 111.894 171.667 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' GLU . . . . . 0.765 ' O ' ' O ' ' A' ' 127' ' ' HOH . 0.0 OUTLIER -106.97 120.33 41.78 Favored 'General case' 0 N--CA 1.438 -1.035 0 CA-C-N 115.341 -0.845 . . . . 89.219999999999999 109.277 -178.661 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 84.8 mt -104.24 146.41 28.83 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 114.305 1.224 . . . . 60.18 114.305 177.433 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' SER . . . . . 0.46 ' O ' ' HB2' ' A' ' 72' ' ' PHE . 52.3 p -124.41 169.97 11.31 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.659 -0.701 . . . . 52.07 109.763 176.147 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 72' ' ' PHE . . . . . 0.46 ' HB2' ' O ' ' A' ' 71' ' ' SER . 24.8 m-85 74.12 3.67 4.43 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 113.483 0.92 . . . . 60.0 113.483 173.965 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ILE . . . . . 0.61 HD13 ' HB2' ' A' ' 104' ' ' SER . 8.0 mt -134.86 129.47 51.42 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.362 0 N-CA-C 110.008 -0.367 . . . . 50.170000000000002 110.008 -178.628 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 36.2 mtm105 -76.21 149.67 37.2 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.273 0.559 . . . . 80.219999999999999 111.392 179.851 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -54.32 -50.93 66.21 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 112.643 0.609 . . . . 56.090000000000003 112.643 -178.343 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -62.82 -30.42 71.47 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 120.275 -0.57 . . . . 77.359999999999999 111.542 -174.983 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 30.9 mm -68.85 -48.76 68.99 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.434 0 CA-C-N 116.114 -0.494 . . . . 57.990000000000002 109.822 175.93 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 75.5 t80 -59.96 -42.38 93.96 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 120.537 -0.465 . . . . 56.020000000000003 111.203 177.625 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -47.3 -42.82 21.8 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 112.179 0.437 . . . . 49.119999999999997 112.179 174.623 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' GLU . . . . . 0.485 ' HA ' ' OE1' ' A' ' 80' ' ' GLU . 0.0 OUTLIER -64.21 -45.15 89.53 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 123.502 0.721 . . . . 76.739999999999995 112.864 177.085 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 81' ' ' ILE . . . . . 0.509 HD11 ' OG ' ' A' ' 104' ' ' SER . 5.4 mm -56.84 -40.48 71.49 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.369 0 N-CA-C 109.257 -0.645 . . . . 62.509999999999998 109.257 177.575 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 6.2 mt -67.49 -47.76 69.09 Favored 'General case' 0 CA--C 1.506 -0.736 0 C-N-CA 119.21 -0.996 . . . . 51.280000000000001 110.613 178.648 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -51.49 -39.15 56.99 Favored 'General case' 0 CA--C 1.508 -0.636 0 C-N-CA 119.264 -0.974 . . . . 50.090000000000003 109.842 -177.987 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 17.7 t80 -67.86 -53.74 24.32 Favored 'General case' 0 CA--C 1.508 -0.669 0 CA-C-O 121.671 0.748 . . . . 44.689999999999998 109.051 178.213 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 28.0 mt -48.94 -31.65 4.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 C-N-CA 119.553 -0.859 . . . . 49.409999999999997 110.84 179.294 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 52.8 m-85 -103.04 12.4 36.02 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 115.573 1.694 . . . . 45.25 115.573 -179.487 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 54.6 p -147.34 -20.2 0.39 Allowed 'General case' 0 CA--C 1.512 -0.502 0 N-CA-C 113.799 1.037 . . . . 53.020000000000003 113.799 178.155 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 6.8 p 79.02 4.98 2.33 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 111.918 0.34 . . . . 51.229999999999997 111.918 -174.115 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 67.7 mttt -132.24 145.94 51.67 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 112.141 0.423 . . . . 82.620000000000005 112.141 -176.69 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 34.9 pt -106.82 140.24 25.62 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.681 0 N-CA-C 103.566 -2.753 . . . . 50.18 103.566 158.584 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 48.3 t -128.59 119.16 49.39 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 C-N-CA 120.463 -0.495 . . . . 66.540000000000006 110.574 -168.388 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 44.6 mtm105 47.91 45.6 18.85 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 113.908 1.077 . . . . 131.81999999999999 113.908 177.473 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 93.1 t -70.87 136.47 25.85 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.813 0 CA-C-N 115.347 -0.842 . . . . 59.090000000000003 110.493 170.015 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 5.5 ptm180 -76.48 138.32 40.21 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 113.106 0.78 . . . . 109.56999999999999 113.106 -179.775 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 65.1 p -55.69 -26.67 46.17 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 116.459 2.022 . . . . 89.120000000000005 116.459 -164.621 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 4.2 p30 -80.71 -33.45 35.3 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 119.173 -1.011 . . . . 84.689999999999998 112.647 -178.423 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 30.6 mt -67.15 -9.64 42.0 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-O 121.366 0.603 . . . . 70.430000000000007 111.605 177.433 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 11.1 tp -65.69 -49.96 66.64 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.75 -0.659 . . . . 64.319999999999993 111.988 -172.789 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' ASP . . . . . 0.61 ' O ' ' HG3' ' A' ' 103' ' ' LYS . 0.3 OUTLIER -56.96 -37.99 72.35 Favored 'General case' 0 N--CA 1.444 -0.726 0 N-CA-C 108.771 -0.826 . . . . 110.8 108.771 -176.052 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -69.98 -42.65 72.84 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 114.773 -1.103 . . . . 64.109999999999999 111.041 -179.25 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 56.9 tp -60.47 -47.48 85.94 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 115.631 -0.713 . . . . 52.32 110.211 176.888 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 54.8 mt -52.01 -40.42 28.88 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 CA-C-N 116.284 -0.416 . . . . 50.109999999999999 111.112 176.937 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' LYS . . . . . 0.61 ' HG3' ' O ' ' A' ' 99' ' ' ASP . 32.4 mttp -71.59 -34.76 70.16 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 112.476 0.547 . . . . 80.219999999999999 112.476 -175.056 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 104' ' ' SER . . . . . 0.61 ' HB2' HD13 ' A' ' 73' ' ' ILE . 21.9 p -74.29 -34.36 63.5 Favored 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 107.878 -1.156 . . . . 64.670000000000002 107.878 -178.567 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -59.89 -39.92 96.14 Favored Glycine 0 N--CA 1.447 -0.632 0 N-CA-C 111.023 -0.831 . . . . 49.130000000000003 111.023 170.244 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 33.0 mt-30 -64.34 -48.21 76.45 Favored 'General case' 0 C--N 1.329 -0.299 0 O-C-N 122.473 -0.427 . . . . 70.819999999999993 111.477 175.492 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 86.1 mt -60.11 -38.4 82.89 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 113.099 0.778 . . . . 52.090000000000003 113.099 179.971 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 34.2 mt -91.76 -12.61 33.38 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 112.834 0.679 . . . . 49.299999999999997 112.834 -174.699 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' GLY . . . . . 0.475 ' HA3' ' OG1' ' A' ' 55' ' ' THR . . . 74.97 42.53 29.65 Favored Glycine 0 C--N 1.331 0.284 0 O-C-N 123.408 0.442 . . . . 44.420000000000002 112.121 177.094 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 15.8 t -102.04 92.03 2.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 N-CA-C 107.169 -1.419 . . . . 45.859999999999999 107.169 174.959 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 58.9 tttp -47.99 -40.96 24.04 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 114.853 1.427 . . . . 85.290000000000006 114.853 -166.144 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 87.6 t80 -69.43 -37.48 77.43 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.407 -0.361 . . . . 48.530000000000001 111.156 -173.379 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 32.5 mm -74.24 -46.21 45.06 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.111 0 O-C-N 123.675 0.61 . . . . 53.509999999999998 109.804 177.881 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -50.87 -32.46 20.48 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.502 0.556 . . . . 55.270000000000003 112.502 176.286 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -108.99 22.33 16.06 Favored 'General case' 0 CA--C 1.514 -0.426 0 N-CA-C 114.507 1.299 . . . . 72.909999999999997 114.507 -169.125 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 90.7 mt -65.42 -17.01 64.21 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 119.184 -1.006 . . . . 82.269999999999996 113.126 172.064 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.543 0 C-N-CA 121.31 -0.472 . . . . 86.849999999999994 112.545 173.236 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 127' ' ' HOH . . . . . 0.765 ' O ' ' O ' ' A' ' 69' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 136' ' ' HOH . . . . . 0.511 ' O ' ' NE2' ' A' ' 66' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 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 . . . . . 0.489 ' O ' ' NH1' ' A' ' 26' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.644 ' HA ' ' NE ' ' A' ' 4' ' ' ARG . 1.7 tpm_? . . . . . 0 CA--C 1.551 1.0 0 N-CA-C 112.802 0.667 . . . . 150.37 112.802 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 13.2 pttt -154.66 155.1 34.04 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 113.492 0.923 . . . . 68.5 113.492 -176.894 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 43.9 mt -108.77 134.86 50.9 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-O 121.496 0.665 . . . . 58.520000000000003 112.545 175.321 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 45.6 mm -111.68 133.59 56.82 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.566 0 CA-C-N 115.329 -0.85 . . . . 57.859999999999999 112.031 -179.896 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 28.4 m -125.18 140.97 52.39 Favored 'General case' 0 CA--C 1.506 -0.721 0 N-CA-C 107.224 -1.398 . . . . 58.920000000000002 107.224 171.491 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -135.8 142.57 44.89 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 109.206 -0.664 . . . . 57.719999999999999 109.206 174.73 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 97.2 m -120.74 132.21 54.93 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-N 116.058 -0.519 . . . . 50.960000000000001 110.562 174.744 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 57.2 t0 -94.14 95.62 9.1 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 108.651 -0.87 . . . . 57.200000000000003 108.651 177.555 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.444 HD12 ' HA ' ' A' ' 12' ' ' ILE . 0.2 OUTLIER -55.84 -32.22 31.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 N-CA-C 113.199 0.814 . . . . 80.510000000000005 113.199 -178.614 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -91.79 -0.86 57.56 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 113.851 1.056 . . . . 93.930000000000007 113.851 -177.362 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 70.5 t80 -57.99 -58.59 7.76 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 119.981 -0.688 . . . . 53.140000000000001 112.529 -172.191 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 27.9 m -46.63 -50.7 17.2 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 114.083 1.142 . . . . 71.959999999999994 114.083 -178.657 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -59.1 -42.14 96.91 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 116.065 1.186 . . . . 61.090000000000003 116.065 176.639 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 11.0 t -71.91 -44.89 62.93 Favored 'General case' 0 C--N 1.328 -0.363 0 O-C-N 121.949 -0.736 . . . . 58.369999999999997 109.617 -177.812 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 35.6 tp -51.9 -58.58 6.05 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.025 -0.534 . . . . 48.310000000000002 111.586 175.343 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 17.7 mt -54.43 -44.13 72.19 Favored 'General case' 0 CA--C 1.508 -0.657 0 CA-C-N 115.74 -0.664 . . . . 49.770000000000003 112.109 -179.198 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 21.7 t30 -64.4 -42.68 95.97 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.755 0.65 . . . . 55.600000000000001 112.755 178.714 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 66.1 m -60.75 -37.96 83.56 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 119.549 -0.86 . . . . 51.619999999999997 109.967 173.811 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 62.1 mt -69.46 -37.5 77.34 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 121.394 0.616 . . . . 52.82 110.887 -177.293 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 57.5 t30 -66.66 -43.12 85.4 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.594 -0.73 . . . . 54.770000000000003 110.793 178.68 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -59.17 -42.88 91.84 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.306 0.484 . . . . 88.469999999999999 112.306 172.491 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 82.0 mt-30 -53.86 -46.68 71.36 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.105 0.479 . . . . 60.759999999999998 110.818 176.508 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.489 ' NH1' ' O ' ' A' ' 142' ' ' HOH . 5.9 ptt180 -75.48 -18.32 59.87 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 119.074 -1.051 . . . . 54.270000000000003 111.489 -174.928 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -70.74 -26.22 74.41 Favored Glycine 0 N--CA 1.452 -0.273 0 N-CA-C 109.299 -1.52 . . . . 64.680000000000007 109.299 177.648 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 88.1 m-70 -110.48 2.98 19.2 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 113.037 0.755 . . . . 85.670000000000002 113.037 179.005 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 76.59 6.95 85.32 Favored Glycine 0 C--N 1.333 0.409 0 N-CA-C 113.918 0.327 . . . . 48.579999999999998 113.918 178.843 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.81 122.2 13.61 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-O 120.875 0.369 . . . . 69.209999999999994 111.564 -179.372 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 60.0 m-85 67.55 2.97 3.16 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 123.935 0.894 . . . . 56.060000000000002 113.305 176.591 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 84.9 m -70.16 127.95 34.58 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.268 0.556 . . . . 58.329999999999998 111.621 -178.611 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 28.5 p-10 -119.18 13.06 12.8 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.845 -0.616 . . . . 52.840000000000003 112.441 -175.2 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 9.1 p -148.13 152.03 12.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 C-N-CA 119.077 -1.049 . . . . 52.18 110.554 173.085 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 56.9 m -122.64 126.08 46.92 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.291 -1.003 . . . . 50.310000000000002 108.291 175.051 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 34.0 t -107.25 126.87 63.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.2 0.524 . . . . 53.57 111.036 176.121 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.401 HG12 ' HG2' ' A' ' 42' ' ' LYS . 76.5 mt -108.12 114.18 45.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.543 -0.753 . . . . 55.409999999999997 111.49 -176.949 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 19.4 t -124.79 132.8 70.84 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.64 0 CA-C-N 115.83 -0.623 . . . . 57.890000000000001 109.384 179.989 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 81.9 mt-10 45.64 -123.13 1.12 Allowed 'General case' 0 CA--C 1.515 -0.401 0 N-CA-C 103.799 -2.667 . . . . 68.969999999999999 103.799 -163.223 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -115.4 15.01 16.84 Favored 'General case' 0 C--N 1.316 -0.848 0 C-N-CA 113.003 -3.479 . . . . 91.739999999999995 113.984 177.062 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.675 ' HG3' HH11 ' A' ' 41' ' ' ARG . 7.8 tpt85 -86.26 142.71 28.36 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 114.301 -1.318 . . . . 119.8 108.278 179.345 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.401 ' HG2' HG12 ' A' ' 37' ' ' ILE . 95.7 mttt -114.33 125.08 53.47 Favored 'General case' 0 CA--C 1.51 -0.559 0 CA-C-O 119.556 -0.259 . . . . 93.959999999999994 110.442 -179.239 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 39.7 m-85 -108.66 123.88 49.65 Favored 'General case' 0 N--CA 1.452 -0.363 0 O-C-N 123.369 0.418 . . . . 54.079999999999998 110.051 174.861 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 32.8 mtm180 -87.65 142.28 27.96 Favored 'General case' 0 C--O 1.222 -0.355 0 N-CA-C 108.543 -0.91 . . . . 100.34999999999999 108.543 173.411 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -161.2 -179.07 7.15 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 114.64 1.348 . . . . 54.490000000000002 114.64 -176.282 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' HIS . . . . . . . . . . . . . 29.9 m80 -109.49 119.31 39.05 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.574 -0.739 . . . . 51.909999999999997 112.744 178.988 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -51.94 -36.99 51.09 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 114.899 1.444 . . . . 57.920000000000002 114.899 176.802 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 48.7 p-10 -65.39 -35.89 82.3 Favored 'General case' 0 CA--C 1.517 -0.296 0 C-N-CA 119.609 -0.836 . . . . 48.810000000000002 111.238 -177.161 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 23.0 mm -73.27 -47.01 48.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.963 -0.562 . . . . 45.490000000000002 111.62 178.23 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 26.5 mt -69.72 -39.74 76.65 Favored 'General case' 0 C--O 1.241 0.635 0 C-N-CA 120.548 -0.461 . . . . 45.950000000000003 111.679 -176.916 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 40.2 t -57.12 -46.43 82.64 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 120.137 -0.625 . . . . 55.899999999999999 111.424 173.871 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.08 -30.29 71.36 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.322 -0.399 . . . . 50.119999999999997 112.023 -174.709 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 71.4 m -111.39 -14.34 13.77 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.665 -0.698 . . . . 46.539999999999999 112.641 -164.603 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.8 t -130.42 125.41 34.44 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 116.105 -0.498 . . . . 41.149999999999999 111.866 -178.162 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' THR . . . . . 0.475 ' OG1' ' HA3' ' A' ' 109' ' ' GLY . 21.4 p -70.31 -27.97 64.81 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 119.467 -0.893 . . . . 57.899999999999999 110.647 -178.522 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 73.3 t80 -71.25 -50.89 28.13 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 120.071 -0.652 . . . . 67.159999999999997 110.223 -179.356 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 25.2 m-85 -62.59 -30.91 71.68 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 113.294 0.85 . . . . 43.57 113.294 173.192 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 64.4 t-80 -58.03 -45.74 86.47 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.858 0.837 . . . . 53.509999999999998 109.517 175.681 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -59.74 -53.37 58.81 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 114.37 -1.286 . . . . 128.47 112.226 177.572 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.23 -45.46 83.86 Favored 'General case' 0 C--O 1.238 0.448 0 N-CA-C 113.286 0.847 . . . . 56.100000000000001 113.286 -177.876 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 22.1 m-30 -87.09 5.67 36.51 Favored 'General case' 0 CA--C 1.518 -0.266 0 N-CA-C 113.707 1.003 . . . . 63.920000000000002 113.707 -165.525 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 79.4 p -82.74 5.59 20.86 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.335 0.588 . . . . 69.599999999999994 109.804 170.95 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 26.2 m -141.77 164.98 18.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.039 -0.528 . . . . 73.890000000000001 109.737 175.963 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.29 146.48 19.11 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 115.897 -0.592 . . . . 84.099999999999994 111.683 178.556 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 156.74 121.84 0.71 Allowed Glycine 0 N--CA 1.447 -0.628 0 N-CA-C 111.098 -0.801 . . . . 73.319999999999993 111.098 -177.025 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.511 ' NE2' ' O ' ' A' ' 136' ' ' HOH . 94.0 mm-40 -109.77 -11.5 14.71 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 123.026 0.53 . . . . 151.24000000000001 110.631 -179.544 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 69.0 t -136.03 131.92 49.83 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.358 0 CA-C-N 116.082 -0.508 . . . . 71.599999999999994 111.056 179.354 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 1.1 m -125.69 134.3 67.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 C-N-CA 119.736 -0.786 . . . . 56.75 111.894 171.667 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.765 ' O ' ' O ' ' A' ' 127' ' ' HOH . 0.0 OUTLIER -106.97 120.33 41.78 Favored 'General case' 0 N--CA 1.438 -1.035 0 CA-C-N 115.341 -0.845 . . . . 89.219999999999999 109.277 -178.661 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 84.8 mt -104.24 146.41 28.83 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 114.305 1.224 . . . . 60.18 114.305 177.433 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' SER . . . . . 0.46 ' O ' ' HB2' ' A' ' 72' ' ' PHE . 52.3 p -124.41 169.97 11.31 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.659 -0.701 . . . . 52.07 109.763 176.147 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' PHE . . . . . 0.46 ' HB2' ' O ' ' A' ' 71' ' ' SER . 24.8 m-85 74.12 3.67 4.43 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 113.483 0.92 . . . . 60.0 113.483 173.965 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.61 HD13 ' HB2' ' A' ' 104' ' ' SER . 8.0 mt -134.86 129.47 51.42 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.362 0 N-CA-C 110.008 -0.367 . . . . 50.170000000000002 110.008 -178.628 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 36.2 mtm105 -76.21 149.67 37.2 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.273 0.559 . . . . 80.219999999999999 111.392 179.851 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -54.32 -50.93 66.21 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 112.643 0.609 . . . . 56.090000000000003 112.643 -178.343 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -62.82 -30.42 71.47 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 120.275 -0.57 . . . . 77.359999999999999 111.542 -174.983 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 30.9 mm -68.85 -48.76 68.99 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.434 0 CA-C-N 116.114 -0.494 . . . . 57.990000000000002 109.822 175.93 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 75.5 t80 -59.96 -42.38 93.96 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 120.537 -0.465 . . . . 56.020000000000003 111.203 177.625 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -47.3 -42.82 21.8 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 112.179 0.437 . . . . 49.119999999999997 112.179 174.623 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.485 ' HA ' ' OE1' ' A' ' 80' ' ' GLU . 0.0 OUTLIER -64.21 -45.15 89.53 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 123.502 0.721 . . . . 76.739999999999995 112.864 177.085 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.509 HD11 ' OG ' ' A' ' 104' ' ' SER . 5.4 mm -56.84 -40.48 71.49 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.369 0 N-CA-C 109.257 -0.645 . . . . 62.509999999999998 109.257 177.575 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 6.2 mt -67.49 -47.76 69.09 Favored 'General case' 0 CA--C 1.506 -0.736 0 C-N-CA 119.21 -0.996 . . . . 51.280000000000001 110.613 178.648 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -51.49 -39.15 56.99 Favored 'General case' 0 CA--C 1.508 -0.636 0 C-N-CA 119.264 -0.974 . . . . 50.090000000000003 109.842 -177.987 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 17.7 t80 -67.86 -53.74 24.32 Favored 'General case' 0 CA--C 1.508 -0.669 0 CA-C-O 121.671 0.748 . . . . 44.689999999999998 109.051 178.213 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 28.0 mt -48.94 -31.65 4.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 C-N-CA 119.553 -0.859 . . . . 49.409999999999997 110.84 179.294 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 52.8 m-85 -103.04 12.4 36.02 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 115.573 1.694 . . . . 45.25 115.573 -179.487 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 54.6 p -147.34 -20.2 0.39 Allowed 'General case' 0 CA--C 1.512 -0.502 0 N-CA-C 113.799 1.037 . . . . 53.020000000000003 113.799 178.155 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 6.8 p 79.02 4.98 2.33 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 111.918 0.34 . . . . 51.229999999999997 111.918 -174.115 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 67.7 mttt -132.24 145.94 51.67 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 112.141 0.423 . . . . 82.620000000000005 112.141 -176.69 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 34.9 pt -106.82 140.24 25.62 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.681 0 N-CA-C 103.566 -2.753 . . . . 50.18 103.566 158.584 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 48.3 t -128.59 119.16 49.39 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 C-N-CA 120.463 -0.495 . . . . 66.540000000000006 110.574 -168.388 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 44.6 mtm105 47.91 45.6 18.85 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 113.908 1.077 . . . . 131.81999999999999 113.908 177.473 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 93.1 t -70.87 136.47 25.85 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.813 0 CA-C-N 115.347 -0.842 . . . . 59.090000000000003 110.493 170.015 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 5.5 ptm180 -76.48 138.32 40.21 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 113.106 0.78 . . . . 109.56999999999999 113.106 -179.775 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 65.1 p -55.69 -26.67 46.17 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 116.459 2.022 . . . . 89.120000000000005 116.459 -164.621 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 4.2 p30 -80.71 -33.45 35.3 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 119.173 -1.011 . . . . 84.689999999999998 112.647 -178.423 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 30.6 mt -67.15 -9.64 42.0 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-O 121.366 0.603 . . . . 70.430000000000007 111.605 177.433 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 11.1 tp -65.69 -49.96 66.64 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.75 -0.659 . . . . 64.319999999999993 111.988 -172.789 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' ASP . . . . . 0.61 ' O ' ' HG3' ' A' ' 103' ' ' LYS . 0.3 OUTLIER -56.96 -37.99 72.35 Favored 'General case' 0 N--CA 1.444 -0.726 0 N-CA-C 108.771 -0.826 . . . . 110.8 108.771 -176.052 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -69.98 -42.65 72.84 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 114.773 -1.103 . . . . 64.109999999999999 111.041 -179.25 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 56.9 tp -60.47 -47.48 85.94 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 115.631 -0.713 . . . . 52.32 110.211 176.888 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 54.8 mt -52.01 -40.42 28.88 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 CA-C-N 116.284 -0.416 . . . . 50.109999999999999 111.112 176.937 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' LYS . . . . . 0.61 ' HG3' ' O ' ' A' ' 99' ' ' ASP . 32.4 mttp -71.59 -34.76 70.16 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 112.476 0.547 . . . . 80.219999999999999 112.476 -175.056 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' SER . . . . . 0.61 ' HB2' HD13 ' A' ' 73' ' ' ILE . 21.9 p -74.29 -34.36 63.5 Favored 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 107.878 -1.156 . . . . 64.670000000000002 107.878 -178.567 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -59.89 -39.92 96.14 Favored Glycine 0 N--CA 1.447 -0.632 0 N-CA-C 111.023 -0.831 . . . . 49.130000000000003 111.023 170.244 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 33.0 mt-30 -64.34 -48.21 76.45 Favored 'General case' 0 C--N 1.329 -0.299 0 O-C-N 122.473 -0.427 . . . . 70.819999999999993 111.477 175.492 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 86.1 mt -60.11 -38.4 82.89 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 113.099 0.778 . . . . 52.090000000000003 113.099 179.971 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 34.2 mt -91.76 -12.61 33.38 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 112.834 0.679 . . . . 49.299999999999997 112.834 -174.699 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' GLY . . . . . 0.475 ' HA3' ' OG1' ' A' ' 55' ' ' THR . . . 74.97 42.53 29.65 Favored Glycine 0 C--N 1.331 0.284 0 O-C-N 123.408 0.442 . . . . 44.420000000000002 112.121 177.094 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 15.8 t -102.04 92.03 2.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 N-CA-C 107.169 -1.419 . . . . 45.859999999999999 107.169 174.959 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 58.9 tttp -47.99 -40.96 24.04 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 114.853 1.427 . . . . 85.290000000000006 114.853 -166.144 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 87.6 t80 -69.43 -37.48 77.43 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.407 -0.361 . . . . 48.530000000000001 111.156 -173.379 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 32.5 mm -74.24 -46.21 45.06 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.111 0 O-C-N 123.675 0.61 . . . . 53.509999999999998 109.804 177.881 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -50.87 -32.46 20.48 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.502 0.556 . . . . 55.270000000000003 112.502 176.286 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 99.4 mt-10 -108.99 22.33 16.06 Favored 'General case' 0 CA--C 1.514 -0.426 0 N-CA-C 114.507 1.299 . . . . 72.909999999999997 114.507 -169.125 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 90.7 mt -65.42 -17.01 64.21 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 119.184 -1.006 . . . . 82.269999999999996 113.126 172.064 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.543 0 C-N-CA 121.31 -0.472 . . . . 86.849999999999994 112.545 173.236 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' HOH . . . . . 0.765 ' O ' ' O ' ' A' ' 69' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' HOH . . . . . 0.511 ' O ' ' NE2' ' A' ' 66' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 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 . . . . . 0.489 ' O ' ' NH1' ' A' ' 26' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 stop_ save_