data_1byw_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 1byw _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 ' 26' ' ' SER . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.599 0 CA-C-O 121.076 0.465 . . . . 49.48 111.376 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.46 146.54 51.88 Favored 'General case' 0 C--O 1.241 0.634 0 N-CA-C 114.275 1.213 . . . . 50.8 114.275 -179.683 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 6.7 mptt -137.63 110.35 7.59 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 105.626 -1.99 . . . . 36.26 105.626 178.759 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 34.8 p90 -141.93 172.4 12.75 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 113.319 0.859 . . . . 25.3 113.319 -178.635 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 9.8 pt -148.7 149.88 14.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.311 -0.859 . . . . 23.49 109.611 179.462 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 8.9 mt -112.92 127.56 70.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 N-CA-C 109.822 -0.436 . . . . 27.59 109.822 179.28 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -109.34 154.02 23.11 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.871 0.367 . . . . 34.22 111.69 -179.568 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 60.5 t-20 -92.2 100.18 12.84 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 108.759 -0.83 . . . . 42.57 108.759 179.57 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -62.2 -29.86 70.67 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.615 0.598 . . . . 45.53 112.615 -179.105 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . . . -78.28 32.87 0.19 Allowed 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 113.101 0.778 . . . . 50.79 113.101 -179.28 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 16.3 t -140.31 155.5 23.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 N-CA-C 108.575 -0.898 . . . . 48.59 108.575 179.397 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . . . -66.94 -39.2 87.26 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 113.249 0.833 . . . . 44.77 113.249 -179.244 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 45.2 p-10 -96.79 4.2 51.87 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 114.377 1.251 . . . . 49.98 114.377 -178.902 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 36.6 m 50.46 44.35 26.97 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.73 -0.47 . . . . 44.95 109.73 -179.513 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -46.36 134.88 8.6 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.915 0.709 . . . . 37.12 112.915 -179.22 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 43.6 t -69.3 116.91 11.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 N-CA-C 109.362 -0.607 . . . . 30.61 109.362 179.327 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 21.1 pt -98.28 -0.18 10.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.612 -0.267 . . . . 25.57 111.43 -179.916 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -175.59 145.9 0.74 Allowed 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.714 0.635 . . . . 22.78 112.714 179.426 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 25.1 p -151.19 125.01 9.11 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 106.965 -1.495 . . . . 28.36 106.965 178.86 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 -75.27 166.1 24.15 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.595 0.591 . . . . 26.05 112.595 -179.267 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -54.05 -37.94 64.68 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.88 -0.6 . . . . 30.56 112.492 -179.486 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -58.54 -45.23 94.83 Favored Glycine 0 CA--C 1.517 0.218 0 C-N-CA 120.957 -0.639 . . . . 27.45 114.567 -179.783 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 90.6 t80 -60.83 -54.35 46.15 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.073 0.463 . . . . 25.2 110.209 -179.964 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 87.3 m -50.78 -44.47 58.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.551 -0.75 . . . . 29.3 112.842 -179.567 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 90.9 mt-10 -69.38 -32.99 72.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.959 0.409 . . . . 45.41 110.783 179.991 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 13.1 tp -67.16 -52.28 43.41 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.991 -0.549 . . . . 31.58 111.983 -179.783 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 25.2 p -81.16 -20.46 41.22 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.652 0.612 . . . . 30.86 112.652 -179.436 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 86.34 7.05 80.29 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.401 -0.904 . . . . 27.58 113.348 179.829 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 60.7 m-85 -102.88 147.08 27.34 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.38 -0.6 . . . . 24.86 109.38 179.734 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 15.8 p -82.25 156.85 24.14 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.537 0.569 . . . . 26.41 112.537 -179.143 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 37.4 ttm105 -53.86 -38.87 65.15 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 112.698 0.629 . . . . 24.47 112.698 -179.504 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.92 -32.03 73.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.665 -0.243 . . . . 25.74 111.52 -179.676 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -74.65 -45.98 41.12 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.85 0.357 . . . . 27.59 111.528 179.593 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 60.5 t -66.39 -42.06 89.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 N-CA-C 113.852 1.056 . . . . 25.99 113.852 -179.014 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 42.6 mmm -47.55 136.71 9.76 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 113.686 0.995 . . . . 26.9 113.686 -179.301 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 68.9 mm-40 68.67 13.89 8.95 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 116.554 2.057 . . . . 36.23 116.554 178.57 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 79.4 mtt180 -103.17 150.93 38.37 Favored Pre-proline 0 C--N 1.326 -0.42 0 C-N-CA 120.825 -0.35 . . . . 48.9 110.351 179.888 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -49.03 124.25 11.19 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 121.25 1.3 . . . . 33.8 110.969 179.775 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 12.9 p -57.6 -4.03 0.23 Allowed 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 115.132 1.53 . . . . 32.98 115.132 -178.599 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 18.3 p -80.09 -9.73 59.72 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 108.68 -0.859 . . . . 27.12 108.68 178.792 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 60.5 m 49.26 61.37 3.17 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 113.371 0.878 . . . . 27.21 113.371 179.158 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 54.9 m-20 -66.22 -21.42 66.3 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.011 -0.54 . . . . 35.36 111.536 -179.804 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 45.8 p90 -69.98 -9.73 56.18 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.661 -0.415 . . . . 29.71 111.055 -179.894 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 91.7 mt -97.14 -5.65 36.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.322 -0.399 . . . . 29.4 110.676 179.611 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 58.7 m170 -75.34 154.7 37.14 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 113.017 0.747 . . . . 34.54 113.017 -179.132 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -162.29 -160.41 11.05 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.537 -0.839 . . . . 37.95 113.267 -179.922 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_exo -49.52 -57.4 2.36 Favored 'Trans proline' 0 CA--C 1.526 0.121 0 C-N-CA 124.401 3.4 . . . . 39.07 115.89 -179.913 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 1.3 m -74.39 -12.94 60.65 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 115.225 1.565 . . . . 42.54 115.225 -178.801 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 8.2 m -59.91 113.95 2.56 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.699 -0.4 . . . . 40.17 110.752 -179.935 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' GLN . . . . . 0.438 ' N ' ' O ' ' A' ' 220' ' ' HOH . . . -75.16 131.13 40.24 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 113.479 0.918 . . . . 48.86 113.479 -179.55 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . . . -60.2 -32.46 71.12 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.98 -0.555 . . . . 40.86 111.497 -179.958 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . . . -73.39 -37.55 65.93 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.892 0.377 . . . . 39.0 110.179 179.716 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -66.31 -37.93 86.52 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.408 -0.589 . . . . 35.95 109.408 179.86 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -71.65 -46.51 58.79 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.951 -0.568 . . . . 34.44 110.982 179.895 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -58.73 -37.28 75.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.252 -0.431 . . . . 33.9 111.419 -179.874 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 13.4 mt-30 -62.49 -42.94 99.83 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.778 -0.452 . . . . 31.58 109.778 179.668 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 58.2 mt -65.67 -37.38 79.83 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.217 0 N-CA-C 109.342 -0.614 . . . . 29.34 109.342 179.908 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -65.8 -45.31 82.87 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.031 -0.531 . . . . 29.91 109.988 -179.974 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . . . -59.14 -47.03 86.77 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.018 -0.537 . . . . 30.92 110.885 -179.697 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -52.65 -47.59 66.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.094 -0.503 . . . . 31.97 110.593 179.865 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 77.9 mt -63.04 -37.11 85.88 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.177 -0.465 . . . . 35.4 111.532 -179.755 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.9 mt -65.64 -59.76 3.61 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.473 0.546 . . . . 42.51 112.473 -179.747 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -88.1 20.23 30.48 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.505 -0.855 . . . . 46.03 115.081 -179.251 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . 49.17 48.78 20.56 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 121.243 0.544 . . . . 47.16 110.192 -179.84 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . . . -92.96 135.51 34.09 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.731 -0.668 . . . . 47.47 111.532 -179.664 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -83.46 114.04 21.2 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 102.712 -3.07 . . . . 53.94 102.712 177.496 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 28.5 ttm180 -151.18 146.88 26.41 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 115.878 1.807 . . . . 41.89 115.878 -177.377 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 13.0 mttt -110.3 124.6 51.96 Favored 'General case' 0 N--CA 1.462 0.169 0 N-CA-C 108.192 -1.04 . . . . 36.0 108.192 178.925 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 20.3 t -127.48 129.45 70.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 N-CA-C 112.918 0.71 . . . . 32.18 112.918 -179.257 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -89.77 117.08 28.35 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 106.64 -1.615 . . . . 33.81 106.64 178.595 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 19.2 tt -134.77 144.87 33.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 120.979 0.418 . . . . 28.5 111.801 -178.438 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -81.28 116.65 21.24 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.304 -0.628 . . . . 29.08 109.304 179.754 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 -112.29 155.21 24.44 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.11 -0.496 . . . . 31.67 111.933 -179.343 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -123.82 127.49 48.14 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.862 -0.608 . . . . 35.6 110.859 179.869 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 16.5 mtt85 -74.39 178.89 4.91 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.363 -0.381 . . . . 33.61 110.463 179.677 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 49.3 tttt -68.19 -27.27 66.26 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.46 -0.336 . . . . 41.27 111.285 -179.985 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 30.7 p-10 -81.46 9.32 7.57 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.972 -0.558 . . . . 40.46 111.034 179.967 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 84.72 -20.99 12.04 Favored Glycine 0 CA--C 1.519 0.296 0 C-N-CA 120.71 -0.757 . . . . 38.26 113.135 -179.994 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 2.8 t -51.94 144.61 11.38 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.919 0.39 . . . . 37.05 111.032 179.952 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 54.0 t -112.73 144.56 42.05 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.141 -0.481 . . . . 35.84 110.704 -179.691 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 46.1 p90 -152.13 145.18 24.53 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.042 0.448 . . . . 34.51 111.778 179.42 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 18.7 tp -80.38 113.24 18.42 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 108.414 -0.958 . . . . 35.39 108.414 179.452 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 52.0 t -112.47 141.44 46.22 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 113.559 0.948 . . . . 29.8 113.559 -178.858 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 29.4 tp -104.8 108.4 19.86 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 107.309 -1.367 . . . . 26.17 107.309 178.321 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 80.0 t -88.19 130.73 37.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 121.167 0.508 . . . . 24.26 111.623 -179.836 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -113.06 98.23 7.02 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.768 -0.827 . . . . 29.9 108.768 179.808 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 17.8 t -82.88 106.26 13.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 N-CA-C 109.659 -0.497 . . . . 24.13 109.659 179.371 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 40.1 t -112.62 100.31 50.03 Favored Pre-proline 0 C--N 1.329 -0.312 0 N-CA-C 112.447 0.536 . . . . 22.94 112.447 -179.609 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_exo -70.68 147.11 56.28 Favored 'Trans proline' 0 N--CA 1.465 -0.173 0 C-N-CA 120.291 0.661 . . . . 23.8 110.466 179.737 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 95.6 t -122.82 105.57 16.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 N-CA-C 109.888 -0.412 . . . . 28.41 109.888 179.658 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 11.5 mttm -100.6 161.94 13.26 Favored 'General case' 0 C--N 1.333 -0.149 0 N-CA-C 113.69 0.996 . . . . 38.58 113.69 -179.267 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 34.2 p30 -99.42 -168.55 1.63 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.532 -0.758 . . . . 41.81 109.193 179.324 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . . . -61.05 -40.38 93.42 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 108.964 -0.754 . . . . 44.91 108.964 179.42 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . . . -70.16 -2.37 12.86 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.86 -0.609 . . . . 43.72 112.495 179.81 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 77.42 6.14 86.3 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.292 -0.956 . . . . 40.84 112.763 -179.981 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -80.4 138.09 36.6 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.463 -0.569 . . . . 36.87 109.463 179.527 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 1.4 t -76.69 113.01 15.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 N-CA-C 109.681 -0.489 . . . . 34.04 109.681 179.482 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 5.1 mt -85.06 -55.4 6.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.105 -0.498 . . . . 32.51 111.301 -179.791 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 8.9 ptt? -140.76 170.98 14.75 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.882 -0.599 . . . . 28.23 110.66 -179.826 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 12.9 m-85 -121.3 148.99 43.59 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.423 -0.955 . . . . 27.26 108.423 179.619 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 50.5 mt -127.46 107.88 17.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 N-CA-C 106.814 -1.55 . . . . 25.83 106.814 178.198 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 1.2 mt -101.21 125.62 47.85 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.27 -0.423 . . . . 25.98 109.861 179.462 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -111.77 126.84 55.5 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.389 -0.597 . . . . 31.19 109.389 179.976 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 7.2 m-85 -108.97 143.21 38.54 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.173 -0.467 . . . . 24.39 109.844 -179.965 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . . . -149.75 136.73 19.56 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.475 -0.935 . . . . 30.16 108.475 179.346 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 31.9 t -77.59 124.04 35.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 121.01 0.433 . . . . 37.85 112.087 -179.564 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 55.7 t -91.2 -37.88 9.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.936 -0.574 . . . . 46.52 110.128 179.874 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 6.9 ttm -169.39 145.2 3.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.383 -0.371 . . . . 56.63 111.451 -179.517 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 53.8 mm-40 -89.05 125.14 34.88 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.199 -0.455 . . . . 59.87 111.192 -179.956 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 48.4 pttt . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.364 -0.827 . . . . 69.25 111.017 179.581 . . . . . . . . 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 0 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud 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 0 . 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 . . . . . 0.438 ' O ' ' N ' ' A' ' 75' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 ' 26' ' ' SER . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.599 0 CA-C-O 121.076 0.465 . . . . 49.48 111.376 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.46 146.54 51.88 Favored 'General case' 0 C--O 1.241 0.634 0 N-CA-C 114.275 1.213 . . . . 50.8 114.275 -179.683 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 28' ' ' LYS . . . . . 0.416 ' HG2' ' O ' ' A' ' 47' ' ' GLY . 6.7 mptt -137.63 110.35 7.59 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 105.626 -1.99 . . . . 36.26 105.626 178.759 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 34.8 p90 -141.93 172.4 12.75 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 113.319 0.859 . . . . 25.3 113.319 -178.635 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ILE . . . . . 0.51 HG12 ' HE1' ' A' ' 129' ' ' PHE . 9.8 pt -148.7 149.88 14.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.311 -0.859 . . . . 23.49 109.611 179.462 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ILE . . . . . 0.489 HG22 HD11 ' A' ' 42' ' ' ILE . 8.9 mt -112.92 127.56 70.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 N-CA-C 109.822 -0.436 . . . . 27.59 109.822 179.28 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ALA . . . . . 0.527 ' HB3' ' HB2' ' A' ' 125' ' ' PHE . . . -109.34 154.02 23.11 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.871 0.367 . . . . 34.22 111.69 -179.568 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 60.5 t-20 -92.2 100.18 12.84 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 108.759 -0.83 . . . . 42.57 108.759 179.57 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -62.2 -29.86 70.67 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.615 0.598 . . . . 45.53 112.615 -179.105 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . . . -78.28 32.87 0.19 Allowed 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 113.101 0.778 . . . . 50.79 113.101 -179.28 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 16.3 t -140.31 155.5 23.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 N-CA-C 108.575 -0.898 . . . . 48.59 108.575 179.397 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . . . -66.94 -39.2 87.26 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 113.249 0.833 . . . . 44.77 113.249 -179.244 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 45.2 p-10 -96.79 4.2 51.87 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 114.377 1.251 . . . . 49.98 114.377 -178.902 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 36.6 m 50.46 44.35 26.97 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.73 -0.47 . . . . 44.95 109.73 -179.513 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -46.36 134.88 8.6 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.915 0.709 . . . . 37.12 112.915 -179.22 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 43.6 t -69.3 116.91 11.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 N-CA-C 109.362 -0.607 . . . . 30.61 109.362 179.327 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ILE . . . . . 0.489 HD11 HG22 ' A' ' 31' ' ' ILE . 21.1 pt -98.28 -0.18 10.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.612 -0.267 . . . . 25.57 111.43 -179.916 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -175.59 145.9 0.74 Allowed 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.714 0.635 . . . . 22.78 112.714 179.426 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 25.1 p -151.19 125.01 9.11 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 106.965 -1.495 . . . . 28.36 106.965 178.86 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 -75.27 166.1 24.15 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.595 0.591 . . . . 26.05 112.595 -179.267 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -54.05 -37.94 64.68 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.88 -0.6 . . . . 30.56 112.492 -179.486 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' GLY . . . . . 0.416 ' O ' ' HG2' ' A' ' 28' ' ' LYS . . . -58.54 -45.23 94.83 Favored Glycine 0 CA--C 1.517 0.218 0 C-N-CA 120.957 -0.639 . . . . 27.45 114.567 -179.783 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 90.6 t80 -60.83 -54.35 46.15 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.073 0.463 . . . . 25.2 110.209 -179.964 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 87.3 m -50.78 -44.47 58.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.551 -0.75 . . . . 29.3 112.842 -179.567 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 90.9 mt-10 -69.38 -32.99 72.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.959 0.409 . . . . 45.41 110.783 179.991 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' LEU . . . . . 0.422 HD12 ' O ' ' A' ' 218' ' ' HOH . 13.1 tp -67.16 -52.28 43.41 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.991 -0.549 . . . . 31.58 111.983 -179.783 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 52' ' ' CYS . . . . . 0.506 ' HB2' HD21 ' A' ' 69' ' ' LEU . 25.2 p -81.16 -20.46 41.22 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.652 0.612 . . . . 30.86 112.652 -179.436 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 86.34 7.05 80.29 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.401 -0.904 . . . . 27.58 113.348 179.829 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 60.7 m-85 -102.88 147.08 27.34 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.38 -0.6 . . . . 24.86 109.38 179.734 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' SER . . . . . 0.447 ' OG ' ' HG3' ' A' ' 58' ' ' GLU . 15.8 p -82.25 156.85 24.14 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.537 0.569 . . . . 26.41 112.537 -179.143 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ARG . . . . . 0.511 ' O ' ' HG2' ' A' ' 60' ' ' MET . 37.4 ttm105 -53.86 -38.87 65.15 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 112.698 0.629 . . . . 24.47 112.698 -179.504 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.92 -32.03 73.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.665 -0.243 . . . . 25.74 111.52 -179.676 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' GLU . . . . . 0.447 ' HG3' ' OG ' ' A' ' 55' ' ' SER . 34.0 mt-10 -74.65 -45.98 41.12 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.85 0.357 . . . . 27.59 111.528 179.593 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 60.5 t -66.39 -42.06 89.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 N-CA-C 113.852 1.056 . . . . 25.99 113.852 -179.014 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' MET . . . . . 0.511 ' HG2' ' O ' ' A' ' 56' ' ' ARG . 42.6 mmm -47.55 136.71 9.76 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 113.686 0.995 . . . . 26.9 113.686 -179.301 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 68.9 mm-40 68.67 13.89 8.95 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 116.554 2.057 . . . . 36.23 116.554 178.57 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 79.4 mtt180 -103.17 150.93 38.37 Favored Pre-proline 0 C--N 1.326 -0.42 0 C-N-CA 120.825 -0.35 . . . . 48.9 110.351 179.888 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -49.03 124.25 11.19 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 121.25 1.3 . . . . 33.8 110.969 179.775 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 12.9 p -57.6 -4.03 0.23 Allowed 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 115.132 1.53 . . . . 32.98 115.132 -178.599 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 18.3 p -80.09 -9.73 59.72 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 108.68 -0.859 . . . . 27.12 108.68 178.792 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 60.5 m 49.26 61.37 3.17 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 113.371 0.878 . . . . 27.21 113.371 179.158 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 54.9 m-20 -66.22 -21.42 66.3 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.011 -0.54 . . . . 35.36 111.536 -179.804 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 45.8 p90 -69.98 -9.73 56.18 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.661 -0.415 . . . . 29.71 111.055 -179.894 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' LEU . . . . . 0.506 HD21 ' HB2' ' A' ' 52' ' ' CYS . 91.7 mt -97.14 -5.65 36.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.322 -0.399 . . . . 29.4 110.676 179.611 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 58.7 m170 -75.34 154.7 37.14 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 113.017 0.747 . . . . 34.54 113.017 -179.132 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -162.29 -160.41 11.05 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.537 -0.839 . . . . 37.95 113.267 -179.922 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' PRO . . . . . 0.485 ' HD2' ' CZ ' ' A' ' 99' ' ' TYR . 60.5 Cg_exo -49.52 -57.4 2.36 Favored 'Trans proline' 0 CA--C 1.526 0.121 0 C-N-CA 124.401 3.4 . . . . 39.07 115.89 -179.913 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 1.3 m -74.39 -12.94 60.65 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 115.225 1.565 . . . . 42.54 115.225 -178.801 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 8.2 m -59.91 113.95 2.56 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.699 -0.4 . . . . 40.17 110.752 -179.935 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . . . -75.16 131.13 40.24 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 113.479 0.918 . . . . 48.86 113.479 -179.55 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . . . -60.2 -32.46 71.12 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.98 -0.555 . . . . 40.86 111.497 -179.958 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . . . -73.39 -37.55 65.93 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.892 0.377 . . . . 39.0 110.179 179.716 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -66.31 -37.93 86.52 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.408 -0.589 . . . . 35.95 109.408 179.86 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -71.65 -46.51 58.79 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.951 -0.568 . . . . 34.44 110.982 179.895 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -58.73 -37.28 75.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.252 -0.431 . . . . 33.9 111.419 -179.874 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 13.4 mt-30 -62.49 -42.94 99.83 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.778 -0.452 . . . . 31.58 109.778 179.668 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 58.2 mt -65.67 -37.38 79.83 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.217 0 N-CA-C 109.342 -0.614 . . . . 29.34 109.342 179.908 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -65.8 -45.31 82.87 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.031 -0.531 . . . . 29.91 109.988 -179.974 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . . . -59.14 -47.03 86.77 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.018 -0.537 . . . . 30.92 110.885 -179.697 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -52.65 -47.59 66.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.094 -0.503 . . . . 31.97 110.593 179.865 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 77.9 mt -63.04 -37.11 85.88 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.177 -0.465 . . . . 35.4 111.532 -179.755 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.9 mt -65.64 -59.76 3.61 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.473 0.546 . . . . 42.51 112.473 -179.747 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -88.1 20.23 30.48 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.505 -0.855 . . . . 46.03 115.081 -179.251 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' ALA . . . . . 0.528 ' HB2' HG21 ' A' ' 122' ' ' VAL . . . 49.17 48.78 20.56 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 121.243 0.544 . . . . 47.16 110.192 -179.84 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . . . -92.96 135.51 34.09 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.731 -0.668 . . . . 47.47 111.532 -179.664 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -83.46 114.04 21.2 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 102.712 -3.07 . . . . 53.94 102.712 177.496 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 28.5 ttm180 -151.18 146.88 26.41 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 115.878 1.807 . . . . 41.89 115.878 -177.377 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 13.0 mttt -110.3 124.6 51.96 Favored 'General case' 0 N--CA 1.462 0.169 0 N-CA-C 108.192 -1.04 . . . . 36.0 108.192 178.925 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 20.3 t -127.48 129.45 70.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 N-CA-C 112.918 0.71 . . . . 32.18 112.918 -179.257 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -89.77 117.08 28.35 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 106.64 -1.615 . . . . 33.81 106.64 178.595 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 19.2 tt -134.77 144.87 33.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 120.979 0.418 . . . . 28.5 111.801 -178.438 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -81.28 116.65 21.24 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.304 -0.628 . . . . 29.08 109.304 179.754 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 -112.29 155.21 24.44 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.11 -0.496 . . . . 31.67 111.933 -179.343 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' TYR . . . . . 0.561 ' CE2' ' HB2' ' A' ' 105' ' ' CYS . 82.8 m-85 -123.82 127.49 48.14 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.862 -0.608 . . . . 35.6 110.859 179.869 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 100' ' ' ARG . . . . . 0.503 ' HB2' ' OD1' ' A' ' 102' ' ' ASP . 16.5 mtt85 -74.39 178.89 4.91 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.363 -0.381 . . . . 33.61 110.463 179.677 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 49.3 tttt -68.19 -27.27 66.26 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.46 -0.336 . . . . 41.27 111.285 -179.985 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' ASP . . . . . 0.506 ' OD1' ' HB3' ' A' ' 104' ' ' SER . 30.7 p-10 -81.46 9.32 7.57 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.972 -0.558 . . . . 40.46 111.034 179.967 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 84.72 -20.99 12.04 Favored Glycine 0 CA--C 1.519 0.296 0 C-N-CA 120.71 -0.757 . . . . 38.26 113.135 -179.994 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' SER . . . . . 0.506 ' HB3' ' OD1' ' A' ' 102' ' ' ASP . 2.8 t -51.94 144.61 11.38 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.919 0.39 . . . . 37.05 111.032 179.952 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 105' ' ' CYS . . . . . 0.561 ' HB2' ' CE2' ' A' ' 99' ' ' TYR . 54.0 t -112.73 144.56 42.05 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.141 -0.481 . . . . 35.84 110.704 -179.691 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 46.1 p90 -152.13 145.18 24.53 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.042 0.448 . . . . 34.51 111.778 179.42 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 18.7 tp -80.38 113.24 18.42 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 108.414 -0.958 . . . . 35.39 108.414 179.452 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 52.0 t -112.47 141.44 46.22 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 113.559 0.948 . . . . 29.8 113.559 -178.858 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 29.4 tp -104.8 108.4 19.86 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 107.309 -1.367 . . . . 26.17 107.309 178.321 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 80.0 t -88.19 130.73 37.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 121.167 0.508 . . . . 24.26 111.623 -179.836 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -113.06 98.23 7.02 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.768 -0.827 . . . . 29.9 108.768 179.808 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' VAL . . . . . 0.557 ' HA ' HD22 ' A' ' 127' ' ' LEU . 17.8 t -82.88 106.26 13.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 N-CA-C 109.659 -0.497 . . . . 24.13 109.659 179.371 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 40.1 t -112.62 100.31 50.03 Favored Pre-proline 0 C--N 1.329 -0.312 0 N-CA-C 112.447 0.536 . . . . 22.94 112.447 -179.609 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_exo -70.68 147.11 56.28 Favored 'Trans proline' 0 N--CA 1.465 -0.173 0 C-N-CA 120.291 0.661 . . . . 23.8 110.466 179.737 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 95.6 t -122.82 105.57 16.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 N-CA-C 109.888 -0.412 . . . . 28.41 109.888 179.658 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 11.5 mttm -100.6 161.94 13.26 Favored 'General case' 0 C--N 1.333 -0.149 0 N-CA-C 113.69 0.996 . . . . 38.58 113.69 -179.267 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' ASN . . . . . 1.029 ' HB3' HD11 ' A' ' 123' ' ' ILE . 34.2 p30 -99.42 -168.55 1.63 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.532 -0.758 . . . . 41.81 109.193 179.324 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . . . -61.05 -40.38 93.42 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 108.964 -0.754 . . . . 44.91 108.964 179.42 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . . . -70.16 -2.37 12.86 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.86 -0.609 . . . . 43.72 112.495 179.81 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 77.42 6.14 86.3 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.292 -0.956 . . . . 40.84 112.763 -179.981 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -80.4 138.09 36.6 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.463 -0.569 . . . . 36.87 109.463 179.527 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' VAL . . . . . 0.528 HG21 ' HB2' ' A' ' 89' ' ' ALA . 1.4 t -76.69 113.01 15.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 N-CA-C 109.681 -0.489 . . . . 34.04 109.681 179.482 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 123' ' ' ILE . . . . . 1.029 HD11 ' HB3' ' A' ' 117' ' ' ASN . 5.1 mt -85.06 -55.4 6.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.105 -0.498 . . . . 32.51 111.301 -179.791 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 8.9 ptt? -140.76 170.98 14.75 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.882 -0.599 . . . . 28.23 110.66 -179.826 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' PHE . . . . . 0.527 ' HB2' ' HB3' ' A' ' 32' ' ' ALA . 12.9 m-85 -121.3 148.99 43.59 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.423 -0.955 . . . . 27.26 108.423 179.619 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 50.5 mt -127.46 107.88 17.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 N-CA-C 106.814 -1.55 . . . . 25.83 106.814 178.198 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' LEU . . . . . 0.557 HD22 ' HA ' ' A' ' 112' ' ' VAL . 1.2 mt -101.21 125.62 47.85 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.27 -0.423 . . . . 25.98 109.861 179.462 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -111.77 126.84 55.5 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.389 -0.597 . . . . 31.19 109.389 179.976 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' PHE . . . . . 0.51 ' HE1' HG12 ' A' ' 30' ' ' ILE . 7.2 m-85 -108.97 143.21 38.54 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.173 -0.467 . . . . 24.39 109.844 -179.965 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . . . -149.75 136.73 19.56 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.475 -0.935 . . . . 30.16 108.475 179.346 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 31.9 t -77.59 124.04 35.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 121.01 0.433 . . . . 37.85 112.087 -179.564 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 55.7 t -91.2 -37.88 9.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.936 -0.574 . . . . 46.52 110.128 179.874 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 6.9 ttm -169.39 145.2 3.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.383 -0.371 . . . . 56.63 111.451 -179.517 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 53.8 mm-40 -89.05 125.14 34.88 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.199 -0.455 . . . . 59.87 111.192 -179.956 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 135' ' ' LYS . . . . . 0.499 ' HG3' ' O ' ' A' ' 135' ' ' LYS . 48.4 pttt . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.364 -0.827 . . . . 69.25 111.017 179.581 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 200' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud 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 0 . 1 . 001 ecloud build full ' A' A ' 218' ' ' HOH . . . . . 0.422 ' O ' HD12 ' A' ' 51' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 0 . 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 ' 26' ' ' SER . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.599 0 CA-C-O 121.076 0.465 . . . . 49.48 111.376 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.46 146.54 51.88 Favored 'General case' 0 C--O 1.241 0.634 0 N-CA-C 114.275 1.213 . . . . 50.8 114.275 -179.683 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.416 ' HG2' ' O ' ' A' ' 47' ' ' GLY . 6.7 mptt -137.63 110.35 7.59 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 105.626 -1.99 . . . . 36.26 105.626 178.759 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 34.8 p90 -141.93 172.4 12.75 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 113.319 0.859 . . . . 25.3 113.319 -178.635 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.51 HG12 ' HE1' ' A' ' 129' ' ' PHE . 9.8 pt -148.7 149.88 14.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.311 -0.859 . . . . 23.49 109.611 179.462 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.489 HG22 HD11 ' A' ' 42' ' ' ILE . 8.9 mt -112.92 127.56 70.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 N-CA-C 109.822 -0.436 . . . . 27.59 109.822 179.28 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.527 ' HB3' ' HB2' ' A' ' 125' ' ' PHE . . . -109.34 154.02 23.11 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.871 0.367 . . . . 34.22 111.69 -179.568 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 60.5 t-20 -92.2 100.18 12.84 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 108.759 -0.83 . . . . 42.57 108.759 179.57 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -62.2 -29.86 70.67 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.615 0.598 . . . . 45.53 112.615 -179.105 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . . . -78.28 32.87 0.19 Allowed 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 113.101 0.778 . . . . 50.79 113.101 -179.28 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 16.3 t -140.31 155.5 23.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 N-CA-C 108.575 -0.898 . . . . 48.59 108.575 179.397 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . . . -66.94 -39.2 87.26 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 113.249 0.833 . . . . 44.77 113.249 -179.244 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 45.2 p-10 -96.79 4.2 51.87 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 114.377 1.251 . . . . 49.98 114.377 -178.902 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 36.6 m 50.46 44.35 26.97 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.73 -0.47 . . . . 44.95 109.73 -179.513 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -46.36 134.88 8.6 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.915 0.709 . . . . 37.12 112.915 -179.22 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 43.6 t -69.3 116.91 11.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 N-CA-C 109.362 -0.607 . . . . 30.61 109.362 179.327 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.489 HD11 HG22 ' A' ' 31' ' ' ILE . 21.1 pt -98.28 -0.18 10.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.612 -0.267 . . . . 25.57 111.43 -179.916 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -175.59 145.9 0.74 Allowed 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.714 0.635 . . . . 22.78 112.714 179.426 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 25.1 p -151.19 125.01 9.11 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 106.965 -1.495 . . . . 28.36 106.965 178.86 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 -75.27 166.1 24.15 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.595 0.591 . . . . 26.05 112.595 -179.267 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -54.05 -37.94 64.68 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.88 -0.6 . . . . 30.56 112.492 -179.486 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.416 ' O ' ' HG2' ' A' ' 28' ' ' LYS . . . -58.54 -45.23 94.83 Favored Glycine 0 CA--C 1.517 0.218 0 C-N-CA 120.957 -0.639 . . . . 27.45 114.567 -179.783 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 90.6 t80 -60.83 -54.35 46.15 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.073 0.463 . . . . 25.2 110.209 -179.964 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 87.3 m -50.78 -44.47 58.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.551 -0.75 . . . . 29.3 112.842 -179.567 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 90.9 mt-10 -69.38 -32.99 72.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.959 0.409 . . . . 45.41 110.783 179.991 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.422 HD12 ' O ' ' A' ' 218' ' ' HOH . 13.1 tp -67.16 -52.28 43.41 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.991 -0.549 . . . . 31.58 111.983 -179.783 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.506 ' HB2' HD21 ' A' ' 69' ' ' LEU . 25.2 p -81.16 -20.46 41.22 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.652 0.612 . . . . 30.86 112.652 -179.436 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 86.34 7.05 80.29 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.401 -0.904 . . . . 27.58 113.348 179.829 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 60.7 m-85 -102.88 147.08 27.34 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.38 -0.6 . . . . 24.86 109.38 179.734 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' SER . . . . . 0.447 ' OG ' ' HG3' ' A' ' 58' ' ' GLU . 15.8 p -82.25 156.85 24.14 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.537 0.569 . . . . 26.41 112.537 -179.143 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.511 ' O ' ' HG2' ' A' ' 60' ' ' MET . 37.4 ttm105 -53.86 -38.87 65.15 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 112.698 0.629 . . . . 24.47 112.698 -179.504 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -64.92 -32.03 73.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.665 -0.243 . . . . 25.74 111.52 -179.676 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.447 ' HG3' ' OG ' ' A' ' 55' ' ' SER . 34.0 mt-10 -74.65 -45.98 41.12 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.85 0.357 . . . . 27.59 111.528 179.593 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 60.5 t -66.39 -42.06 89.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 N-CA-C 113.852 1.056 . . . . 25.99 113.852 -179.014 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' MET . . . . . 0.511 ' HG2' ' O ' ' A' ' 56' ' ' ARG . 42.6 mmm -47.55 136.71 9.76 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 113.686 0.995 . . . . 26.9 113.686 -179.301 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 68.9 mm-40 68.67 13.89 8.95 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 116.554 2.057 . . . . 36.23 116.554 178.57 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 79.4 mtt180 -103.17 150.93 38.37 Favored Pre-proline 0 C--N 1.326 -0.42 0 C-N-CA 120.825 -0.35 . . . . 48.9 110.351 179.888 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -49.03 124.25 11.19 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 121.25 1.3 . . . . 33.8 110.969 179.775 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 12.9 p -57.6 -4.03 0.23 Allowed 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 115.132 1.53 . . . . 32.98 115.132 -178.599 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 18.3 p -80.09 -9.73 59.72 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 108.68 -0.859 . . . . 27.12 108.68 178.792 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 60.5 m 49.26 61.37 3.17 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 113.371 0.878 . . . . 27.21 113.371 179.158 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 54.9 m-20 -66.22 -21.42 66.3 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.011 -0.54 . . . . 35.36 111.536 -179.804 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 45.8 p90 -69.98 -9.73 56.18 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.661 -0.415 . . . . 29.71 111.055 -179.894 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.506 HD21 ' HB2' ' A' ' 52' ' ' CYS . 91.7 mt -97.14 -5.65 36.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.322 -0.399 . . . . 29.4 110.676 179.611 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 58.7 m170 -75.34 154.7 37.14 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 113.017 0.747 . . . . 34.54 113.017 -179.132 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -162.29 -160.41 11.05 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.537 -0.839 . . . . 37.95 113.267 -179.922 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.485 ' HD2' ' CZ ' ' A' ' 99' ' ' TYR . 60.5 Cg_exo -49.52 -57.4 2.36 Favored 'Trans proline' 0 CA--C 1.526 0.121 0 C-N-CA 124.401 3.4 . . . . 39.07 115.89 -179.913 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 1.3 m -74.39 -12.94 60.65 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 115.225 1.565 . . . . 42.54 115.225 -178.801 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 8.2 m -59.91 113.95 2.56 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.699 -0.4 . . . . 40.17 110.752 -179.935 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . . . -75.16 131.13 40.24 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 113.479 0.918 . . . . 48.86 113.479 -179.55 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . . . -60.2 -32.46 71.12 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.98 -0.555 . . . . 40.86 111.497 -179.958 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . . . -73.39 -37.55 65.93 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.892 0.377 . . . . 39.0 110.179 179.716 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -66.31 -37.93 86.52 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.408 -0.589 . . . . 35.95 109.408 179.86 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -71.65 -46.51 58.79 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.951 -0.568 . . . . 34.44 110.982 179.895 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -58.73 -37.28 75.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.252 -0.431 . . . . 33.9 111.419 -179.874 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 13.4 mt-30 -62.49 -42.94 99.83 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.778 -0.452 . . . . 31.58 109.778 179.668 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 58.2 mt -65.67 -37.38 79.83 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.217 0 N-CA-C 109.342 -0.614 . . . . 29.34 109.342 179.908 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -65.8 -45.31 82.87 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.031 -0.531 . . . . 29.91 109.988 -179.974 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . . . -59.14 -47.03 86.77 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.018 -0.537 . . . . 30.92 110.885 -179.697 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -52.65 -47.59 66.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.094 -0.503 . . . . 31.97 110.593 179.865 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 77.9 mt -63.04 -37.11 85.88 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.177 -0.465 . . . . 35.4 111.532 -179.755 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.9 mt -65.64 -59.76 3.61 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.473 0.546 . . . . 42.51 112.473 -179.747 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -88.1 20.23 30.48 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.505 -0.855 . . . . 46.03 115.081 -179.251 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.528 ' HB2' HG21 ' A' ' 122' ' ' VAL . . . 49.17 48.78 20.56 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 121.243 0.544 . . . . 47.16 110.192 -179.84 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . . . -92.96 135.51 34.09 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.731 -0.668 . . . . 47.47 111.532 -179.664 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -83.46 114.04 21.2 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 102.712 -3.07 . . . . 53.94 102.712 177.496 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 28.5 ttm180 -151.18 146.88 26.41 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 115.878 1.807 . . . . 41.89 115.878 -177.377 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 13.0 mttt -110.3 124.6 51.96 Favored 'General case' 0 N--CA 1.462 0.169 0 N-CA-C 108.192 -1.04 . . . . 36.0 108.192 178.925 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 20.3 t -127.48 129.45 70.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 N-CA-C 112.918 0.71 . . . . 32.18 112.918 -179.257 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -89.77 117.08 28.35 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 106.64 -1.615 . . . . 33.81 106.64 178.595 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 19.2 tt -134.77 144.87 33.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 120.979 0.418 . . . . 28.5 111.801 -178.438 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -81.28 116.65 21.24 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.304 -0.628 . . . . 29.08 109.304 179.754 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 -112.29 155.21 24.44 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.11 -0.496 . . . . 31.67 111.933 -179.343 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.561 ' CE2' ' HB2' ' A' ' 105' ' ' CYS . 82.8 m-85 -123.82 127.49 48.14 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.862 -0.608 . . . . 35.6 110.859 179.869 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' ARG . . . . . 0.503 ' HB2' ' OD1' ' A' ' 102' ' ' ASP . 16.5 mtt85 -74.39 178.89 4.91 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.363 -0.381 . . . . 33.61 110.463 179.677 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 49.3 tttt -68.19 -27.27 66.26 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.46 -0.336 . . . . 41.27 111.285 -179.985 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' ASP . . . . . 0.506 ' OD1' ' HB3' ' A' ' 104' ' ' SER . 30.7 p-10 -81.46 9.32 7.57 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.972 -0.558 . . . . 40.46 111.034 179.967 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 84.72 -20.99 12.04 Favored Glycine 0 CA--C 1.519 0.296 0 C-N-CA 120.71 -0.757 . . . . 38.26 113.135 -179.994 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' SER . . . . . 0.506 ' HB3' ' OD1' ' A' ' 102' ' ' ASP . 2.8 t -51.94 144.61 11.38 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.919 0.39 . . . . 37.05 111.032 179.952 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' CYS . . . . . 0.561 ' HB2' ' CE2' ' A' ' 99' ' ' TYR . 54.0 t -112.73 144.56 42.05 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.141 -0.481 . . . . 35.84 110.704 -179.691 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 46.1 p90 -152.13 145.18 24.53 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.042 0.448 . . . . 34.51 111.778 179.42 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 18.7 tp -80.38 113.24 18.42 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 108.414 -0.958 . . . . 35.39 108.414 179.452 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 52.0 t -112.47 141.44 46.22 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 113.559 0.948 . . . . 29.8 113.559 -178.858 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 29.4 tp -104.8 108.4 19.86 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 107.309 -1.367 . . . . 26.17 107.309 178.321 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 80.0 t -88.19 130.73 37.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 121.167 0.508 . . . . 24.26 111.623 -179.836 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -113.06 98.23 7.02 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.768 -0.827 . . . . 29.9 108.768 179.808 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' VAL . . . . . 0.557 ' HA ' HD22 ' A' ' 127' ' ' LEU . 17.8 t -82.88 106.26 13.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 N-CA-C 109.659 -0.497 . . . . 24.13 109.659 179.371 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 40.1 t -112.62 100.31 50.03 Favored Pre-proline 0 C--N 1.329 -0.312 0 N-CA-C 112.447 0.536 . . . . 22.94 112.447 -179.609 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_exo -70.68 147.11 56.28 Favored 'Trans proline' 0 N--CA 1.465 -0.173 0 C-N-CA 120.291 0.661 . . . . 23.8 110.466 179.737 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 95.6 t -122.82 105.57 16.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 N-CA-C 109.888 -0.412 . . . . 28.41 109.888 179.658 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 11.5 mttm -100.6 161.94 13.26 Favored 'General case' 0 C--N 1.333 -0.149 0 N-CA-C 113.69 0.996 . . . . 38.58 113.69 -179.267 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' ASN . . . . . 1.029 ' HB3' HD11 ' A' ' 123' ' ' ILE . 34.2 p30 -99.42 -168.55 1.63 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.532 -0.758 . . . . 41.81 109.193 179.324 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . . . -61.05 -40.38 93.42 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 108.964 -0.754 . . . . 44.91 108.964 179.42 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . . . -70.16 -2.37 12.86 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.86 -0.609 . . . . 43.72 112.495 179.81 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 77.42 6.14 86.3 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.292 -0.956 . . . . 40.84 112.763 -179.981 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -80.4 138.09 36.6 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.463 -0.569 . . . . 36.87 109.463 179.527 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' VAL . . . . . 0.528 HG21 ' HB2' ' A' ' 89' ' ' ALA . 1.4 t -76.69 113.01 15.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 N-CA-C 109.681 -0.489 . . . . 34.04 109.681 179.482 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' ILE . . . . . 1.029 HD11 ' HB3' ' A' ' 117' ' ' ASN . 5.1 mt -85.06 -55.4 6.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.105 -0.498 . . . . 32.51 111.301 -179.791 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 8.9 ptt? -140.76 170.98 14.75 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.882 -0.599 . . . . 28.23 110.66 -179.826 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' PHE . . . . . 0.527 ' HB2' ' HB3' ' A' ' 32' ' ' ALA . 12.9 m-85 -121.3 148.99 43.59 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.423 -0.955 . . . . 27.26 108.423 179.619 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 50.5 mt -127.46 107.88 17.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 N-CA-C 106.814 -1.55 . . . . 25.83 106.814 178.198 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.557 HD22 ' HA ' ' A' ' 112' ' ' VAL . 1.2 mt -101.21 125.62 47.85 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.27 -0.423 . . . . 25.98 109.861 179.462 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -111.77 126.84 55.5 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.389 -0.597 . . . . 31.19 109.389 179.976 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' PHE . . . . . 0.51 ' HE1' HG12 ' A' ' 30' ' ' ILE . 7.2 m-85 -108.97 143.21 38.54 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.173 -0.467 . . . . 24.39 109.844 -179.965 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . . . -149.75 136.73 19.56 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.475 -0.935 . . . . 30.16 108.475 179.346 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 31.9 t -77.59 124.04 35.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 121.01 0.433 . . . . 37.85 112.087 -179.564 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 55.7 t -91.2 -37.88 9.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.936 -0.574 . . . . 46.52 110.128 179.874 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 6.9 ttm -169.39 145.2 3.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.383 -0.371 . . . . 56.63 111.451 -179.517 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 53.8 mm-40 -89.05 125.14 34.88 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.199 -0.455 . . . . 59.87 111.192 -179.956 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' LYS . . . . . 0.499 ' HG3' ' O ' ' A' ' 135' ' ' LYS . 48.4 pttt . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.364 -0.827 . . . . 69.25 111.017 179.581 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 200' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 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 0 . 1 . 001 ecloud nobuild full ' A' A ' 218' ' ' HOH . . . . . 0.422 ' O ' HD12 ' A' ' 51' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 0 . 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_