data_1qys_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 1qys _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 ' 3' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 . . . . . 0 N--CA 1.491 1.598 0 N-CA-C 113.497 0.925 . . . . 174.51 113.497 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 49.4 mt -91.39 111.06 23.32 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.312 0 CA-C-O 121.762 0.792 . . . . 57.73 112.833 -179.785 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' GLN . . . . . 0.429 ' CA ' ' NE2' ' A' ' 5' ' ' GLN . 2.2 tp-100 -101.0 116.17 32.22 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 114.578 -1.192 . . . . 87.59 112.386 -179.492 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 49.0 t -105.91 115.83 48.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-O 121.299 0.571 . . . . 61.01 112.049 179.517 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -112.13 114.87 27.95 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.056 -0.72 . . . . 83.92 109.056 179.706 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 63.5 t -111.95 117.76 55.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.989 -0.55 . . . . 45.42 109.566 178.896 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' ASN . . . . . 0.483 ' OD1' ' OD1' ' A' ' 18' ' ' ASP . 1.6 t30 -122.64 108.89 13.61 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 121.821 0.819 . . . . 105.47 112.277 -179.986 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 57.1 mt -106.83 117.89 53.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.281 -0.872 . . . . 70.73 111.984 -179.704 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -109.79 143.81 39.1 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 116.272 -0.422 . . . . 114.14 109.862 179.322 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -168.83 80.22 0.14 Allowed 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 120.204 -0.599 . . . . 70.35 112.443 -177.311 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.4 m120 43.86 102.49 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 115.565 1.691 . . . . 100.93 115.565 178.537 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 56.52 16.87 17.51 Favored Glycine 0 C--N 1.332 0.345 0 N-CA-C 115.978 1.151 . . . . 130.92 115.978 178.913 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . . . -146.94 107.24 4.04 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 110.109 -0.33 . . . . 68.27 110.109 179.701 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 54.4 t30 -115.63 125.65 53.18 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 121.118 0.485 . . . . 102.09 109.813 179.114 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . . . -112.31 132.56 54.9 Favored 'General case' 0 CA--C 1.518 -0.265 0 N-CA-C 107.911 -1.144 . . . . 42.25 107.911 179.531 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ASP . . . . . 0.483 ' OD1' ' OD1' ' A' ' 9' ' ' ASN . 35.9 t70 -125.89 103.47 7.79 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 122.852 0.461 . . . . 89.81 110.821 179.99 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 94.2 m-85 -100.82 126.41 47.39 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 122.85 0.46 . . . . 87.94 110.334 -179.0 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 4.6 m -124.47 123.97 41.29 Favored 'General case' 0 CA--C 1.515 -0.372 0 N-CA-C 108.209 -1.034 . . . . 57.6 108.209 179.545 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -128.2 162.32 27.25 Favored 'General case' 0 N--CA 1.464 0.269 0 N-CA-C 108.027 -1.101 . . . . 63.74 108.027 179.668 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.2 m -139.81 113.06 8.3 Favored 'General case' 0 CA--C 1.506 -0.742 0 N-CA-C 103.669 -2.715 . . . . 67.33 103.669 178.563 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 29.8 m -118.53 169.59 9.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 C-N-CA 120.103 -0.639 . . . . 71.7 111.949 -179.776 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' THR . . . . . 0.489 ' O ' ' OG1' ' A' ' 25' ' ' THR . 39.0 m -158.71 81.0 0.8 Allowed 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 105.956 -1.868 . . . . 95.26 105.956 178.835 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' THR . . . . . 0.565 ' C ' ' N ' ' A' ' 27' ' ' SER . 0.2 OUTLIER -176.78 -36.94 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.767 0.654 . . . . 146.88 112.767 -179.836 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 68.87 -7.45 0.75 Allowed 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 103.665 -2.717 . . . . 187.15 103.665 -176.319 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' SER . . . . . 0.565 ' N ' ' C ' ' A' ' 25' ' ' THR . . . -100.1 -50.62 3.92 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 104.534 -2.395 . . . . 116.53 104.534 177.899 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 -76.82 1.46 17.3 Favored 'General case' 0 CA--C 1.522 -0.134 0 N-CA-C 106.529 -1.656 . . . . 200.03 106.529 178.295 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -83.94 -40.25 18.77 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 104.381 -2.451 . . . . 97.2 104.381 178.208 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . . . -62.67 -25.19 68.02 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 107.21 -1.404 . . . . 113.13 107.21 178.792 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . . . -73.61 -44.51 56.92 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.66 -0.7 . . . . 80.64 109.686 179.989 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 72.1 t -68.42 -45.4 82.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 N-CA-C 107.653 -1.24 . . . . 56.38 107.653 179.204 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 13.1 mt -54.49 -65.42 0.58 Allowed 'General case' 0 CA--C 1.511 -0.539 0 CA-C-N 115.41 -0.814 . . . . 55.92 109.976 179.708 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . . . -47.25 -45.86 24.08 Favored 'General case' 0 N--CA 1.455 -0.175 0 O-C-N 123.635 0.584 . . . . 69.48 109.495 179.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 68.3 tt0 -59.91 -41.32 91.42 Favored 'General case' 0 C--O 1.239 0.529 0 N-CA-C 113.245 0.832 . . . . 129.81 113.245 -179.042 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . . . -69.3 -36.35 76.91 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 119.789 -0.764 . . . . 61.28 110.747 179.947 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' MSE . . . . . . . . . . . . . 46.1 mtp -53.26 -40.58 64.75 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 115.599 -0.728 . . . . 57.27 110.094 179.513 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -72.2 -51.47 21.01 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 120.093 -0.643 . . . . 94.79 112.445 179.877 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 40.4 m-85 -48.67 -43.07 36.48 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 119.631 -0.828 . . . . 104.8 110.664 179.184 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -76.3 -35.24 27.1 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 N-CA-C 114.06 1.133 . . . . 76.7 114.06 -178.036 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 79.9 mttt -56.58 -53.19 60.52 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 104.969 -2.234 . . . . 66.42 104.969 177.63 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 63.5 tttp -54.4 -57.24 12.05 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 114.632 -1.167 . . . . 200.03 113.573 -179.73 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -65.59 -31.3 72.27 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 113.716 1.006 . . . . 126.98 113.716 -178.441 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 45.66 59.79 4.65 Favored Glycine 0 C--N 1.334 0.439 0 C-N-CA 121.088 -0.577 . . . . 55.22 111.966 -179.385 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ALA . . . . . 0.517 ' N ' ' O ' ' A' ' 107' ' ' HOH . . . -86.41 152.4 22.73 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 112.444 0.535 . . . . 48.7 112.444 -179.204 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . . . -65.22 -49.76 68.44 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.78 -0.645 . . . . 100.71 109.777 -179.692 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . . . -115.58 132.82 56.51 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 113.725 1.009 . . . . 55.3 113.725 -178.897 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 23.5 t -135.86 129.64 48.23 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 C-N-CA 123.471 0.708 . . . . 43.03 110.857 179.368 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 11.0 ttm180 -121.61 135.82 54.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.525 0.679 . . . . 83.41 111.043 -179.072 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 16.9 mt -138.03 124.59 27.01 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.938 0 N-CA-C 107.878 -1.156 . . . . 31.16 107.878 177.894 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 34.5 p -126.27 136.14 52.41 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.418 -0.956 . . . . 38.78 108.418 177.985 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 76.7 mt -125.6 121.43 60.07 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.602 0 CA-C-N 114.898 -1.046 . . . . 47.52 109.658 -178.608 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 48.7 m -90.11 109.8 20.84 Favored 'General case' 0 N--CA 1.443 -0.822 0 N-CA-C 105.955 -1.869 . . . . 55.53 105.955 179.255 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -95.2 176.01 6.39 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.149 -0.932 . . . . 54.3 110.284 -179.63 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ARG . . . . . 0.591 ' N ' ' OE1' ' A' ' 59' ' ' GLU . . . -82.04 -35.34 28.89 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.346 -0.388 . . . . 74.08 110.813 179.748 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 68.6 p -137.38 150.27 47.57 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 120.678 0.275 . . . . 61.95 110.478 179.401 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 38.6 tttt -55.95 -35.13 66.33 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.758 0.651 . . . . 79.8 112.758 179.895 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 20.7 mtpp -66.63 -23.19 66.13 Favored 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 109.513 -0.551 . . . . 120.41 109.513 179.568 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' GLU . . . . . 0.591 ' OE1' ' N ' ' A' ' 55' ' ' ARG . 38.0 tt0 -78.17 -46.85 19.45 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 107.397 -1.334 . . . . 68.19 107.397 178.489 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -51.87 -31.47 28.12 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.446 -0.797 . . . . 49.39 110.41 179.118 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -70.98 -47.52 58.43 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 115.501 -0.772 . . . . 78.01 109.648 -179.83 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . . . -57.9 -36.26 72.19 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 108.536 -0.913 . . . . 51.31 108.536 179.553 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 10.3 m-30 -72.14 -37.62 69.4 Favored 'General case' 0 CA--C 1.51 -0.56 0 CA-C-N 116.327 -0.397 . . . . 47.9 111.599 -179.571 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -64.06 -37.24 86.72 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 107.831 -1.174 . . . . 43.04 107.831 179.247 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -64.07 -39.41 94.0 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 108.701 -0.852 . . . . 46.89 108.701 178.589 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 16.8 mt -65.32 -51.4 65.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 121.433 0.635 . . . . 53.42 111.008 179.108 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 79.1 mt -62.82 -27.84 69.6 Favored 'General case' 0 N--CA 1.443 -0.821 0 CA-C-N 115.697 -0.683 . . . . 37.91 112.574 -178.646 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 3.8 mt -67.05 -45.69 86.29 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.68 0 C-N-CA 118.904 -1.118 . . . . 44.65 110.464 -179.686 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 89.3 mttt -64.76 -36.0 82.88 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.568 -0.53 . . . . 60.8 109.568 179.827 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 25.6 t -60.27 -56.16 19.43 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 C-N-CA 121.002 -0.279 . . . . 46.67 110.513 178.497 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -60.21 -39.99 88.51 Favored 'General case' 0 C--O 1.234 0.25 0 C-N-CA 123.033 0.533 . . . . 47.43 112.41 179.479 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.8 -55.93 19.35 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.731 -0.47 . . . . 53.65 109.731 -179.469 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . . . -51.88 -49.23 63.37 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 108.991 -0.744 . . . . 50.89 108.991 179.602 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 23.3 mt -71.59 16.9 0.1 Allowed 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 114.853 1.427 . . . . 51.78 114.853 -179.966 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 80.04 -2.95 73.17 Favored Glycine 0 N--CA 1.451 -0.337 0 N-CA-C 119.836 2.694 . . . . 38.15 119.836 177.909 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 78.7 m-85 -78.97 121.57 25.08 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 102.789 -3.041 . . . . 50.24 102.789 177.234 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -120.1 -3.84 10.07 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 120.276 3.435 . . . . 96.49 120.276 -176.415 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -117.66 91.68 3.64 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 103.764 -2.68 . . . . 108.13 103.764 176.007 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 30.8 mt -105.0 138.11 31.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 118.338 2.718 . . . . 35.39 118.338 -175.369 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 15.1 m120 -108.44 127.63 54.08 Favored 'General case' 0 CA--C 1.514 -0.432 0 N-CA-C 106.553 -1.647 . . . . 68.24 106.553 177.269 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 75.2 t -116.93 121.82 68.63 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.721 0 N-CA-C 104.032 -2.581 . . . . 31.42 104.032 178.204 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 65.6 m -128.48 128.84 45.14 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.953 0.406 . . . . 46.66 110.557 -179.975 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -105.37 136.0 45.72 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 106.57 -1.641 . . . . 57.37 106.57 177.673 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -133.87 90.05 2.65 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 104.032 -2.581 . . . . 115.57 104.032 178.507 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 70.78 -113.59 4.86 Favored Glycine 0 N--CA 1.446 -0.668 0 N-CA-C 108.714 -1.754 . . . . 51.12 108.714 -178.829 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 40.9 m-20 -106.05 6.46 31.17 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-O 121.091 0.472 . . . . 84.41 111.493 -179.847 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 54.8 m -101.26 123.35 45.24 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 115.131 -0.941 . . . . 59.15 111.259 179.09 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 10.9 p -106.54 134.21 48.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 108.822 -0.807 . . . . 36.77 108.822 176.659 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 26.6 m -122.96 105.72 10.22 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.828 -0.624 . . . . 51.33 111.828 179.857 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 43.7 t -100.75 116.03 43.45 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.33 0 N-CA-C 107.557 -1.275 . . . . 33.06 107.557 178.315 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -117.98 127.64 54.02 Favored 'General case' 0 C--O 1.238 0.486 0 N-CA-C 108.391 -0.966 . . . . 115.49 108.391 178.527 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -123.38 158.51 18.0 Favored Glycine 0 N--CA 1.444 -0.798 0 C-N-CA 119.514 -1.327 . . . . 57.29 113.866 179.208 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 37.8 mt-30 -124.1 140.75 52.67 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 107.691 -1.225 . . . . 87.1 107.691 177.195 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 4.8 tp . . . . . 0 C--O 1.254 1.334 0 N-CA-C 114.313 1.227 . . . . 78.23 114.313 -178.032 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' HOH . . . . . 0.517 ' O ' ' N ' ' A' ' 45' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 . . . . . 0 N--CA 1.491 1.598 0 N-CA-C 113.497 0.925 . . . . 174.50999999999999 113.497 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 49.4 mt -91.39 111.06 23.32 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.312 0 CA-C-O 121.762 0.792 . . . . 57.729999999999997 112.833 -179.785 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' GLN . . . . . 0.443 ' NE2' ' CG2' ' A' ' 20' ' ' THR . 27.1 tp60 -101.0 116.17 32.22 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 114.578 -1.192 . . . . 87.590000000000003 112.386 -179.492 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 49.0 t -105.91 115.83 48.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-O 121.299 0.571 . . . . 61.009999999999998 112.049 179.517 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -112.13 114.87 27.95 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.056 -0.72 . . . . 83.920000000000002 109.056 179.706 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 8' ' ' VAL . . . . . 0.567 ' HB ' ' HB2' ' A' ' 19' ' ' TYR . 63.5 t -111.95 117.76 55.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.989 -0.55 . . . . 45.420000000000002 109.566 178.896 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 9' ' ' ASN . . . . . 0.619 ' ND2' ' OD1' ' A' ' 18' ' ' ASP . 1.0 OUTLIER -122.64 108.89 13.61 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 121.821 0.819 . . . . 105.47 112.277 -179.986 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 57.1 mt -106.83 117.89 53.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.281 -0.872 . . . . 70.730000000000004 111.984 -179.704 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -109.79 143.81 39.1 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 116.272 -0.422 . . . . 114.14 109.862 179.322 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -168.83 80.22 0.14 Allowed 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 120.204 -0.599 . . . . 70.349999999999994 112.443 -177.311 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.4 m120 43.86 102.49 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 115.565 1.691 . . . . 100.93000000000001 115.565 178.537 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 56.52 16.87 17.51 Favored Glycine 0 C--N 1.332 0.345 0 N-CA-C 115.978 1.151 . . . . 130.91999999999999 115.978 178.913 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . . . -146.94 107.24 4.04 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 110.109 -0.33 . . . . 68.269999999999996 110.109 179.701 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -115.63 125.65 53.18 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 121.118 0.485 . . . . 102.09 109.813 179.114 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . . . -112.31 132.56 54.9 Favored 'General case' 0 CA--C 1.518 -0.265 0 N-CA-C 107.911 -1.144 . . . . 42.25 107.911 179.531 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ASP . . . . . 0.619 ' OD1' ' ND2' ' A' ' 9' ' ' ASN . 35.9 t70 -125.89 103.47 7.79 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 122.852 0.461 . . . . 89.810000000000002 110.821 179.99 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 19' ' ' TYR . . . . . 0.567 ' HB2' ' HB ' ' A' ' 8' ' ' VAL . 94.2 m-85 -100.82 126.41 47.39 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 122.85 0.46 . . . . 87.939999999999998 110.334 -179.0 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 20' ' ' THR . . . . . 0.443 ' CG2' ' NE2' ' A' ' 5' ' ' GLN . 4.6 m -124.47 123.97 41.29 Favored 'General case' 0 CA--C 1.515 -0.372 0 N-CA-C 108.209 -1.034 . . . . 57.600000000000001 108.209 179.545 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -128.2 162.32 27.25 Favored 'General case' 0 N--CA 1.464 0.269 0 N-CA-C 108.027 -1.101 . . . . 63.740000000000002 108.027 179.668 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.2 m -139.81 113.06 8.3 Favored 'General case' 0 CA--C 1.506 -0.742 0 N-CA-C 103.669 -2.715 . . . . 67.329999999999998 103.669 178.563 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 29.8 m -118.53 169.59 9.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 C-N-CA 120.103 -0.639 . . . . 71.700000000000003 111.949 -179.776 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' THR . . . . . 0.482 ' O ' ' OG1' ' A' ' 25' ' ' THR . 39.0 m -158.71 81.0 0.8 Allowed 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 105.956 -1.868 . . . . 95.260000000000005 105.956 178.835 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 25' ' ' THR . . . . . 0.743 ' HB ' ' H ' ' A' ' 28' ' ' GLU . 0.2 OUTLIER -176.78 -36.94 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.767 0.654 . . . . 146.88 112.767 -179.836 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 26' ' ' GLU . . . . . 0.438 ' HB3' ' O ' ' A' ' 25' ' ' THR . 30.9 tt0 68.87 -7.45 0.75 Allowed 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 103.665 -2.717 . . . . 187.15000000000001 103.665 -176.319 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 27' ' ' SER . . . . . 0.73 ' H ' ' C ' ' A' ' 25' ' ' THR . . . -100.1 -50.62 3.92 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 104.534 -2.395 . . . . 116.53 104.534 177.899 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 28' ' ' GLU . . . . . 0.743 ' H ' ' HB ' ' A' ' 25' ' ' THR . 16.5 pt-20 -76.82 1.46 17.3 Favored 'General case' 0 CA--C 1.522 -0.134 0 N-CA-C 106.529 -1.656 . . . . 200.03 106.529 178.295 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 29' ' ' LEU . . . . . 0.598 HD22 ' HG ' ' A' ' 33' ' ' LEU . 0.4 OUTLIER -83.94 -40.25 18.77 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 104.381 -2.451 . . . . 97.200000000000003 104.381 178.208 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . . . -62.67 -25.19 68.02 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 107.21 -1.404 . . . . 113.13 107.21 178.792 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . . . -73.61 -44.51 56.92 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.66 -0.7 . . . . 80.640000000000001 109.686 179.989 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 72.1 t -68.42 -45.4 82.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 N-CA-C 107.653 -1.24 . . . . 56.380000000000003 107.653 179.204 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' LEU . . . . . 0.598 ' HG ' HD22 ' A' ' 29' ' ' LEU . 13.1 mt -54.49 -65.42 0.58 Allowed 'General case' 0 CA--C 1.511 -0.539 0 CA-C-N 115.41 -0.814 . . . . 55.920000000000002 109.976 179.708 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . . . -47.25 -45.86 24.08 Favored 'General case' 0 N--CA 1.455 -0.175 0 O-C-N 123.635 0.584 . . . . 69.480000000000004 109.495 179.921 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 68.3 tt0 -59.91 -41.32 91.42 Favored 'General case' 0 C--O 1.239 0.529 0 N-CA-C 113.245 0.832 . . . . 129.81 113.245 -179.042 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' LEU . . . . . 0.741 ' O ' HG23 ' A' ' 40' ' ' ILE . . . -69.3 -36.35 76.91 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 119.789 -0.764 . . . . 61.280000000000001 110.747 179.947 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 37' ' ' MSE . . . . . 0.748 ' HE2' HD21 ' A' ' 74' ' ' LEU . 46.1 mtp -53.26 -40.58 64.75 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 115.599 -0.728 . . . . 57.270000000000003 110.094 179.513 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -72.2 -51.47 21.01 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 120.093 -0.643 . . . . 94.790000000000006 112.445 179.877 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 40.4 m-85 -48.67 -43.07 36.48 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 119.631 -0.828 . . . . 104.8 110.664 179.184 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ILE . . . . . 0.741 HG23 ' O ' ' A' ' 36' ' ' LEU . 0.7 OUTLIER -76.3 -35.24 27.1 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 N-CA-C 114.06 1.133 . . . . 76.700000000000003 114.06 -178.036 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 79.9 mttt -56.58 -53.19 60.52 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 104.969 -2.234 . . . . 66.420000000000002 104.969 177.63 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 63.5 tttp -54.4 -57.24 12.05 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 114.632 -1.167 . . . . 200.03 113.573 -179.73 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.59 -31.3 72.27 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 113.716 1.006 . . . . 126.98 113.716 -178.441 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 45.66 59.79 4.65 Favored Glycine 0 C--N 1.334 0.439 0 C-N-CA 121.088 -0.577 . . . . 55.219999999999999 111.966 -179.385 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -86.41 152.4 22.73 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 112.444 0.535 . . . . 48.700000000000003 112.444 -179.204 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . . . -65.22 -49.76 68.44 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.78 -0.645 . . . . 100.70999999999999 109.777 -179.692 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . . . -115.58 132.82 56.51 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 113.725 1.009 . . . . 55.299999999999997 113.725 -178.897 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 23.5 t -135.86 129.64 48.23 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 C-N-CA 123.471 0.708 . . . . 43.030000000000001 110.857 179.368 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 11.0 ttm180 -121.61 135.82 54.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.525 0.679 . . . . 83.409999999999997 111.043 -179.072 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 16.9 mt -138.03 124.59 27.01 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.938 0 N-CA-C 107.878 -1.156 . . . . 31.16 107.878 177.894 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' SER . . . . . 0.518 ' HA ' ' O ' ' A' ' 88' ' ' VAL . 34.5 p -126.27 136.14 52.41 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.418 -0.956 . . . . 38.780000000000001 108.418 177.985 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ILE . . . . . 0.413 HD12 HD11 ' A' ' 67' ' ' LEU . 76.7 mt -125.6 121.43 60.07 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.602 0 CA-C-N 114.898 -1.046 . . . . 47.520000000000003 109.658 -178.608 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 48.7 m -90.11 109.8 20.84 Favored 'General case' 0 N--CA 1.443 -0.822 0 N-CA-C 105.955 -1.869 . . . . 55.530000000000001 105.955 179.255 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' ALA . . . . . 0.409 ' HB1' ' OE1' ' A' ' 59' ' ' GLU . . . -95.2 176.01 6.39 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.149 -0.932 . . . . 54.299999999999997 110.284 -179.63 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . . . -82.04 -35.34 28.89 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.346 -0.388 . . . . 74.079999999999998 110.813 179.748 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' THR . . . . . 0.421 ' O ' ' HB3' ' A' ' 59' ' ' GLU . 68.6 p -137.38 150.27 47.57 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 120.678 0.275 . . . . 61.950000000000003 110.478 179.401 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 38.6 tttt -55.95 -35.13 66.33 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.758 0.651 . . . . 79.799999999999997 112.758 179.895 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 20.7 mtpp -66.63 -23.19 66.13 Favored 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 109.513 -0.551 . . . . 120.41 109.513 179.568 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' GLU . . . . . 0.421 ' HB3' ' O ' ' A' ' 56' ' ' THR . 38.0 tt0 -78.17 -46.85 19.45 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 107.397 -1.334 . . . . 68.189999999999998 107.397 178.489 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -51.87 -31.47 28.12 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.446 -0.797 . . . . 49.390000000000001 110.41 179.118 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -70.98 -47.52 58.43 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 115.501 -0.772 . . . . 78.010000000000005 109.648 -179.83 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . . . -57.9 -36.26 72.19 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 108.536 -0.913 . . . . 51.310000000000002 108.536 179.553 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 10.3 m-30 -72.14 -37.62 69.4 Favored 'General case' 0 CA--C 1.51 -0.56 0 CA-C-N 116.327 -0.397 . . . . 47.899999999999999 111.599 -179.571 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ALA . . . . . 0.506 ' HB2' HG21 ' A' ' 88' ' ' VAL . . . -64.06 -37.24 86.72 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 107.831 -1.174 . . . . 43.039999999999999 107.831 179.247 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -64.07 -39.41 94.0 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 108.701 -0.852 . . . . 46.890000000000001 108.701 178.589 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ILE . . . . . 0.433 HG21 HD11 ' A' ' 33' ' ' LEU . 16.8 mt -65.32 -51.4 65.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 121.433 0.635 . . . . 53.420000000000002 111.008 179.108 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 67' ' ' LEU . . . . . 0.413 HD11 HD12 ' A' ' 52' ' ' ILE . 79.1 mt -62.82 -27.84 69.6 Favored 'General case' 0 N--CA 1.443 -0.821 0 CA-C-N 115.697 -0.683 . . . . 37.909999999999997 112.574 -178.646 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 3.8 mt -67.05 -45.69 86.29 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.68 0 C-N-CA 118.904 -1.118 . . . . 44.649999999999999 110.464 -179.686 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 89.3 mttt -64.76 -36.0 82.88 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.568 -0.53 . . . . 60.799999999999997 109.568 179.827 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' VAL . . . . . 0.508 ' O ' ' HG ' ' A' ' 74' ' ' LEU . 25.6 t -60.27 -56.16 19.43 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 C-N-CA 121.002 -0.279 . . . . 46.670000000000002 110.513 178.497 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -60.21 -39.99 88.51 Favored 'General case' 0 C--O 1.234 0.25 0 C-N-CA 123.033 0.533 . . . . 47.43 112.41 179.479 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.8 -55.93 19.35 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.731 -0.47 . . . . 53.649999999999999 109.731 -179.469 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . . . -51.88 -49.23 63.37 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 108.991 -0.744 . . . . 50.890000000000001 108.991 179.602 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' LEU . . . . . 0.748 HD21 ' HE2' ' A' ' 37' ' ' MSE . 23.3 mt -71.59 16.9 0.1 Allowed 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 114.853 1.427 . . . . 51.780000000000001 114.853 -179.966 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 80.04 -2.95 73.17 Favored Glycine 0 N--CA 1.451 -0.337 0 N-CA-C 119.836 2.694 . . . . 38.149999999999999 119.836 177.909 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' TYR . . . . . 0.485 ' CZ ' HD13 ' A' ' 94' ' ' LEU . 78.7 m-85 -78.97 121.57 25.08 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 102.789 -3.041 . . . . 50.240000000000002 102.789 177.234 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -120.1 -3.84 10.07 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 120.276 3.435 . . . . 96.489999999999995 120.276 -176.415 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -117.66 91.68 3.64 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 103.764 -2.68 . . . . 108.13 103.764 176.007 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 30.8 mt -105.0 138.11 31.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 118.338 2.718 . . . . 35.390000000000001 118.338 -175.369 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 74.6 m-20 -108.44 127.63 54.08 Favored 'General case' 0 CA--C 1.514 -0.432 0 N-CA-C 106.553 -1.647 . . . . 68.239999999999995 106.553 177.269 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 75.2 t -116.93 121.82 68.63 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.721 0 N-CA-C 104.032 -2.581 . . . . 31.420000000000002 104.032 178.204 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 65.6 m -128.48 128.84 45.14 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.953 0.406 . . . . 46.659999999999997 110.557 -179.975 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -105.37 136.0 45.72 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 106.57 -1.641 . . . . 57.369999999999997 106.57 177.673 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -133.87 90.05 2.65 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 104.032 -2.581 . . . . 115.56999999999999 104.032 178.507 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 70.78 -113.59 4.86 Favored Glycine 0 N--CA 1.446 -0.668 0 N-CA-C 108.714 -1.754 . . . . 51.119999999999997 108.714 -178.829 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 40.9 m-20 -106.05 6.46 31.17 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-O 121.091 0.472 . . . . 84.409999999999997 111.493 -179.847 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 54.8 m -101.26 123.35 45.24 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 115.131 -0.941 . . . . 59.149999999999999 111.259 179.09 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' VAL . . . . . 0.518 ' O ' ' HA ' ' A' ' 51' ' ' SER . 10.9 p -106.54 134.21 48.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 108.822 -0.807 . . . . 36.770000000000003 108.822 176.659 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 26.6 m -122.96 105.72 10.22 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.828 -0.624 . . . . 51.329999999999998 111.828 179.857 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 43.7 t -100.75 116.03 43.45 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.33 0 N-CA-C 107.557 -1.275 . . . . 33.060000000000002 107.557 178.315 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -117.98 127.64 54.02 Favored 'General case' 0 C--O 1.238 0.486 0 N-CA-C 108.391 -0.966 . . . . 115.48999999999999 108.391 178.527 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -123.38 158.51 18.0 Favored Glycine 0 N--CA 1.444 -0.798 0 C-N-CA 119.514 -1.327 . . . . 57.289999999999999 113.866 179.208 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 37.8 mt-30 -124.1 140.75 52.67 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 107.691 -1.225 . . . . 87.099999999999994 107.691 177.195 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' LEU . . . . . 0.485 HD13 ' CZ ' ' A' ' 76' ' ' TYR . 4.8 tp . . . . . 0 C--O 1.254 1.334 0 N-CA-C 114.313 1.227 . . . . 78.230000000000004 114.313 -178.032 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 . . . . . 0 N--CA 1.491 1.598 0 N-CA-C 113.497 0.925 . . . . 174.50999999999999 113.497 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 49.4 mt -91.39 111.06 23.32 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.312 0 CA-C-O 121.762 0.792 . . . . 57.729999999999997 112.833 -179.785 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.62 ' HA ' HE21 ' A' ' 5' ' ' GLN . 2.2 tp-100 -101.0 116.17 32.22 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 114.578 -1.192 . . . . 87.590000000000003 112.386 -179.492 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 49.0 t -105.91 115.83 48.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-O 121.299 0.571 . . . . 61.009999999999998 112.049 179.517 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -112.13 114.87 27.95 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.056 -0.72 . . . . 83.920000000000002 109.056 179.706 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.567 ' HB ' ' HB2' ' A' ' 19' ' ' TYR . 63.5 t -111.95 117.76 55.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.989 -0.55 . . . . 45.420000000000002 109.566 178.896 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.483 ' OD1' ' OD1' ' A' ' 18' ' ' ASP . 1.6 t30 -122.64 108.89 13.61 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 121.821 0.819 . . . . 105.47 112.277 -179.986 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 57.1 mt -106.83 117.89 53.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.281 -0.872 . . . . 70.730000000000004 111.984 -179.704 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -109.79 143.81 39.1 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 116.272 -0.422 . . . . 114.14 109.862 179.322 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -168.83 80.22 0.14 Allowed 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 120.204 -0.599 . . . . 70.349999999999994 112.443 -177.311 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.4 m120 43.86 102.49 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 115.565 1.691 . . . . 100.93000000000001 115.565 178.537 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 56.52 16.87 17.51 Favored Glycine 0 C--N 1.332 0.345 0 N-CA-C 115.978 1.151 . . . . 130.91999999999999 115.978 178.913 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . . . -146.94 107.24 4.04 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 110.109 -0.33 . . . . 68.269999999999996 110.109 179.701 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 54.4 t30 -115.63 125.65 53.18 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 121.118 0.485 . . . . 102.09 109.813 179.114 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . . . -112.31 132.56 54.9 Favored 'General case' 0 CA--C 1.518 -0.265 0 N-CA-C 107.911 -1.144 . . . . 42.25 107.911 179.531 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.483 ' OD1' ' OD1' ' A' ' 9' ' ' ASN . 35.9 t70 -125.89 103.47 7.79 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 122.852 0.461 . . . . 89.810000000000002 110.821 179.99 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.567 ' HB2' ' HB ' ' A' ' 8' ' ' VAL . 94.2 m-85 -100.82 126.41 47.39 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 122.85 0.46 . . . . 87.939999999999998 110.334 -179.0 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 4.6 m -124.47 123.97 41.29 Favored 'General case' 0 CA--C 1.515 -0.372 0 N-CA-C 108.209 -1.034 . . . . 57.600000000000001 108.209 179.545 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -128.2 162.32 27.25 Favored 'General case' 0 N--CA 1.464 0.269 0 N-CA-C 108.027 -1.101 . . . . 63.740000000000002 108.027 179.668 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.2 m -139.81 113.06 8.3 Favored 'General case' 0 CA--C 1.506 -0.742 0 N-CA-C 103.669 -2.715 . . . . 67.329999999999998 103.669 178.563 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 29.8 m -118.53 169.59 9.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 C-N-CA 120.103 -0.639 . . . . 71.700000000000003 111.949 -179.776 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' THR . . . . . 0.482 ' O ' ' OG1' ' A' ' 25' ' ' THR . 39.0 m -158.71 81.0 0.8 Allowed 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 105.956 -1.868 . . . . 95.260000000000005 105.956 178.835 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' THR . . . . . 0.743 ' HB ' ' H ' ' A' ' 28' ' ' GLU . 0.2 OUTLIER -176.78 -36.94 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.767 0.654 . . . . 146.88 112.767 -179.836 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.438 ' HB3' ' O ' ' A' ' 25' ' ' THR . 30.9 tt0 68.87 -7.45 0.75 Allowed 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 103.665 -2.717 . . . . 187.15000000000001 103.665 -176.319 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' SER . . . . . 0.73 ' H ' ' C ' ' A' ' 25' ' ' THR . . . -100.1 -50.62 3.92 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 104.534 -2.395 . . . . 116.53 104.534 177.899 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.743 ' H ' ' HB ' ' A' ' 25' ' ' THR . 16.5 pt-20 -76.82 1.46 17.3 Favored 'General case' 0 CA--C 1.522 -0.134 0 N-CA-C 106.529 -1.656 . . . . 200.03 106.529 178.295 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.598 HD22 ' HG ' ' A' ' 33' ' ' LEU . 0.4 OUTLIER -83.94 -40.25 18.77 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 104.381 -2.451 . . . . 97.200000000000003 104.381 178.208 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . . . -62.67 -25.19 68.02 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 107.21 -1.404 . . . . 113.13 107.21 178.792 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . . . -73.61 -44.51 56.92 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.66 -0.7 . . . . 80.640000000000001 109.686 179.989 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 72.1 t -68.42 -45.4 82.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 N-CA-C 107.653 -1.24 . . . . 56.380000000000003 107.653 179.204 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.598 ' HG ' HD22 ' A' ' 29' ' ' LEU . 13.1 mt -54.49 -65.42 0.58 Allowed 'General case' 0 CA--C 1.511 -0.539 0 CA-C-N 115.41 -0.814 . . . . 55.920000000000002 109.976 179.708 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . . . -47.25 -45.86 24.08 Favored 'General case' 0 N--CA 1.455 -0.175 0 O-C-N 123.635 0.584 . . . . 69.480000000000004 109.495 179.921 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 68.3 tt0 -59.91 -41.32 91.42 Favored 'General case' 0 C--O 1.239 0.529 0 N-CA-C 113.245 0.832 . . . . 129.81 113.245 -179.042 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.741 ' O ' HG23 ' A' ' 40' ' ' ILE . . . -69.3 -36.35 76.91 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 119.789 -0.764 . . . . 61.280000000000001 110.747 179.947 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' MSE . . . . . 0.748 ' HE2' HD21 ' A' ' 74' ' ' LEU . 46.1 mtp -53.26 -40.58 64.75 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 115.599 -0.728 . . . . 57.270000000000003 110.094 179.513 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -72.2 -51.47 21.01 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 120.093 -0.643 . . . . 94.790000000000006 112.445 179.877 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 40.4 m-85 -48.67 -43.07 36.48 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 119.631 -0.828 . . . . 104.8 110.664 179.184 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.741 HG23 ' O ' ' A' ' 36' ' ' LEU . 0.7 OUTLIER -76.3 -35.24 27.1 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 N-CA-C 114.06 1.133 . . . . 76.700000000000003 114.06 -178.036 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 79.9 mttt -56.58 -53.19 60.52 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 104.969 -2.234 . . . . 66.420000000000002 104.969 177.63 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 63.5 tttp -54.4 -57.24 12.05 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 114.632 -1.167 . . . . 200.03 113.573 -179.73 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -65.59 -31.3 72.27 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 113.716 1.006 . . . . 126.98 113.716 -178.441 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 45.66 59.79 4.65 Favored Glycine 0 C--N 1.334 0.439 0 C-N-CA 121.088 -0.577 . . . . 55.219999999999999 111.966 -179.385 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -86.41 152.4 22.73 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 112.444 0.535 . . . . 48.700000000000003 112.444 -179.204 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . . . -65.22 -49.76 68.44 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.78 -0.645 . . . . 100.70999999999999 109.777 -179.692 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . . . -115.58 132.82 56.51 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 113.725 1.009 . . . . 55.299999999999997 113.725 -178.897 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 23.5 t -135.86 129.64 48.23 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 C-N-CA 123.471 0.708 . . . . 43.030000000000001 110.857 179.368 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 11.0 ttm180 -121.61 135.82 54.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.525 0.679 . . . . 83.409999999999997 111.043 -179.072 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 16.9 mt -138.03 124.59 27.01 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.938 0 N-CA-C 107.878 -1.156 . . . . 31.16 107.878 177.894 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' SER . . . . . 0.518 ' HA ' ' O ' ' A' ' 88' ' ' VAL . 34.5 p -126.27 136.14 52.41 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.418 -0.956 . . . . 38.780000000000001 108.418 177.985 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.413 HD12 HD11 ' A' ' 67' ' ' LEU . 76.7 mt -125.6 121.43 60.07 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.602 0 CA-C-N 114.898 -1.046 . . . . 47.520000000000003 109.658 -178.608 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 48.7 m -90.11 109.8 20.84 Favored 'General case' 0 N--CA 1.443 -0.822 0 N-CA-C 105.955 -1.869 . . . . 55.530000000000001 105.955 179.255 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.409 ' HB1' ' OE1' ' A' ' 59' ' ' GLU . . . -95.2 176.01 6.39 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.149 -0.932 . . . . 54.299999999999997 110.284 -179.63 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . . . -82.04 -35.34 28.89 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.346 -0.388 . . . . 74.079999999999998 110.813 179.748 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' THR . . . . . 0.421 ' O ' ' HB3' ' A' ' 59' ' ' GLU . 68.6 p -137.38 150.27 47.57 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 120.678 0.275 . . . . 61.950000000000003 110.478 179.401 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 38.6 tttt -55.95 -35.13 66.33 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.758 0.651 . . . . 79.799999999999997 112.758 179.895 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 20.7 mtpp -66.63 -23.19 66.13 Favored 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 109.513 -0.551 . . . . 120.41 109.513 179.568 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.421 ' HB3' ' O ' ' A' ' 56' ' ' THR . 38.0 tt0 -78.17 -46.85 19.45 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 107.397 -1.334 . . . . 68.189999999999998 107.397 178.489 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -51.87 -31.47 28.12 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.446 -0.797 . . . . 49.390000000000001 110.41 179.118 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -70.98 -47.52 58.43 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 115.501 -0.772 . . . . 78.010000000000005 109.648 -179.83 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . . . -57.9 -36.26 72.19 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 108.536 -0.913 . . . . 51.310000000000002 108.536 179.553 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 10.3 m-30 -72.14 -37.62 69.4 Favored 'General case' 0 CA--C 1.51 -0.56 0 CA-C-N 116.327 -0.397 . . . . 47.899999999999999 111.599 -179.571 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.506 ' HB2' HG21 ' A' ' 88' ' ' VAL . . . -64.06 -37.24 86.72 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 107.831 -1.174 . . . . 43.039999999999999 107.831 179.247 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -64.07 -39.41 94.0 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 108.701 -0.852 . . . . 46.890000000000001 108.701 178.589 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.433 HG21 HD11 ' A' ' 33' ' ' LEU . 16.8 mt -65.32 -51.4 65.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 121.433 0.635 . . . . 53.420000000000002 111.008 179.108 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.413 HD11 HD12 ' A' ' 52' ' ' ILE . 79.1 mt -62.82 -27.84 69.6 Favored 'General case' 0 N--CA 1.443 -0.821 0 CA-C-N 115.697 -0.683 . . . . 37.909999999999997 112.574 -178.646 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 3.8 mt -67.05 -45.69 86.29 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.68 0 C-N-CA 118.904 -1.118 . . . . 44.649999999999999 110.464 -179.686 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 89.3 mttt -64.76 -36.0 82.88 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.568 -0.53 . . . . 60.799999999999997 109.568 179.827 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.508 ' O ' ' HG ' ' A' ' 74' ' ' LEU . 25.6 t -60.27 -56.16 19.43 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 C-N-CA 121.002 -0.279 . . . . 46.670000000000002 110.513 178.497 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -60.21 -39.99 88.51 Favored 'General case' 0 C--O 1.234 0.25 0 C-N-CA 123.033 0.533 . . . . 47.43 112.41 179.479 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.8 -55.93 19.35 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.731 -0.47 . . . . 53.649999999999999 109.731 -179.469 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . . . -51.88 -49.23 63.37 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 108.991 -0.744 . . . . 50.890000000000001 108.991 179.602 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.748 HD21 ' HE2' ' A' ' 37' ' ' MSE . 23.3 mt -71.59 16.9 0.1 Allowed 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 114.853 1.427 . . . . 51.780000000000001 114.853 -179.966 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 80.04 -2.95 73.17 Favored Glycine 0 N--CA 1.451 -0.337 0 N-CA-C 119.836 2.694 . . . . 38.149999999999999 119.836 177.909 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.485 ' CZ ' HD13 ' A' ' 94' ' ' LEU . 78.7 m-85 -78.97 121.57 25.08 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 102.789 -3.041 . . . . 50.240000000000002 102.789 177.234 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -120.1 -3.84 10.07 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 120.276 3.435 . . . . 96.489999999999995 120.276 -176.415 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -117.66 91.68 3.64 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 103.764 -2.68 . . . . 108.13 103.764 176.007 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 30.8 mt -105.0 138.11 31.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 118.338 2.718 . . . . 35.390000000000001 118.338 -175.369 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 15.1 m120 -108.44 127.63 54.08 Favored 'General case' 0 CA--C 1.514 -0.432 0 N-CA-C 106.553 -1.647 . . . . 68.239999999999995 106.553 177.269 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 75.2 t -116.93 121.82 68.63 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.721 0 N-CA-C 104.032 -2.581 . . . . 31.420000000000002 104.032 178.204 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 65.6 m -128.48 128.84 45.14 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.953 0.406 . . . . 46.659999999999997 110.557 -179.975 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -105.37 136.0 45.72 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 106.57 -1.641 . . . . 57.369999999999997 106.57 177.673 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -133.87 90.05 2.65 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 104.032 -2.581 . . . . 115.56999999999999 104.032 178.507 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 70.78 -113.59 4.86 Favored Glycine 0 N--CA 1.446 -0.668 0 N-CA-C 108.714 -1.754 . . . . 51.119999999999997 108.714 -178.829 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 40.9 m-20 -106.05 6.46 31.17 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-O 121.091 0.472 . . . . 84.409999999999997 111.493 -179.847 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 54.8 m -101.26 123.35 45.24 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 115.131 -0.941 . . . . 59.149999999999999 111.259 179.09 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.518 ' O ' ' HA ' ' A' ' 51' ' ' SER . 10.9 p -106.54 134.21 48.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 108.822 -0.807 . . . . 36.770000000000003 108.822 176.659 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 26.6 m -122.96 105.72 10.22 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.828 -0.624 . . . . 51.329999999999998 111.828 179.857 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 43.7 t -100.75 116.03 43.45 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.33 0 N-CA-C 107.557 -1.275 . . . . 33.060000000000002 107.557 178.315 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -117.98 127.64 54.02 Favored 'General case' 0 C--O 1.238 0.486 0 N-CA-C 108.391 -0.966 . . . . 115.48999999999999 108.391 178.527 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -123.38 158.51 18.0 Favored Glycine 0 N--CA 1.444 -0.798 0 C-N-CA 119.514 -1.327 . . . . 57.289999999999999 113.866 179.208 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 37.8 mt-30 -124.1 140.75 52.67 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 107.691 -1.225 . . . . 87.099999999999994 107.691 177.195 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.485 HD13 ' CZ ' ' A' ' 76' ' ' TYR . 4.8 tp . . . . . 0 C--O 1.254 1.334 0 N-CA-C 114.313 1.227 . . . . 78.230000000000004 114.313 -178.032 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_