data_3g1c_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 3g1c _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 56.4 t30 . . . . . 0 N--CA 1.506 2.364 0 N-CA-C 112.707 0.632 . . . . 90.12 112.707 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 51.5 t30 -53.47 -39.28 64.37 Favored 'General case' 0 CA--C 1.551 1.004 0 N-CA-C 113.155 0.798 . . . . 87.07 113.155 178.983 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 39.9 tttt -68.36 -18.27 64.44 Favored 'General case' 0 C--O 1.248 1.004 0 N-CA-C 113.512 0.931 . . . . 79.86 113.512 178.728 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 62.0 mt -93.03 -2.26 55.83 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 114.485 1.291 . . . . 58.66 114.485 179.918 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -88.82 77.68 7.75 Favored 'General case' 0 C--O 1.212 -0.901 0 CA-C-O 122.342 1.068 . . . . 67.29 109.994 177.689 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' THR . . . . . 0.786 ' CG2' ' O ' ' A' ' 133' ' ' HOH . 0.8 OUTLIER -137.89 152.9 49.48 Favored 'General case' 0 N--CA 1.425 -1.691 0 C-N-CA 125.455 1.502 . . . . 55.04 107.073 -167.926 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 16.8 tp60 -74.72 -31.71 61.93 Favored 'General case' 0 N--CA 1.431 -1.387 0 CA-C-O 122.36 1.076 . . . . 64.85 108.84 -178.017 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -56.0 -48.48 75.82 Favored 'General case' 0 N--CA 1.441 -0.88 0 CA-C-N 114.787 -1.097 . . . . 46.31 110.97 172.415 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 44.4 t -64.96 -43.82 96.15 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.553 0 N-CA-C 109.799 -0.445 . . . . 42.11 109.799 178.341 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -61.23 -39.21 89.45 Favored 'General case' 0 C--O 1.259 1.555 0 N-CA-C 112.596 0.591 . . . . 61.11 112.596 179.027 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' GLN . . . . . 0.523 ' NE2' ' O ' ' A' ' 112' ' ' HOH . 18.1 mt-30 -70.82 -38.51 73.28 Favored 'General case' 0 C--O 1.162 -3.504 0 C-N-CA 118.162 -1.415 . . . . 55.75 112.88 176.778 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 54.6 tp -50.93 -51.24 54.19 Favored 'General case' 0 C--O 1.209 -1.05 0 N-CA-C 108.449 -0.945 . . . . 40.21 108.449 170.212 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 20.6 m-30 -64.53 -35.68 81.75 Favored 'General case' 0 CA--C 1.495 -1.139 0 N-CA-C 113.215 0.82 . . . . 41.14 113.215 -178.281 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 44.6 mm-40 -68.75 -39.92 80.06 Favored 'General case' 0 CA--C 1.489 -1.392 0 C-N-CA 117.55 -1.66 . . . . 41.29 109.853 177.954 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -55.48 -46.61 76.85 Favored 'General case' 0 C--O 1.201 -1.484 0 O-C-N 123.994 0.809 . . . . 40.87 108.999 174.838 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 77.7 mt -68.78 -46.82 78.88 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 N-CA-C 107.793 -1.188 . . . . 40.37 107.793 -174.913 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -68.51 -9.01 46.32 Favored 'General case' 0 CA--C 1.506 -0.733 0 N-CA-C 115.371 1.619 . . . . 45.94 115.371 178.155 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 88.6 p -87.0 -10.61 52.72 Favored 'General case' 0 N--CA 1.487 1.379 0 CA-C-N 119.98 1.263 . . . . 44.02 111.73 177.629 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 74.7 mt -64.79 131.52 47.03 Favored 'General case' 0 C--O 1.215 -0.723 0 N-CA-C 109.229 -0.656 . . . . 43.95 109.229 -177.874 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 15.9 mtpt -99.92 -21.17 15.79 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 114.857 1.429 . . . . 68.79 114.857 -170.103 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -160.37 173.85 15.02 Favored 'General case' 0 CA--C 1.489 -1.397 0 C-N-CA 120.229 -0.588 . . . . 55.42 111.111 -179.198 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.2 mp -65.24 -29.39 70.18 Favored 'General case' 0 C--O 1.198 -1.634 0 N-CA-C 114.759 1.392 . . . . 46.93 114.759 -174.238 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 68.1 m-20 -66.66 -36.68 83.11 Favored 'General case' 0 C--O 1.208 -1.11 0 CA-C-N 119.625 1.102 . . . . 55.71 110.857 176.845 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 79.6 mt-10 -67.38 -43.14 82.12 Favored 'General case' 0 C--O 1.248 1.015 0 N-CA-C 109.293 -0.632 . . . . 50.5 109.293 176.38 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -56.05 -49.21 74.39 Favored 'General case' 0 C--O 1.21 -0.995 0 O-C-N 124.434 1.084 . . . . 41.61 110.255 175.233 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 10.0 m-85 -57.36 -48.44 79.03 Favored 'General case' 0 CA--C 1.554 1.126 0 CA-C-O 122.647 1.213 . . . . 48.27 112.783 178.601 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -57.92 -52.46 65.4 Favored 'General case' 0 C--N 1.311 -1.068 0 O-C-N 121.464 -0.773 . . . . 51.05 111.704 -179.697 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 78.4 t80 -61.67 -57.31 12.48 Favored 'General case' 0 C--N 1.313 -1.014 0 N-CA-C 113.682 0.993 . . . . 47.48 113.682 178.989 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 65.1 m-85 -64.88 -30.36 71.36 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 119.157 -1.017 . . . . 41.22 112.442 -174.137 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -70.77 -28.96 65.07 Favored 'General case' 0 C--N 1.31 -1.137 0 C-N-CA 120.32 -0.552 . . . . 64.95 110.362 175.845 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 91.4 m-20 -72.57 -41.18 65.99 Favored 'General case' 0 CA--C 1.506 -0.728 0 C-N-CA 119.032 -1.067 . . . . 50.87 111.257 174.681 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 38.8 t -84.83 -27.22 6.72 Favored 'Isoleucine or valine' 0 C--O 1.24 0.573 0 N-CA-C 114.219 1.192 . . . . 47.7 114.219 -174.031 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 69.3 m -122.12 161.64 22.72 Favored 'General case' 0 CA--C 1.49 -1.348 0 CA-C-N 118.213 0.461 . . . . 46.36 110.492 -172.078 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 31.0 p -79.44 163.1 25.04 Favored 'General case' 0 C--O 1.26 1.653 0 CA-C-O 122.03 0.919 . . . . 46.24 110.443 165.86 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.8 mp -60.65 -44.15 96.37 Favored 'Isoleucine or valine' 0 C--O 1.246 0.87 0 N-CA-C 107.452 -1.314 . . . . 53.78 107.452 -178.424 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 6.8 m120 -66.3 -34.31 77.71 Favored 'General case' 0 N--CA 1.421 -1.904 0 CA-C-N 115.279 -0.873 . . . . 55.38 113.293 -175.767 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -64.34 -46.9 81.45 Favored 'General case' 0 C--O 1.192 -1.933 0 C-N-CA 118.781 -1.168 . . . . 49.15 110.594 175.434 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 92.2 mt -61.66 -45.23 99.11 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.486 0 N-CA-C 108.601 -0.888 . . . . 42.03 108.601 179.358 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 63.6 mt -59.31 -33.25 70.87 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 122.395 1.093 . . . . 43.79 112.032 178.293 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 30.1 t -72.76 -35.9 67.57 Favored 'General case' 0 C--N 1.311 -1.086 0 CA-C-N 115.317 -0.856 . . . . 48.07 113.189 -179.595 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 56.0 mt -73.99 -39.09 63.89 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 120.544 -0.462 . . . . 45.22 111.198 177.108 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 54.3 p -65.79 -35.98 82.22 Favored 'General case' 0 C--O 1.203 -1.344 0 O-C-N 121.991 -0.443 . . . . 46.43 111.728 177.583 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 41.8 tt0 -61.81 -46.63 88.68 Favored 'General case' 0 N--CA 1.442 -0.847 0 N-CA-C 112.459 0.54 . . . . 46.67 112.459 171.547 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -62.06 -41.13 97.84 Favored 'General case' 0 C--O 1.2 -1.511 0 C-N-CA 117.885 -1.526 . . . . 56.3 110.669 178.037 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -63.43 -42.71 98.71 Favored 'General case' 0 CA--C 1.57 1.725 0 C-N-CA 118.869 -1.132 . . . . 41.65 109.715 -178.588 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 60.6 tt0 -67.25 -42.97 83.02 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.322 -0.861 . . . . 55.85 110.436 -178.232 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 24.9 t -52.08 -44.14 39.15 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.742 0 N-CA-C 108.826 -0.805 . . . . 42.98 108.826 172.864 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -69.52 -42.29 74.87 Favored 'General case' 0 N--CA 1.435 -1.186 0 C-N-CA 119.501 -0.88 . . . . 41.68 110.812 -172.584 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.5 ttpt -60.37 -47.84 84.31 Favored 'General case' 0 CA--C 1.574 1.866 0 CA-C-O 121.772 0.796 . . . . 47.61 110.921 176.584 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 88.0 mtp -66.08 -32.84 74.53 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 105.955 -1.869 . . . . 46.84 105.955 -175.944 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 32.5 mt -65.17 -38.14 89.58 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 120.248 -1.532 . . . . 41.71 109.653 -179.32 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 22.0 mmt180 -80.36 -21.55 42.29 Favored 'General case' 0 C--O 1.196 -1.714 0 C-N-CA 120.306 -0.558 . . . . 56.3 110.454 179.96 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -75.59 4.46 7.58 Favored 'General case' 0 N--CA 1.432 -1.349 0 O-C-N 121.597 -0.689 . . . . 50.83 112.168 169.111 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 16.0 m-70 70.86 25.06 3.97 Favored 'General case' 0 C--N 1.313 -1.006 0 N-CA-C 116.901 2.186 . . . . 61.75 116.901 175.381 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ARG . . . . . 0.429 ' NH2' ' OD2' ' A' ' 60' ' ' ASP . 36.9 mmm-85 -81.24 158.2 24.92 Favored 'General case' 0 CA--C 1.484 -1.563 0 CA-C-O 118.685 -0.674 . . . . 66.32 109.908 178.004 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 72.4 p -81.09 163.3 23.27 Favored 'General case' 0 CA--C 1.514 -0.426 0 O-C-N 124.549 1.156 . . . . 43.97 110.225 -178.445 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 3.7 m-30 -63.01 -36.26 82.96 Favored 'General case' 0 CA--C 1.508 -0.66 0 C-N-CA 119.278 -0.969 . . . . 56.56 111.834 -179.757 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 22.6 tp -58.45 -49.45 77.26 Favored 'General case' 0 CA--C 1.49 -1.345 0 N-CA-C 113.02 0.748 . . . . 50.38 113.02 176.069 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ASP . . . . . 0.429 ' OD2' ' NH2' ' A' ' 56' ' ' ARG . 88.2 m-20 -65.25 -32.42 74.08 Favored 'General case' 0 N--CA 1.424 -1.748 0 N-CA-C 114.21 1.189 . . . . 54.26 114.21 177.527 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 74.8 mt -71.69 -46.77 60.54 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.087 0 N-CA-C 107.524 -1.287 . . . . 47.83 107.524 178.348 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.53 -34.69 74.49 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-N 118.673 0.67 . . . . 54.34 112.272 179.557 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 89.9 mt-10 -68.29 -52.71 30.6 Favored 'General case' 0 C--O 1.2 -1.521 0 N-CA-C 113.373 0.879 . . . . 76.56 113.373 176.567 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.8 tptp -70.92 -30.76 67.17 Favored 'General case' 0 N--CA 1.412 -2.339 0 C-N-CA 120.955 -0.298 . . . . 61.09 111.76 -172.433 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 34.4 p -107.9 -23.08 12.19 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 121.3 -0.875 . . . . 55.06 110.699 -168.504 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 89.14 -12.07 67.47 Favored Glycine 0 CA--C 1.497 -1.05 0 O-C-N 121.784 -0.572 . . . . 52.65 112.953 -174.947 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -60.98 143.45 55.22 Favored 'General case' 0 C--O 1.24 0.59 0 CA-C-N 118.082 0.941 . . . . 50.35 110.5 -176.824 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 88.0 p -74.13 163.51 27.76 Favored 'General case' 0 N--CA 1.433 -1.309 0 N-CA-C 107.463 -1.31 . . . . 52.16 107.463 168.463 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 82.4 p -72.79 -22.7 60.79 Favored 'General case' 0 C--O 1.244 0.809 0 CA-C-O 122.002 0.905 . . . . 53.42 111.242 -176.388 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -65.34 -46.86 78.54 Favored 'General case' 0 N--CA 1.437 -1.107 0 CA-C-N 115.235 -0.893 . . . . 52.31 110.493 171.136 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 86.2 m -57.4 -42.84 83.03 Favored 'General case' 0 CA--C 1.497 -1.066 0 CA-C-N 118.902 0.774 . . . . 50.73 110.353 171.877 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 89.0 mt -61.42 -43.73 97.26 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.814 0 C-N-CA 118.935 -1.106 . . . . 47.2 109.313 -176.521 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 56.7 m -64.04 -43.12 96.49 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 115.824 -0.625 . . . . 48.68 112.476 -178.922 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 54.8 mtm-85 -57.29 -49.6 75.57 Favored 'General case' 0 C--O 1.195 -1.816 0 N-CA-C 112.764 0.653 . . . . 65.13 112.764 172.869 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 40.0 t -57.34 -41.66 78.83 Favored 'Isoleucine or valine' 0 C--O 1.247 0.93 0 CA-C-O 122.727 1.251 . . . . 44.75 109.341 178.394 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 13.4 t-20 -61.63 -33.53 74.09 Favored 'General case' 0 C--O 1.211 -0.934 0 C-N-CA 118.56 -1.256 . . . . 47.93 112.362 -177.405 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 46.3 mtt85 -62.9 -45.41 92.64 Favored 'General case' 0 C--N 1.313 -0.981 0 C-N-CA 119.643 -0.823 . . . . 76.3 112.559 172.625 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 68.2 m -67.48 -30.21 69.85 Favored 'General case' 0 CA--C 1.489 -1.378 0 C-N-CA 119.994 -0.682 . . . . 45.98 112.606 179.991 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 22.3 tp -69.44 -41.11 76.73 Favored 'General case' 0 CA--C 1.489 -1.391 0 N-CA-C 108.557 -0.905 . . . . 45.73 108.557 -177.728 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 27.8 m120 -96.41 -27.41 14.93 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 113.709 1.003 . . . . 52.82 113.709 -168.424 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 76.4 m-85 -126.9 39.49 3.91 Favored 'General case' 0 C--O 1.198 -1.638 0 CA-C-N 115.941 -0.572 . . . . 66.45 110.337 -173.419 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -123.94 -147.29 7.2 Favored Glycine 0 N--CA 1.436 -1.362 0 N-CA-C 107.645 -2.182 . . . . 51.14 107.645 -172.202 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -92.49 4.58 53.25 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 114.259 1.207 . . . . 57.33 114.259 -177.987 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 30.1 m-20 63.9 27.51 14.45 Favored 'General case' 0 CA--C 1.485 -1.541 0 N-CA-C 113.008 0.744 . . . . 62.11 113.008 -175.606 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -70.5 -39.23 68.94 Favored Glycine 0 CA--C 1.53 0.992 0 N-CA-C 115.978 1.151 . . . . 46.96 115.978 174.134 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -60.01 -49.82 76.17 Favored 'General case' 0 C--O 1.249 1.032 0 O-C-N 121.119 -1.224 . . . . 43.13 107.775 179.93 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 58.5 m-20 -63.23 -36.16 82.74 Favored 'General case' 0 CA--C 1.491 -1.304 0 CA-C-N 114.061 -1.427 . . . . 50.98 112.152 -173.32 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 2.7 ttm-85 -70.59 -39.72 73.68 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 118.135 -1.426 . . . . 78.58 109.351 -179.073 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 70.2 t -60.17 -46.84 94.03 Favored 'Isoleucine or valine' 0 CA--C 1.58 2.097 0 O-C-N 121.198 -0.939 . . . . 46.21 109.609 173.528 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 22.6 m-85 -60.32 -44.43 95.47 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.098 -1.002 . . . . 46.21 109.799 -175.427 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 49.6 tp10 -61.51 -47.98 83.12 Favored 'General case' 0 CA--C 1.486 -1.513 0 O-C-N 123.948 0.78 . . . . 75.02 110.794 174.648 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 41.9 ttm180 -65.16 -42.33 93.85 Favored 'General case' 0 C--O 1.214 -0.804 0 C-N-CA 119.126 -1.029 . . . . 57.35 113.082 -174.919 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 16.1 mt -91.28 3.74 54.09 Favored 'General case' 0 CA--C 1.588 2.441 0 N-CA-C 113.363 0.875 . . . . 50.54 113.363 -175.087 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 56.2 44.7 88.94 Favored Glycine 0 C--O 1.22 -0.776 0 N-CA-C 110.866 -0.894 . . . . 52.19 110.866 177.724 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 25.9 mtt -89.14 -22.28 22.93 Favored 'General case' 0 CA--C 1.506 -0.739 0 N-CA-C 114.187 1.18 . . . . 54.16 114.187 -164.081 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 39.0 mt -78.04 120.92 23.56 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 118.926 -1.109 . . . . 61.57 109.352 -169.055 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -51.51 110.97 0.51 Allowed 'General case' 0 C--O 1.257 1.483 0 O-C-N 124.194 0.934 . . . . 85.85 110.571 170.231 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 7.1 mmtp . . . . . 0 CA--C 1.552 1.026 0 O-C-N 124.857 1.348 . . . . 84.73 111.464 172.016 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 . . . . . 0.523 ' O ' ' NE2' ' A' ' 12' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' HOH . . . . . 0.786 ' O ' ' CG2' ' A' ' 7' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 158' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 159' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 160' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 161' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 162' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 163' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 164' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 165' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 166' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' ASN . . . . . 0.437 ' OD1' ' HE2' ' A' ' 6' ' ' LYS . 56.4 t30 . . . . . 0 N--CA 1.506 2.364 0 N-CA-C 112.707 0.632 . . . . 90.12 112.707 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 51.5 t30 -53.47 -39.28 64.37 Favored 'General case' 0 CA--C 1.551 1.004 0 N-CA-C 113.155 0.798 . . . . 87.07 113.155 178.983 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 39.9 tttt -68.36 -18.27 64.44 Favored 'General case' 0 C--O 1.248 1.004 0 N-CA-C 113.512 0.931 . . . . 79.86 113.512 178.728 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 62.0 mt -93.03 -2.26 55.83 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 114.485 1.291 . . . . 58.66 114.485 179.918 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' LYS . . . . . 0.437 ' HE2' ' OD1' ' A' ' 2' ' ' ASN . 75.2 mmtt -88.82 77.68 7.75 Favored 'General case' 0 C--O 1.212 -0.901 0 CA-C-O 122.342 1.068 . . . . 67.29 109.994 177.689 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 7' ' ' THR . . . . . 1.164 HG21 ' O ' ' A' ' 133' ' ' HOH . 0.8 OUTLIER -137.89 152.9 49.48 Favored 'General case' 0 N--CA 1.425 -1.691 0 C-N-CA 125.455 1.502 . . . . 55.04 107.073 -167.926 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 8' ' ' GLN . . . . . 0.488 ' HG3' ' O ' ' A' ' 125' ' ' HOH . 16.8 tp60 -74.72 -31.71 61.93 Favored 'General case' 0 N--CA 1.431 -1.387 0 CA-C-O 122.36 1.076 . . . . 64.85 108.84 -178.017 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 9' ' ' ALA . . . . . 0.586 ' HB3' ' CG2' ' A' ' 7' ' ' THR . . . -56.0 -48.48 75.82 Favored 'General case' 0 N--CA 1.441 -0.88 0 CA-C-N 114.787 -1.097 . . . . 46.31 110.97 172.415 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 10' ' ' VAL . . . . . 0.884 ' H ' HG22 ' A' ' 7' ' ' THR . 44.4 t -64.96 -43.82 96.15 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.553 0 N-CA-C 109.799 -0.445 . . . . 42.11 109.799 178.341 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -61.23 -39.21 89.45 Favored 'General case' 0 C--O 1.259 1.555 0 N-CA-C 112.596 0.591 . . . . 61.11 112.596 179.027 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 18.1 mt-30 -70.82 -38.51 73.28 Favored 'General case' 0 C--O 1.162 -3.504 0 C-N-CA 118.162 -1.415 . . . . 55.75 112.88 176.778 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 54.6 tp -50.93 -51.24 54.19 Favored 'General case' 0 C--O 1.209 -1.05 0 N-CA-C 108.449 -0.945 . . . . 40.21 108.449 170.212 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 20.6 m-30 -64.53 -35.68 81.75 Favored 'General case' 0 CA--C 1.495 -1.139 0 N-CA-C 113.215 0.82 . . . . 41.14 113.215 -178.281 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 44.6 mm-40 -68.75 -39.92 80.06 Favored 'General case' 0 CA--C 1.489 -1.392 0 C-N-CA 117.55 -1.66 . . . . 41.29 109.853 177.954 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -55.48 -46.61 76.85 Favored 'General case' 0 C--O 1.201 -1.484 0 O-C-N 123.994 0.809 . . . . 40.87 108.999 174.838 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 77.7 mt -68.78 -46.82 78.88 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 N-CA-C 107.793 -1.188 . . . . 40.37 107.793 -174.913 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' LEU . . . . . 0.435 HD23 ' N ' ' A' ' 18' ' ' LEU . 0.7 OUTLIER -68.51 -9.01 46.32 Favored 'General case' 0 CA--C 1.506 -0.733 0 N-CA-C 115.371 1.619 . . . . 45.94 115.371 178.155 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 88.6 p -87.0 -10.61 52.72 Favored 'General case' 0 N--CA 1.487 1.379 0 CA-C-N 119.98 1.263 . . . . 44.02 111.73 177.629 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 74.7 mt -64.79 131.52 47.03 Favored 'General case' 0 C--O 1.215 -0.723 0 N-CA-C 109.229 -0.656 . . . . 43.95 109.229 -177.874 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 15.9 mtpt -99.92 -21.17 15.79 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 114.857 1.429 . . . . 68.79 114.857 -170.103 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -160.37 173.85 15.02 Favored 'General case' 0 CA--C 1.489 -1.397 0 C-N-CA 120.229 -0.588 . . . . 55.42 111.111 -179.198 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.2 mp -65.24 -29.39 70.18 Favored 'General case' 0 C--O 1.198 -1.634 0 N-CA-C 114.759 1.392 . . . . 46.93 114.759 -174.238 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 68.1 m-20 -66.66 -36.68 83.11 Favored 'General case' 0 C--O 1.208 -1.11 0 CA-C-N 119.625 1.102 . . . . 55.71 110.857 176.845 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 79.6 mt-10 -67.38 -43.14 82.12 Favored 'General case' 0 C--O 1.248 1.015 0 N-CA-C 109.293 -0.632 . . . . 50.5 109.293 176.38 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -56.05 -49.21 74.39 Favored 'General case' 0 C--O 1.21 -0.995 0 O-C-N 124.434 1.084 . . . . 41.61 110.255 175.233 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 10.0 m-85 -57.36 -48.44 79.03 Favored 'General case' 0 CA--C 1.554 1.126 0 CA-C-O 122.647 1.213 . . . . 48.27 112.783 178.601 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -57.92 -52.46 65.4 Favored 'General case' 0 C--N 1.311 -1.068 0 O-C-N 121.464 -0.773 . . . . 51.05 111.704 -179.697 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 78.4 t80 -61.67 -57.31 12.48 Favored 'General case' 0 C--N 1.313 -1.014 0 N-CA-C 113.682 0.993 . . . . 47.48 113.682 178.989 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 65.1 m-85 -64.88 -30.36 71.36 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 119.157 -1.017 . . . . 41.22 112.442 -174.137 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -70.77 -28.96 65.07 Favored 'General case' 0 C--N 1.31 -1.137 0 C-N-CA 120.32 -0.552 . . . . 64.95 110.362 175.845 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 91.4 m-20 -72.57 -41.18 65.99 Favored 'General case' 0 CA--C 1.506 -0.728 0 C-N-CA 119.032 -1.067 . . . . 50.87 111.257 174.681 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 38.8 t -84.83 -27.22 6.72 Favored 'Isoleucine or valine' 0 C--O 1.24 0.573 0 N-CA-C 114.219 1.192 . . . . 47.7 114.219 -174.031 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 69.3 m -122.12 161.64 22.72 Favored 'General case' 0 CA--C 1.49 -1.348 0 CA-C-N 118.213 0.461 . . . . 46.36 110.492 -172.078 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' THR . . . . . 0.407 ' OG1' ' HG3' ' A' ' 38' ' ' GLU . 31.0 p -79.44 163.1 25.04 Favored 'General case' 0 C--O 1.26 1.653 0 CA-C-O 122.03 0.919 . . . . 46.24 110.443 165.86 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.8 mp -60.65 -44.15 96.37 Favored 'Isoleucine or valine' 0 C--O 1.246 0.87 0 N-CA-C 107.452 -1.314 . . . . 53.78 107.452 -178.424 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 -66.3 -34.31 77.71 Favored 'General case' 0 N--CA 1.421 -1.904 0 CA-C-N 115.279 -0.873 . . . . 55.38 113.293 -175.767 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' GLU . . . . . 0.407 ' HG3' ' OG1' ' A' ' 35' ' ' THR . 98.1 mt-10 -64.34 -46.9 81.45 Favored 'General case' 0 C--O 1.192 -1.933 0 C-N-CA 118.781 -1.168 . . . . 49.15 110.594 175.434 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 92.2 mt -61.66 -45.23 99.11 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.486 0 N-CA-C 108.601 -0.888 . . . . 42.03 108.601 179.358 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 63.6 mt -59.31 -33.25 70.87 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 122.395 1.093 . . . . 43.79 112.032 178.293 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' SER . . . . . 0.476 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 30.1 t -72.76 -35.9 67.57 Favored 'General case' 0 C--N 1.311 -1.086 0 CA-C-N 115.317 -0.856 . . . . 48.07 113.189 -179.595 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 56.0 mt -73.99 -39.09 63.89 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 120.544 -0.462 . . . . 45.22 111.198 177.108 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 54.3 p -65.79 -35.98 82.22 Favored 'General case' 0 C--O 1.203 -1.344 0 O-C-N 121.991 -0.443 . . . . 46.43 111.728 177.583 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 41.8 tt0 -61.81 -46.63 88.68 Favored 'General case' 0 N--CA 1.442 -0.847 0 N-CA-C 112.459 0.54 . . . . 46.67 112.459 171.547 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ARG . . . . . 0.476 ' HG3' ' O ' ' A' ' 41' ' ' SER . 0.7 OUTLIER -62.06 -41.13 97.84 Favored 'General case' 0 C--O 1.2 -1.511 0 C-N-CA 117.885 -1.526 . . . . 56.3 110.669 178.037 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -63.43 -42.71 98.71 Favored 'General case' 0 CA--C 1.57 1.725 0 C-N-CA 118.869 -1.132 . . . . 41.65 109.715 -178.588 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 60.6 tt0 -67.25 -42.97 83.02 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.322 -0.861 . . . . 55.85 110.436 -178.232 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 24.9 t -52.08 -44.14 39.15 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.742 0 N-CA-C 108.826 -0.805 . . . . 42.98 108.826 172.864 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -69.52 -42.29 74.87 Favored 'General case' 0 N--CA 1.435 -1.186 0 C-N-CA 119.501 -0.88 . . . . 41.68 110.812 -172.584 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.5 ttpt -60.37 -47.84 84.31 Favored 'General case' 0 CA--C 1.574 1.866 0 CA-C-O 121.772 0.796 . . . . 47.61 110.921 176.584 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 88.0 mtp -66.08 -32.84 74.53 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 105.955 -1.869 . . . . 46.84 105.955 -175.944 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 32.5 mt -65.17 -38.14 89.58 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 120.248 -1.532 . . . . 41.71 109.653 -179.32 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ARG . . . . . 0.402 ' HG2' HD21 ' A' ' 79' ' ' LEU . 22.0 mmt180 -80.36 -21.55 42.29 Favored 'General case' 0 C--O 1.196 -1.714 0 C-N-CA 120.306 -0.558 . . . . 56.3 110.454 179.96 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -75.59 4.46 7.58 Favored 'General case' 0 N--CA 1.432 -1.349 0 O-C-N 121.597 -0.689 . . . . 50.83 112.168 169.111 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 16.0 m-70 70.86 25.06 3.97 Favored 'General case' 0 C--N 1.313 -1.006 0 N-CA-C 116.901 2.186 . . . . 61.75 116.901 175.381 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ARG . . . . . 0.414 ' NH2' ' OD2' ' A' ' 60' ' ' ASP . 36.9 mmm-85 -81.24 158.2 24.92 Favored 'General case' 0 CA--C 1.484 -1.563 0 CA-C-O 118.685 -0.674 . . . . 66.32 109.908 178.004 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 72.4 p -81.09 163.3 23.27 Favored 'General case' 0 CA--C 1.514 -0.426 0 O-C-N 124.549 1.156 . . . . 43.97 110.225 -178.445 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 3.7 m-30 -63.01 -36.26 82.96 Favored 'General case' 0 CA--C 1.508 -0.66 0 C-N-CA 119.278 -0.969 . . . . 56.56 111.834 -179.757 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 22.6 tp -58.45 -49.45 77.26 Favored 'General case' 0 CA--C 1.49 -1.345 0 N-CA-C 113.02 0.748 . . . . 50.38 113.02 176.069 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ASP . . . . . 0.414 ' OD2' ' NH2' ' A' ' 56' ' ' ARG . 88.2 m-20 -65.25 -32.42 74.08 Favored 'General case' 0 N--CA 1.424 -1.748 0 N-CA-C 114.21 1.189 . . . . 54.26 114.21 177.527 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 74.8 mt -71.69 -46.77 60.54 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.087 0 N-CA-C 107.524 -1.287 . . . . 47.83 107.524 178.348 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.53 -34.69 74.49 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-N 118.673 0.67 . . . . 54.34 112.272 179.557 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' GLU . . . . . 0.562 ' HG3' ' O ' ' A' ' 161' ' ' HOH . 89.9 mt-10 -68.29 -52.71 30.6 Favored 'General case' 0 C--O 1.2 -1.521 0 N-CA-C 113.373 0.879 . . . . 76.56 113.373 176.567 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.8 tptp -70.92 -30.76 67.17 Favored 'General case' 0 N--CA 1.412 -2.339 0 C-N-CA 120.955 -0.298 . . . . 61.09 111.76 -172.433 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 34.4 p -107.9 -23.08 12.19 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 121.3 -0.875 . . . . 55.06 110.699 -168.504 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 89.14 -12.07 67.47 Favored Glycine 0 CA--C 1.497 -1.05 0 O-C-N 121.784 -0.572 . . . . 52.65 112.953 -174.947 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -60.98 143.45 55.22 Favored 'General case' 0 C--O 1.24 0.59 0 CA-C-N 118.082 0.941 . . . . 50.35 110.5 -176.824 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 88.0 p -74.13 163.51 27.76 Favored 'General case' 0 N--CA 1.433 -1.309 0 N-CA-C 107.463 -1.31 . . . . 52.16 107.463 168.463 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 82.4 p -72.79 -22.7 60.79 Favored 'General case' 0 C--O 1.244 0.809 0 CA-C-O 122.002 0.905 . . . . 53.42 111.242 -176.388 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -65.34 -46.86 78.54 Favored 'General case' 0 N--CA 1.437 -1.107 0 CA-C-N 115.235 -0.893 . . . . 52.31 110.493 171.136 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 86.2 m -57.4 -42.84 83.03 Favored 'General case' 0 CA--C 1.497 -1.066 0 CA-C-N 118.902 0.774 . . . . 50.73 110.353 171.877 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 89.0 mt -61.42 -43.73 97.26 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.814 0 C-N-CA 118.935 -1.106 . . . . 47.2 109.313 -176.521 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 56.7 m -64.04 -43.12 96.49 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 115.824 -0.625 . . . . 48.68 112.476 -178.922 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 54.8 mtm-85 -57.29 -49.6 75.57 Favored 'General case' 0 C--O 1.195 -1.816 0 N-CA-C 112.764 0.653 . . . . 65.13 112.764 172.869 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 40.0 t -57.34 -41.66 78.83 Favored 'Isoleucine or valine' 0 C--O 1.247 0.93 0 CA-C-O 122.727 1.251 . . . . 44.75 109.341 178.394 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 39.4 t30 -61.63 -33.53 74.09 Favored 'General case' 0 C--O 1.211 -0.934 0 C-N-CA 118.56 -1.256 . . . . 47.93 112.362 -177.405 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 46.3 mtt85 -62.9 -45.41 92.64 Favored 'General case' 0 C--N 1.313 -0.981 0 C-N-CA 119.643 -0.823 . . . . 76.3 112.559 172.625 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 68.2 m -67.48 -30.21 69.85 Favored 'General case' 0 CA--C 1.489 -1.378 0 C-N-CA 119.994 -0.682 . . . . 45.98 112.606 179.991 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' LEU . . . . . 0.402 HD21 ' HG2' ' A' ' 53' ' ' ARG . 22.3 tp -69.44 -41.11 76.73 Favored 'General case' 0 CA--C 1.489 -1.391 0 N-CA-C 108.557 -0.905 . . . . 45.73 108.557 -177.728 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 -96.41 -27.41 14.93 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 113.709 1.003 . . . . 52.82 113.709 -168.424 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 76.4 m-85 -126.9 39.49 3.91 Favored 'General case' 0 C--O 1.198 -1.638 0 CA-C-N 115.941 -0.572 . . . . 66.45 110.337 -173.419 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -123.94 -147.29 7.2 Favored Glycine 0 N--CA 1.436 -1.362 0 N-CA-C 107.645 -2.182 . . . . 51.14 107.645 -172.202 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -92.49 4.58 53.25 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 114.259 1.207 . . . . 57.33 114.259 -177.987 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 30.1 m-20 63.9 27.51 14.45 Favored 'General case' 0 CA--C 1.485 -1.541 0 N-CA-C 113.008 0.744 . . . . 62.11 113.008 -175.606 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -70.5 -39.23 68.94 Favored Glycine 0 CA--C 1.53 0.992 0 N-CA-C 115.978 1.151 . . . . 46.96 115.978 174.134 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -60.01 -49.82 76.17 Favored 'General case' 0 C--O 1.249 1.032 0 O-C-N 121.119 -1.224 . . . . 43.13 107.775 179.93 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 58.5 m-20 -63.23 -36.16 82.74 Favored 'General case' 0 CA--C 1.491 -1.304 0 CA-C-N 114.061 -1.427 . . . . 50.98 112.152 -173.32 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 2.7 ttm-85 -70.59 -39.72 73.68 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 118.135 -1.426 . . . . 78.58 109.351 -179.073 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 70.2 t -60.17 -46.84 94.03 Favored 'Isoleucine or valine' 0 CA--C 1.58 2.097 0 O-C-N 121.198 -0.939 . . . . 46.21 109.609 173.528 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 22.6 m-85 -60.32 -44.43 95.47 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.098 -1.002 . . . . 46.21 109.799 -175.427 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 49.6 tp10 -61.51 -47.98 83.12 Favored 'General case' 0 CA--C 1.486 -1.513 0 O-C-N 123.948 0.78 . . . . 75.02 110.794 174.648 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 41.9 ttm180 -65.16 -42.33 93.85 Favored 'General case' 0 C--O 1.214 -0.804 0 C-N-CA 119.126 -1.029 . . . . 57.35 113.082 -174.919 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 16.1 mt -91.28 3.74 54.09 Favored 'General case' 0 CA--C 1.588 2.441 0 N-CA-C 113.363 0.875 . . . . 50.54 113.363 -175.087 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 56.2 44.7 88.94 Favored Glycine 0 C--O 1.22 -0.776 0 N-CA-C 110.866 -0.894 . . . . 52.19 110.866 177.724 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 25.9 mtt -89.14 -22.28 22.93 Favored 'General case' 0 CA--C 1.506 -0.739 0 N-CA-C 114.187 1.18 . . . . 54.16 114.187 -164.081 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 39.0 mt -78.04 120.92 23.56 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 118.926 -1.109 . . . . 61.57 109.352 -169.055 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -51.51 110.97 0.51 Allowed 'General case' 0 C--O 1.257 1.483 0 O-C-N 124.194 0.934 . . . . 85.85 110.571 170.231 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 7.1 mmtp . . . . . 0 CA--C 1.552 1.026 0 O-C-N 124.857 1.348 . . . . 84.73 111.464 172.016 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 105' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 106' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 107' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 109' ' ' HOH . . . . . 0.424 ' O ' HG23 ' A' ' 7' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 build full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 125' ' ' HOH . . . . . 0.488 ' O ' ' HG3' ' A' ' 8' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 133' ' ' HOH . . . . . 1.164 ' O ' HG21 ' A' ' 7' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 149' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 151' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 152' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 153' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 154' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 155' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 156' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 157' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 158' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 159' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 160' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 161' ' ' HOH . . . . . 0.562 ' O ' ' HG3' ' A' ' 63' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 162' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 163' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 164' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 165' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 166' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' ASN . . . . . 0.437 ' OD1' ' HE2' ' A' ' 6' ' ' LYS . 56.4 t30 . . . . . 0 N--CA 1.506 2.364 0 N-CA-C 112.707 0.632 . . . . 90.120000000000005 112.707 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 51.5 t30 -53.47 -39.28 64.37 Favored 'General case' 0 CA--C 1.551 1.004 0 N-CA-C 113.155 0.798 . . . . 87.069999999999993 113.155 178.983 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 39.9 tttt -68.36 -18.27 64.44 Favored 'General case' 0 C--O 1.248 1.004 0 N-CA-C 113.512 0.931 . . . . 79.859999999999999 113.512 178.728 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 62.0 mt -93.03 -2.26 55.83 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 114.485 1.291 . . . . 58.659999999999997 114.485 179.918 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.437 ' HE2' ' OD1' ' A' ' 2' ' ' ASN . 75.2 mmtt -88.82 77.68 7.75 Favored 'General case' 0 C--O 1.212 -0.901 0 CA-C-O 122.342 1.068 . . . . 67.290000000000006 109.994 177.689 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' THR . . . . . 1.164 HG21 ' O ' ' A' ' 133' ' ' HOH . 0.8 OUTLIER -137.89 152.9 49.48 Favored 'General case' 0 N--CA 1.425 -1.691 0 C-N-CA 125.455 1.502 . . . . 55.039999999999999 107.073 -167.926 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.488 ' HG3' ' O ' ' A' ' 125' ' ' HOH . 16.8 tp60 -74.72 -31.71 61.93 Favored 'General case' 0 N--CA 1.431 -1.387 0 CA-C-O 122.36 1.076 . . . . 64.849999999999994 108.84 -178.017 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.586 ' HB3' ' CG2' ' A' ' 7' ' ' THR . . . -56.0 -48.48 75.82 Favored 'General case' 0 N--CA 1.441 -0.88 0 CA-C-N 114.787 -1.097 . . . . 46.310000000000002 110.97 172.415 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.884 ' H ' HG22 ' A' ' 7' ' ' THR . 44.4 t -64.96 -43.82 96.15 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.553 0 N-CA-C 109.799 -0.445 . . . . 42.109999999999999 109.799 178.341 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -61.23 -39.21 89.45 Favored 'General case' 0 C--O 1.259 1.555 0 N-CA-C 112.596 0.591 . . . . 61.109999999999999 112.596 179.027 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 18.1 mt-30 -70.82 -38.51 73.28 Favored 'General case' 0 C--O 1.162 -3.504 0 C-N-CA 118.162 -1.415 . . . . 55.75 112.88 176.778 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 54.6 tp -50.93 -51.24 54.19 Favored 'General case' 0 C--O 1.209 -1.05 0 N-CA-C 108.449 -0.945 . . . . 40.210000000000001 108.449 170.212 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 20.6 m-30 -64.53 -35.68 81.75 Favored 'General case' 0 CA--C 1.495 -1.139 0 N-CA-C 113.215 0.82 . . . . 41.140000000000001 113.215 -178.281 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 44.6 mm-40 -68.75 -39.92 80.06 Favored 'General case' 0 CA--C 1.489 -1.392 0 C-N-CA 117.55 -1.66 . . . . 41.289999999999999 109.853 177.954 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -55.48 -46.61 76.85 Favored 'General case' 0 C--O 1.201 -1.484 0 O-C-N 123.994 0.809 . . . . 40.869999999999997 108.999 174.838 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 77.7 mt -68.78 -46.82 78.88 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 N-CA-C 107.793 -1.188 . . . . 40.369999999999997 107.793 -174.913 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.435 ' N ' HD23 ' A' ' 18' ' ' LEU . 0.7 OUTLIER -68.51 -9.01 46.32 Favored 'General case' 0 CA--C 1.506 -0.733 0 N-CA-C 115.371 1.619 . . . . 45.939999999999998 115.371 178.155 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 88.6 p -87.0 -10.61 52.72 Favored 'General case' 0 N--CA 1.487 1.379 0 CA-C-N 119.98 1.263 . . . . 44.020000000000003 111.73 177.629 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 74.7 mt -64.79 131.52 47.03 Favored 'General case' 0 C--O 1.215 -0.723 0 N-CA-C 109.229 -0.656 . . . . 43.950000000000003 109.229 -177.874 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 15.9 mtpt -99.92 -21.17 15.79 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 114.857 1.429 . . . . 68.790000000000006 114.857 -170.103 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -160.37 173.85 15.02 Favored 'General case' 0 CA--C 1.489 -1.397 0 C-N-CA 120.229 -0.588 . . . . 55.420000000000002 111.111 -179.198 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.2 mp -65.24 -29.39 70.18 Favored 'General case' 0 C--O 1.198 -1.634 0 N-CA-C 114.759 1.392 . . . . 46.93 114.759 -174.238 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 68.1 m-20 -66.66 -36.68 83.11 Favored 'General case' 0 C--O 1.208 -1.11 0 CA-C-N 119.625 1.102 . . . . 55.710000000000001 110.857 176.845 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 79.6 mt-10 -67.38 -43.14 82.12 Favored 'General case' 0 C--O 1.248 1.015 0 N-CA-C 109.293 -0.632 . . . . 50.5 109.293 176.38 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -56.05 -49.21 74.39 Favored 'General case' 0 C--O 1.21 -0.995 0 O-C-N 124.434 1.084 . . . . 41.609999999999999 110.255 175.233 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 10.0 m-85 -57.36 -48.44 79.03 Favored 'General case' 0 CA--C 1.554 1.126 0 CA-C-O 122.647 1.213 . . . . 48.270000000000003 112.783 178.601 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -57.92 -52.46 65.4 Favored 'General case' 0 C--N 1.311 -1.068 0 O-C-N 121.464 -0.773 . . . . 51.049999999999997 111.704 -179.697 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 78.4 t80 -61.67 -57.31 12.48 Favored 'General case' 0 C--N 1.313 -1.014 0 N-CA-C 113.682 0.993 . . . . 47.479999999999997 113.682 178.989 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 65.1 m-85 -64.88 -30.36 71.36 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 119.157 -1.017 . . . . 41.219999999999999 112.442 -174.137 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -70.77 -28.96 65.07 Favored 'General case' 0 C--N 1.31 -1.137 0 C-N-CA 120.32 -0.552 . . . . 64.950000000000003 110.362 175.845 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 91.4 m-20 -72.57 -41.18 65.99 Favored 'General case' 0 CA--C 1.506 -0.728 0 C-N-CA 119.032 -1.067 . . . . 50.869999999999997 111.257 174.681 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 38.8 t -84.83 -27.22 6.72 Favored 'Isoleucine or valine' 0 C--O 1.24 0.573 0 N-CA-C 114.219 1.192 . . . . 47.700000000000003 114.219 -174.031 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 69.3 m -122.12 161.64 22.72 Favored 'General case' 0 CA--C 1.49 -1.348 0 CA-C-N 118.213 0.461 . . . . 46.359999999999999 110.492 -172.078 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' THR . . . . . 0.407 ' OG1' ' HG3' ' A' ' 38' ' ' GLU . 31.0 p -79.44 163.1 25.04 Favored 'General case' 0 C--O 1.26 1.653 0 CA-C-O 122.03 0.919 . . . . 46.240000000000002 110.443 165.86 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.8 mp -60.65 -44.15 96.37 Favored 'Isoleucine or valine' 0 C--O 1.246 0.87 0 N-CA-C 107.452 -1.314 . . . . 53.780000000000001 107.452 -178.424 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 6.8 m120 -66.3 -34.31 77.71 Favored 'General case' 0 N--CA 1.421 -1.904 0 CA-C-N 115.279 -0.873 . . . . 55.380000000000003 113.293 -175.767 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.407 ' HG3' ' OG1' ' A' ' 35' ' ' THR . 98.1 mt-10 -64.34 -46.9 81.45 Favored 'General case' 0 C--O 1.192 -1.933 0 C-N-CA 118.781 -1.168 . . . . 49.149999999999999 110.594 175.434 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 92.2 mt -61.66 -45.23 99.11 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.486 0 N-CA-C 108.601 -0.888 . . . . 42.030000000000001 108.601 179.358 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 63.6 mt -59.31 -33.25 70.87 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 122.395 1.093 . . . . 43.789999999999999 112.032 178.293 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' SER . . . . . 0.476 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 30.1 t -72.76 -35.9 67.57 Favored 'General case' 0 C--N 1.311 -1.086 0 CA-C-N 115.317 -0.856 . . . . 48.07 113.189 -179.595 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 56.0 mt -73.99 -39.09 63.89 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 120.544 -0.462 . . . . 45.219999999999999 111.198 177.108 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 54.3 p -65.79 -35.98 82.22 Favored 'General case' 0 C--O 1.203 -1.344 0 O-C-N 121.991 -0.443 . . . . 46.43 111.728 177.583 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 41.8 tt0 -61.81 -46.63 88.68 Favored 'General case' 0 N--CA 1.442 -0.847 0 N-CA-C 112.459 0.54 . . . . 46.670000000000002 112.459 171.547 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.476 ' HG3' ' O ' ' A' ' 41' ' ' SER . 0.7 OUTLIER -62.06 -41.13 97.84 Favored 'General case' 0 C--O 1.2 -1.511 0 C-N-CA 117.885 -1.526 . . . . 56.299999999999997 110.669 178.037 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -63.43 -42.71 98.71 Favored 'General case' 0 CA--C 1.57 1.725 0 C-N-CA 118.869 -1.132 . . . . 41.649999999999999 109.715 -178.588 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 60.6 tt0 -67.25 -42.97 83.02 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.322 -0.861 . . . . 55.850000000000001 110.436 -178.232 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 24.9 t -52.08 -44.14 39.15 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.742 0 N-CA-C 108.826 -0.805 . . . . 42.979999999999997 108.826 172.864 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -69.52 -42.29 74.87 Favored 'General case' 0 N--CA 1.435 -1.186 0 C-N-CA 119.501 -0.88 . . . . 41.68 110.812 -172.584 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.5 ttpt -60.37 -47.84 84.31 Favored 'General case' 0 CA--C 1.574 1.866 0 CA-C-O 121.772 0.796 . . . . 47.609999999999999 110.921 176.584 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' MET . . . . . . . . . . . . . 88.0 mtp -66.08 -32.84 74.53 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 105.955 -1.869 . . . . 46.840000000000003 105.955 -175.944 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.528 HD13 HD22 ' A' ' 76' ' ' ASN . 32.5 mt -65.17 -38.14 89.58 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 120.248 -1.532 . . . . 41.710000000000001 109.653 -179.32 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.574 HH12 HD21 ' A' ' 80' ' ' ASN . 22.0 mmt180 -80.36 -21.55 42.29 Favored 'General case' 0 C--O 1.196 -1.714 0 C-N-CA 120.306 -0.558 . . . . 56.299999999999997 110.454 179.96 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -75.59 4.46 7.58 Favored 'General case' 0 N--CA 1.432 -1.349 0 O-C-N 121.597 -0.689 . . . . 50.829999999999998 112.168 169.111 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 16.0 m-70 70.86 25.06 3.97 Favored 'General case' 0 C--N 1.313 -1.006 0 N-CA-C 116.901 2.186 . . . . 61.75 116.901 175.381 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.414 ' NH2' ' OD2' ' A' ' 60' ' ' ASP . 36.9 mmm-85 -81.24 158.2 24.92 Favored 'General case' 0 CA--C 1.484 -1.563 0 CA-C-O 118.685 -0.674 . . . . 66.319999999999993 109.908 178.004 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 72.4 p -81.09 163.3 23.27 Favored 'General case' 0 CA--C 1.514 -0.426 0 O-C-N 124.549 1.156 . . . . 43.969999999999999 110.225 -178.445 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 3.7 m-30 -63.01 -36.26 82.96 Favored 'General case' 0 CA--C 1.508 -0.66 0 C-N-CA 119.278 -0.969 . . . . 56.560000000000002 111.834 -179.757 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 22.6 tp -58.45 -49.45 77.26 Favored 'General case' 0 CA--C 1.49 -1.345 0 N-CA-C 113.02 0.748 . . . . 50.380000000000003 113.02 176.069 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.414 ' OD2' ' NH2' ' A' ' 56' ' ' ARG . 88.2 m-20 -65.25 -32.42 74.08 Favored 'General case' 0 N--CA 1.424 -1.748 0 N-CA-C 114.21 1.189 . . . . 54.259999999999998 114.21 177.527 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 74.8 mt -71.69 -46.77 60.54 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.087 0 N-CA-C 107.524 -1.287 . . . . 47.829999999999998 107.524 178.348 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.53 -34.69 74.49 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-N 118.673 0.67 . . . . 54.340000000000003 112.272 179.557 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.562 ' HG3' ' O ' ' A' ' 161' ' ' HOH . 89.9 mt-10 -68.29 -52.71 30.6 Favored 'General case' 0 C--O 1.2 -1.521 0 N-CA-C 113.373 0.879 . . . . 76.560000000000002 113.373 176.567 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.8 tptp -70.92 -30.76 67.17 Favored 'General case' 0 N--CA 1.412 -2.339 0 C-N-CA 120.955 -0.298 . . . . 61.090000000000003 111.76 -172.433 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 34.4 p -107.9 -23.08 12.19 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 121.3 -0.875 . . . . 55.060000000000002 110.699 -168.504 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 89.14 -12.07 67.47 Favored Glycine 0 CA--C 1.497 -1.05 0 O-C-N 121.784 -0.572 . . . . 52.649999999999999 112.953 -174.947 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -60.98 143.45 55.22 Favored 'General case' 0 C--O 1.24 0.59 0 CA-C-N 118.082 0.941 . . . . 50.350000000000001 110.5 -176.824 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 88.0 p -74.13 163.51 27.76 Favored 'General case' 0 N--CA 1.433 -1.309 0 N-CA-C 107.463 -1.31 . . . . 52.159999999999997 107.463 168.463 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 82.4 p -72.79 -22.7 60.79 Favored 'General case' 0 C--O 1.244 0.809 0 CA-C-O 122.002 0.905 . . . . 53.420000000000002 111.242 -176.388 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -65.34 -46.86 78.54 Favored 'General case' 0 N--CA 1.437 -1.107 0 CA-C-N 115.235 -0.893 . . . . 52.310000000000002 110.493 171.136 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 86.2 m -57.4 -42.84 83.03 Favored 'General case' 0 CA--C 1.497 -1.066 0 CA-C-N 118.902 0.774 . . . . 50.729999999999997 110.353 171.877 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 89.0 mt -61.42 -43.73 97.26 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.814 0 C-N-CA 118.935 -1.106 . . . . 47.200000000000003 109.313 -176.521 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 56.7 m -64.04 -43.12 96.49 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 115.824 -0.625 . . . . 48.68 112.476 -178.922 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 54.8 mtm-85 -57.29 -49.6 75.57 Favored 'General case' 0 C--O 1.195 -1.816 0 N-CA-C 112.764 0.653 . . . . 65.129999999999995 112.764 172.869 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 40.0 t -57.34 -41.66 78.83 Favored 'Isoleucine or valine' 0 C--O 1.247 0.93 0 CA-C-O 122.727 1.251 . . . . 44.75 109.341 178.394 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' ASN . . . . . 0.528 HD22 HD13 ' A' ' 52' ' ' LEU . 13.4 t-20 -61.63 -33.53 74.09 Favored 'General case' 0 C--O 1.211 -0.934 0 C-N-CA 118.56 -1.256 . . . . 47.93 112.362 -177.405 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 46.3 mtt85 -62.9 -45.41 92.64 Favored 'General case' 0 C--N 1.313 -0.981 0 C-N-CA 119.643 -0.823 . . . . 76.299999999999997 112.559 172.625 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 68.2 m -67.48 -30.21 69.85 Favored 'General case' 0 CA--C 1.489 -1.378 0 C-N-CA 119.994 -0.682 . . . . 45.979999999999997 112.606 179.991 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.402 HD21 ' HG2' ' A' ' 53' ' ' ARG . 22.3 tp -69.44 -41.11 76.73 Favored 'General case' 0 CA--C 1.489 -1.391 0 N-CA-C 108.557 -0.905 . . . . 45.729999999999997 108.557 -177.728 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.574 HD21 HH12 ' A' ' 53' ' ' ARG . 27.8 m120 -96.41 -27.41 14.93 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 113.709 1.003 . . . . 52.82 113.709 -168.424 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 76.4 m-85 -126.9 39.49 3.91 Favored 'General case' 0 C--O 1.198 -1.638 0 CA-C-N 115.941 -0.572 . . . . 66.450000000000003 110.337 -173.419 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -123.94 -147.29 7.2 Favored Glycine 0 N--CA 1.436 -1.362 0 N-CA-C 107.645 -2.182 . . . . 51.140000000000001 107.645 -172.202 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -92.49 4.58 53.25 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 114.259 1.207 . . . . 57.329999999999998 114.259 -177.987 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 30.1 m-20 63.9 27.51 14.45 Favored 'General case' 0 CA--C 1.485 -1.541 0 N-CA-C 113.008 0.744 . . . . 62.109999999999999 113.008 -175.606 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -70.5 -39.23 68.94 Favored Glycine 0 CA--C 1.53 0.992 0 N-CA-C 115.978 1.151 . . . . 46.960000000000001 115.978 174.134 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -60.01 -49.82 76.17 Favored 'General case' 0 C--O 1.249 1.032 0 O-C-N 121.119 -1.224 . . . . 43.130000000000003 107.775 179.93 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 58.5 m-20 -63.23 -36.16 82.74 Favored 'General case' 0 CA--C 1.491 -1.304 0 CA-C-N 114.061 -1.427 . . . . 50.979999999999997 112.152 -173.32 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 2.7 ttm-85 -70.59 -39.72 73.68 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 118.135 -1.426 . . . . 78.579999999999998 109.351 -179.073 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 70.2 t -60.17 -46.84 94.03 Favored 'Isoleucine or valine' 0 CA--C 1.58 2.097 0 O-C-N 121.198 -0.939 . . . . 46.210000000000001 109.609 173.528 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 22.6 m-85 -60.32 -44.43 95.47 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.098 -1.002 . . . . 46.210000000000001 109.799 -175.427 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 49.6 tp10 -61.51 -47.98 83.12 Favored 'General case' 0 CA--C 1.486 -1.513 0 O-C-N 123.948 0.78 . . . . 75.019999999999996 110.794 174.648 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 41.9 ttm180 -65.16 -42.33 93.85 Favored 'General case' 0 C--O 1.214 -0.804 0 C-N-CA 119.126 -1.029 . . . . 57.350000000000001 113.082 -174.919 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 16.1 mt -91.28 3.74 54.09 Favored 'General case' 0 CA--C 1.588 2.441 0 N-CA-C 113.363 0.875 . . . . 50.539999999999999 113.363 -175.087 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 56.2 44.7 88.94 Favored Glycine 0 C--O 1.22 -0.776 0 N-CA-C 110.866 -0.894 . . . . 52.189999999999998 110.866 177.724 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 25.9 mtt -89.14 -22.28 22.93 Favored 'General case' 0 CA--C 1.506 -0.739 0 N-CA-C 114.187 1.18 . . . . 54.159999999999997 114.187 -164.081 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 39.0 mt -78.04 120.92 23.56 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 118.926 -1.109 . . . . 61.57 109.352 -169.055 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -51.51 110.97 0.51 Allowed 'General case' 0 C--O 1.257 1.483 0 O-C-N 124.194 0.934 . . . . 85.849999999999994 110.571 170.231 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 7.1 mmtp . . . . . 0 CA--C 1.552 1.026 0 O-C-N 124.857 1.348 . . . . 84.730000000000004 111.464 172.016 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' HOH . . . . . 0.424 ' O ' HG23 ' A' ' 7' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 . 001 ecloud nobuild full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' HOH . . . . . 0.488 ' O ' ' HG3' ' A' ' 8' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' HOH . . . . . 1.164 ' O ' HG21 ' A' ' 7' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 158' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 159' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 160' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 161' ' ' HOH . . . . . 0.562 ' O ' ' HG3' ' A' ' 63' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 162' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 163' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 164' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 165' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 166' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_