data_2ra4_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 2ra4 _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 89.2 m-20 . . . . . 0 N--CA 1.508 2.436 0 CA-C-O 120.629 0.252 . . . . 40.049999999999997 111.325 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -157.75 163.12 38.42 Favored 'General case' 0 CA--C 1.496 -1.109 0 N-CA-C 108.086 -1.079 . . . . 31.210000000000001 108.086 -173.37 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -81.46 146.09 30.42 Favored 'General case' 0 C--O 1.262 1.714 0 N-CA-C 107.212 -1.403 . . . . 33.009999999999998 107.212 170.53 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -119.49 150.61 39.95 Favored 'General case' 0 C--O 1.242 0.68 0 N-CA-C 107.316 -1.365 . . . . 38.369999999999997 107.316 173.403 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 19.5 m -122.27 162.28 38.55 Favored Pre-proline 0 C--O 1.253 1.263 0 O-C-N 124.598 1.186 . . . . 29.460000000000001 111.505 -173.393 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_exo -70.34 164.52 34.81 Favored 'Trans proline' 0 C--O 1.275 2.347 0 N-CA-C 116.274 1.606 . . . . 27.449999999999999 116.274 -174.37 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 66.4 m -108.35 162.11 14.4 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 124.561 1.145 . . . . 27.600000000000001 108.646 176.141 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 99.8 m -111.51 124.9 53.23 Favored 'General case' 0 N--CA 1.435 -1.193 0 N-CA-C 106.197 -1.779 . . . . 30.690000000000001 106.197 -177.158 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 82.0 m -130.4 152.55 49.68 Favored 'General case' 0 N--CA 1.483 1.18 0 CA-C-O 118.452 -0.785 . . . . 34.689999999999998 110.512 179.301 -70.793 -55.786 -89.262 107.04 2.103 107.764 -66.135 -67.646 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 92.9 m -106.24 129.5 54.27 Favored 'General case' 0 N--CA 1.481 1.091 0 O-C-N 124.24 0.962 . . . . 34.359999999999999 109.996 173.424 -70.037 -83.269 -80.989 100.939 2.175 103.361 -75.377 -73.893 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -114.02 -5.95 13.13 Favored 'General case' 0 C--O 1.22 -0.478 0 CA-C-N 119.392 0.996 . . . . 35.770000000000003 112.447 175.372 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 54.9 p -139.7 151.0 45.53 Favored 'General case' 0 CA--C 1.537 0.442 0 N-CA-C 106.58 -1.637 . . . . 35.590000000000003 106.58 172.375 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 27.5 m-85 -109.56 142.68 40.31 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 114.937 -1.029 . . . . 35.640000000000001 110.316 -177.319 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 68.2 m -60.32 133.08 55.75 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 115.227 -0.897 . . . . 32.840000000000003 112.652 177.169 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.4 p -90.7 -15.01 31.08 Favored 'General case' 0 N--CA 1.476 0.842 0 O-C-N 124.441 1.088 . . . . 41.280000000000001 113.547 175.12 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 63.8 tttt -92.54 133.07 36.3 Favored 'General case' 0 CA--C 1.503 -0.847 0 N-CA-C 107.427 -1.323 . . . . 48.600000000000001 107.427 176.506 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 53.8 tttm -88.05 100.68 13.11 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 107.298 -1.371 . . . . 46.25 107.298 170.002 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 18.2 tt -65.84 154.24 7.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 C-N-CA 124.176 0.991 . . . . 36.869999999999997 111.102 178.274 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' SER . . . . . 0.445 ' OG ' ' CG ' ' A' ' 23' ' ' GLN . 28.1 t -61.77 134.38 56.66 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 108.497 -0.927 . . . . 38.259999999999998 108.497 176.821 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 51.9 tp -64.02 -30.86 71.9 Favored 'General case' 0 CA--C 1.515 -0.368 0 C-N-CA 120.004 -0.679 . . . . 31.309999999999999 110.985 178.12 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' GLN . . . . . 0.445 ' CG ' ' OG ' ' A' ' 21' ' ' SER . 18.0 tm0? -60.54 -21.38 62.46 Favored 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 114.772 1.397 . . . . 34.780000000000001 114.772 178.336 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 73.0 mtp180 -78.69 -10.33 59.72 Favored 'General case' 0 CA--C 1.492 -1.255 0 O-C-N 120.781 -1.199 . . . . 38.689999999999998 113.549 176.666 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 53.7 mt -96.71 143.77 27.34 Favored 'General case' 0 C--O 1.25 1.093 0 N-CA-C 115.154 1.539 . . . . 29.27 115.154 -169.621 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 40.2 tttp -104.9 -39.08 6.4 Favored 'General case' 0 C--O 1.24 0.593 0 C-N-CA 124.389 1.075 . . . . 40.759999999999998 110.753 -178.782 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 89.0 p -170.67 174.65 4.91 Favored 'General case' 0 C--O 1.249 1.072 0 N-CA-C 108.308 -0.997 . . . . 32.960000000000001 108.308 -170.679 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 20.0 p90 -143.77 159.39 42.59 Favored 'General case' 0 N--CA 1.453 -0.29 0 O-C-N 124.73 1.269 . . . . 32.689999999999998 109.308 172.863 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 33.6 m -135.37 155.71 37.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 O-C-N 125.395 1.684 . . . . 33.469999999999999 109.408 170.227 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 45.5 mm -95.86 140.27 17.42 Favored 'Isoleucine or valine' 0 C--O 1.252 1.196 0 N-CA-C 105.496 -2.039 . . . . 34.350000000000001 105.496 169.127 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 18.6 p -59.68 154.14 18.58 Favored 'General case' 0 C--O 1.28 2.68 0 C-N-CA 119.991 -0.684 . . . . 29.539999999999999 112.801 -178.327 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 6.9 t -47.1 146.29 1.84 Allowed 'General case' 0 C--O 1.259 1.587 0 CA-C-O 123.148 1.452 . . . . 30.73 113.275 173.516 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 81.7 p -63.8 -14.34 52.04 Favored 'General case' 0 CA--C 1.546 0.801 0 N-CA-C 114.76 1.393 . . . . 34.909999999999997 114.76 179.331 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 88.8 mtt-85 -70.4 -21.44 62.85 Favored 'General case' 0 C--O 1.252 1.192 0 N-CA-C 114.388 1.255 . . . . 36.579999999999998 114.388 177.546 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 85.1 m -68.46 146.03 97.57 Favored Pre-proline 0 C--O 1.24 0.583 0 N-CA-C 108.202 -1.036 . . . . 33.640000000000001 108.202 -175.477 -67.646 -66.135 -89.262 107.764 2.103 107.04 -55.786 -70.793 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_exo -58.73 -34.29 98.87 Favored 'Trans proline' 0 CA--C 1.536 0.614 0 O-C-N 123.624 1.328 . . . . 34.07 114.031 177.7 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -130.54 139.96 50.47 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 108.838 -0.801 . . . . 52.030000000000001 108.838 -179.957 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -67.95 137.88 55.51 Favored 'General case' 0 CA--C 1.549 0.922 0 O-C-N 123.576 0.547 . . . . 51.100000000000001 110.381 175.322 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -149.09 156.95 42.98 Favored 'General case' 0 CA--C 1.48 -1.721 0 C-N-CA 119.757 -0.777 . . . . 29.050000000000001 109.128 178.795 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 93.7 t -97.77 137.21 26.0 Favored 'Isoleucine or valine' 0 C--O 1.248 1.002 0 O-C-N 125.678 1.861 . . . . 30.449999999999999 106.753 171.429 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 96.6 mt -115.27 116.55 52.85 Favored 'Isoleucine or valine' 0 C--O 1.255 1.385 0 N-CA-C 106.351 -1.722 . . . . 30.219999999999999 106.351 168.625 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 46.4 m-85 -83.03 140.92 32.42 Favored 'General case' 0 N--CA 1.432 -1.36 0 CA-C-N 115.987 -0.551 . . . . 29.719999999999999 110.083 171.685 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 9.4 ttt85 -109.4 126.15 53.14 Favored 'General case' 0 C--O 1.255 1.378 0 N-CA-C 107.17 -1.419 . . . . 53.530000000000001 107.17 173.138 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 20.9 p -84.46 163.21 19.59 Favored 'General case' 0 C--O 1.244 0.787 0 C-N-CA 118.617 -1.233 . . . . 28.600000000000001 108.254 -178.693 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 93.8 mttt -60.14 -23.24 63.75 Favored 'General case' 0 C--O 1.253 1.239 0 C-N-CA 122.817 0.447 . . . . 31.030000000000001 110.692 178.611 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 53.5 mt -93.2 0.77 57.22 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 117.9 -1.52 . . . . 28.780000000000001 112.507 177.948 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 103.2 2.05 48.07 Favored Glycine 0 N--CA 1.482 1.701 0 CA-C-O 118.718 -1.045 . . . . 33.770000000000003 114.657 171.505 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 35.7 ttmt -77.26 148.79 35.57 Favored 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 104.752 -2.314 . . . . 39.710000000000001 104.752 -175.365 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 88.9 mt-10 -108.18 130.87 55.11 Favored 'General case' 0 C--O 1.25 1.093 0 N-CA-C 107.343 -1.355 . . . . 48.579999999999998 107.343 172.682 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 96.8 mt -122.7 128.54 75.32 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 O-C-N 125.125 1.516 . . . . 37.810000000000002 108.929 -177.189 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 61.0 m -80.69 139.06 36.36 Favored 'General case' 0 C--O 1.265 1.888 0 O-C-N 124.734 1.271 . . . . 36.280000000000001 109.821 176.761 -73.893 -75.377 -80.989 103.361 2.175 100.939 -83.269 -70.037 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -148.12 152.77 37.88 Favored 'General case' 0 CA--C 1.495 -1.163 0 C-N-CA 120.044 -0.662 . . . . 26.649999999999999 110.96 179.147 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 67.0 t0 -83.88 118.6 71.79 Favored Pre-proline 0 C--O 1.183 -2.431 0 O-C-N 124.397 1.061 . . . . 29.829999999999998 108.205 -172.05 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -58.28 -21.97 55.14 Favored 'Trans proline' 0 C--O 1.268 2.017 0 C-N-CA 122.039 1.826 . . . . 30.41 114.401 179.26 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 51.1 mttp -79.8 -19.93 47.38 Favored 'General case' 0 C--O 1.211 -0.965 0 N-CA-C 113.338 0.866 . . . . 28.399999999999999 113.338 -178.739 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -72.76 139.12 46.91 Favored 'General case' 0 N--CA 1.505 2.278 0 O-C-N 121.325 -0.859 . . . . 42.890000000000001 113.031 -175.991 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 76.8 tttt -56.56 -46.51 80.67 Favored 'General case' 0 CA--C 1.551 0.986 0 O-C-N 121.483 -0.76 . . . . 43.439999999999998 109.557 -177.912 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 46.8 p-90 -61.93 -36.72 82.21 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 118.474 -1.29 . . . . 31.190000000000001 113.295 -175.658 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 75.0 t -66.53 -46.26 86.78 Favored 'Isoleucine or valine' 0 C--O 1.241 0.634 0 N-CA-C 106.826 -1.546 . . . . 24.690000000000001 106.826 -177.688 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 -60.37 -41.14 93.11 Favored 'General case' 0 C--O 1.243 0.714 0 N-CA-C 113.626 0.973 . . . . 30.030000000000001 113.626 176.998 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ASN . . . . . 0.823 ' OD1' ' O ' ' A' ' 111' ' ' HOH . 86.1 m-20 -65.24 -39.62 92.95 Favored 'General case' 0 C--O 1.242 0.678 0 N-CA-C 108.186 -1.042 . . . . 36.799999999999997 108.186 179.528 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 7.6 m-30 -68.08 -38.13 82.01 Favored 'General case' 0 CA--C 1.507 -0.694 0 C-N-CA 118.968 -1.093 . . . . 30.600000000000001 110.357 -178.647 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 73.9 mtp -62.57 -38.88 91.82 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 108.991 -0.744 . . . . 29.420000000000002 108.991 -179.88 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 23.7 tptm -63.1 -39.27 94.21 Favored 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 109.814 -0.439 . . . . 39.299999999999997 109.814 177.548 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 36.7 m80 -71.94 -39.32 69.5 Favored 'General case' 0 CA--C 1.499 -1.011 0 C-N-CA 118.333 -1.347 . . . . 34.479999999999997 112.194 -179.323 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 86.6 mt -74.57 -36.18 63.05 Favored 'General case' 0 N--CA 1.437 -1.086 0 N-CA-C 113.796 1.036 . . . . 38.390000000000001 113.796 -175.232 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.26 1.752 0 CA-C-O 122.891 1.273 . . . . 44.240000000000002 115.23 179.64 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 80.1 m-20 . . . . . 0 N--CA 1.514 2.733 0 CA-C-O 120.68 0.276 . . . . 42.149999999999999 111.075 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -151.46 157.31 42.17 Favored 'General case' 0 CA--C 1.499 -1.015 0 N-CA-C 106.858 -1.534 . . . . 27.609999999999999 106.858 -166.934 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 76.4 mt -80.63 148.95 30.03 Favored 'General case' 0 N--CA 1.439 -1.014 0 CA-C-N 114.403 -1.272 . . . . 27.699999999999999 108.269 170.403 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -122.37 149.25 44.05 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 106.421 -1.696 . . . . 41.289999999999999 106.421 175.458 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 12.9 m -119.77 159.45 46.45 Favored Pre-proline 0 C--O 1.284 2.906 0 O-C-N 123.802 0.689 . . . . 27.199999999999999 111.104 -174.012 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -67.37 165.8 25.75 Favored 'Trans proline' 0 C--O 1.27 2.086 0 N-CA-C 115.909 1.465 . . . . 28.420000000000002 115.909 -175.344 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 61.2 m -111.05 158.79 18.41 Favored 'General case' 0 C--O 1.253 1.262 0 N-CA-C 105.715 -1.957 . . . . 31.66 105.715 179.178 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 51.6 m -111.89 125.27 53.86 Favored 'General case' 0 N--CA 1.443 -0.776 0 CA-C-N 115.011 -0.995 . . . . 33.829999999999998 109.944 -179.637 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' CYS . . . . . . . . . . . . . 76.8 m -135.42 160.28 38.94 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 118.432 -1.307 . . . . 32.539999999999999 107.667 -176.333 -61.013 -60.353 -86.139 101.314 2.09 103.947 -65.722 -67.415 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' CYS . . . . . . . . . . . . . 85.8 m -113.69 127.76 56.16 Favored 'General case' 0 CA--C 1.495 -1.16 0 CA-C-N 114.643 -1.162 . . . . 32.25 112.013 176.304 -67.259 -83.856 -81.649 100.223 2.183 103.475 -81.143 -73.771 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' PHE . . . . . . . . . . . . . 73.2 m-85 -106.44 -15.23 14.86 Favored 'General case' 0 C--O 1.222 -0.391 0 N-CA-C 113.448 0.907 . . . . 32.450000000000003 113.448 179.952 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 67.8 p -139.53 152.68 47.12 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 106.158 -1.793 . . . . 32.270000000000003 106.158 176.406 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 37.0 m-85 -111.66 142.76 43.57 Favored 'General case' 0 C--O 1.244 0.773 0 N-CA-C 107.911 -1.144 . . . . 35.539999999999999 107.911 -174.12 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 74.0 m -61.16 134.52 57.11 Favored 'General case' 0 C--O 1.243 0.742 0 N-CA-C 112.304 0.483 . . . . 31.620000000000001 112.304 178.806 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -87.19 -25.57 23.98 Favored 'General case' 0 C--N 1.347 0.473 0 N-CA-C 114.273 1.212 . . . . 38.07 114.273 173.161 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 80.8 tttt -82.58 125.75 31.51 Favored 'General case' 0 CA--C 1.51 -0.562 0 N-CA-C 109.697 -0.483 . . . . 43.740000000000002 109.697 176.635 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 19.4 tttt -75.87 103.37 5.92 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 120.577 -0.449 . . . . 46.289999999999999 110.228 166.104 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' ILE . . . . . . . . . . . . . 14.8 tt -66.26 149.32 11.59 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.41 0 C-N-CA 123.283 0.633 . . . . 37.850000000000001 109.967 179.418 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' SER . . . . . 0.457 ' OG ' ' CG ' ' B' ' 23' ' ' GLN . 27.1 t -55.04 130.24 41.04 Favored 'General case' 0 N--CA 1.445 -0.698 0 N-CA-C 113.209 0.818 . . . . 36.850000000000001 113.209 170.381 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' LEU . . . . . . . . . . . . . 52.3 tp -59.53 -33.06 70.91 Favored 'General case' 0 C--O 1.247 0.947 0 O-C-N 120.866 -1.147 . . . . 30.489999999999998 113.656 176.785 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' GLN . . . . . 0.457 ' CG ' ' OG ' ' B' ' 21' ' ' SER . 21.0 tm0? -60.93 -23.07 64.99 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.448 0.536 . . . . 34.770000000000003 112.448 -179.764 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 75.4 mtp180 -75.85 -15.19 60.26 Favored 'General case' 0 C--O 1.241 0.637 0 N-CA-C 113.893 1.072 . . . . 38.350000000000001 113.893 178.396 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 68.1 mt -94.18 147.94 22.68 Favored 'General case' 0 CA--C 1.513 -0.47 0 N-CA-C 115.121 1.526 . . . . 27.460000000000001 115.121 -168.653 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 31.9 tttt -111.49 -46.23 3.3 Favored 'General case' 0 C--O 1.243 0.757 0 CA-C-N 114.338 -1.301 . . . . 45.649999999999999 108.609 -177.109 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 77.3 p -160.27 173.12 16.18 Favored 'General case' 0 C--O 1.252 1.22 0 C-N-CA 119.643 -0.823 . . . . 31.050000000000001 108.9 -171.741 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' TYR . . . . . . . . . . . . . 14.3 p90 -142.73 158.71 43.37 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.859 -1.064 . . . . 30.789999999999999 112.907 166.039 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 32.9 m -134.11 155.91 40.11 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.735 0 CA-C-N 114.965 -1.016 . . . . 28.91 109.357 170.384 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 50.6 mm -93.28 141.45 14.71 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.758 0 N-CA-C 106.628 -1.619 . . . . 27.010000000000002 106.628 168.657 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' THR . . . . . . . . . . . . . 33.7 p -62.03 151.83 34.2 Favored 'General case' 0 C--N 1.311 -1.08 0 C-N-CA 118.991 -1.084 . . . . 27.280000000000001 113.805 -179.421 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 6.6 t -51.71 142.85 13.9 Favored 'General case' 0 C--O 1.249 1.073 0 N-CA-C 115.196 1.554 . . . . 36.600000000000001 115.196 173.809 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 5.1 p -62.41 -10.42 11.43 Favored 'General case' 0 N--CA 1.443 -0.805 0 C-N-CA 118.876 -1.13 . . . . 34.350000000000001 113.122 179.018 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' ARG . . . . . 0.85 ' NH1' ' O ' ' B' ' 100' ' ' HOH . 93.7 mtt180 -68.02 -24.24 65.08 Favored 'General case' 0 C--O 1.252 1.186 0 C-N-CA 119.305 -0.958 . . . . 59.490000000000002 111.887 176.576 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 84.6 m -67.43 145.09 98.32 Favored Pre-proline 0 CA--C 1.498 -1.02 0 CA-C-O 117.843 -1.075 . . . . 30.329999999999998 109.773 -178.576 -67.415 -65.722 -86.139 103.947 2.09 101.314 -60.353 -61.013 1 1 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -70.2 -8.67 24.16 Favored 'Trans proline' 0 N--CA 1.492 1.43 0 N-CA-C 119.162 2.716 . . . . 30.329999999999998 119.162 177.825 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -145.73 151.39 37.91 Favored 'General case' 0 C--O 1.253 1.239 0 O-C-N 121.102 -0.999 . . . . 37.939999999999998 111.077 171.641 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -81.52 135.67 35.6 Favored 'General case' 0 C--O 1.264 1.829 0 C-N-CA 119.605 -0.838 . . . . 33.770000000000003 110.093 -176.312 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -145.54 157.86 43.93 Favored 'General case' 0 CA--C 1.507 -0.673 0 C-N-CA 119.344 -0.942 . . . . 26.710000000000001 110.96 178.821 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' VAL . . . . . . . . . . . . . 71.3 t -99.97 137.07 28.63 Favored 'Isoleucine or valine' 0 C--O 1.253 1.246 0 CA-C-N 114.112 -1.404 . . . . 27.940000000000001 108.02 168.47 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' ILE . . . . . . . . . . . . . 66.2 mt -114.24 120.05 62.94 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.412 0 N-CA-C 104.681 -2.341 . . . . 27.140000000000001 104.681 170.443 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' PHE . . . . . . . . . . . . . 58.9 m-85 -89.57 142.89 27.26 Favored 'General case' 0 C--O 1.248 1.014 0 N-CA-C 108.516 -0.92 . . . . 29.890000000000001 108.516 171.009 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' ARG . . . . . . . . . . . . . 1.8 ttt180 -112.35 123.39 50.19 Favored 'General case' 0 C--O 1.237 0.441 0 N-CA-C 105.338 -2.097 . . . . 39.75 105.338 179.023 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' THR . . . . . 0.506 ' OG1' ' F3 ' ' B' ' 79' ' ' TFA . 27.2 p -83.45 165.05 19.5 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 117.908 -1.517 . . . . 29.34 108.817 -178.074 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -59.26 -25.28 63.94 Favored 'General case' 0 C--O 1.252 1.224 0 O-C-N 124.13 0.894 . . . . 33.909999999999997 111.826 178.22 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 33.5 mt -93.75 8.42 41.11 Favored 'General case' 0 C--O 1.246 0.888 0 C-N-CA 119.147 -1.021 . . . . 29.460000000000001 112.942 177.537 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 92.34 7.35 63.73 Favored Glycine 0 N--CA 1.514 3.855 0 N-CA-C 118.779 2.272 . . . . 32.479999999999997 118.779 174.024 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 36.1 ttmt -82.48 147.48 28.68 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 105.376 -2.083 . . . . 35.600000000000001 105.376 -176.638 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -107.33 131.03 54.68 Favored 'General case' 0 N--CA 1.483 1.204 0 N-CA-C 106.221 -1.77 . . . . 48.439999999999998 106.221 175.949 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' ILE . . . . . . . . . . . . . 17.3 mt -120.21 130.34 74.46 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 CA-C-O 118.253 -0.879 . . . . 30.91 110.448 -178.349 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 61.6 m -83.66 139.27 32.9 Favored 'General case' 0 N--CA 1.493 1.69 0 N-CA-C 108.163 -1.051 . . . . 35.310000000000002 108.163 178.496 -73.771 -81.143 -81.649 103.475 2.183 100.223 -83.856 -67.259 1 1 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . -145.99 152.59 39.64 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 120.1 -0.64 . . . . 26.16 110.364 177.431 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 62.9 t0 -86.13 116.17 64.75 Favored Pre-proline 0 N--CA 1.498 1.944 0 CA-C-N 114.434 -1.257 . . . . 34.310000000000002 108.771 -171.727 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -69.25 -10.83 30.02 Favored 'Trans proline' 0 CA--C 1.54 0.81 0 C-N-CA 113.867 -3.622 . . . . 29.449999999999999 116.476 -178.561 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 37.0 mttt -70.38 -23.32 62.76 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 113.815 1.043 . . . . 44.280000000000001 113.815 173.383 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -73.8 139.41 45.13 Favored 'General case' 0 N--CA 1.473 0.721 0 O-C-N 123.776 0.673 . . . . 47.670000000000002 111.607 -172.999 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 40.3 tttt -58.28 -45.29 88.17 Favored 'General case' 0 CA--C 1.548 0.876 0 O-C-N 121.89 -0.506 . . . . 38.359999999999999 112.168 -176.551 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' TRP . . . . . . . . . . . . . 61.2 p-90 -65.01 -36.57 84.83 Favored 'General case' 0 CA--C 1.495 -1.157 0 O-C-N 121.552 -0.718 . . . . 33.939999999999998 110.744 -174.585 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 67.2 t -60.61 -50.18 81.45 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 O-C-N 124.512 1.132 . . . . 27.449999999999999 108.98 -179.875 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' GLN . . . . . . . . . . . . . 21.3 mt-30 -61.33 -39.96 92.47 Favored 'General case' 0 CA--C 1.554 1.124 0 C-N-CA 120.1 -0.64 . . . . 39.670000000000002 111.629 178.719 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' ASN . . . . . . . . . . . . . 79.3 m-20 -60.32 -45.73 92.39 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 109.909 -0.404 . . . . 37.57 109.909 177.683 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' TYR . . . . . . . . . . . . . 4.9 m-30 -62.36 -40.14 95.45 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 120.533 -0.467 . . . . 30.23 111.046 179.384 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' MET . . . . . . . . . . . . . 89.2 mtp -62.72 -34.64 77.6 Favored 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 109.398 -0.593 . . . . 34.43 109.398 -178.797 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 22.9 mttm -65.85 -45.63 81.46 Favored 'General case' 0 C--O 1.257 1.479 0 CA-C-N 115.634 -0.712 . . . . 42.299999999999997 109.289 -178.053 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' HIS . . . . . . . . . . . . . 19.6 m80 -66.01 -46.34 78.31 Favored 'General case' 0 CA--C 1.519 -0.237 0 O-C-N 124.356 1.035 . . . . 34.960000000000001 111.429 -179.202 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 29.2 mt -68.17 -32.31 72.47 Favored 'General case' 0 C--O 1.219 -0.53 0 C-N-CA 119.31 -0.956 . . . . 36.060000000000002 111.95 -179.514 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.944 0 N-CA-C 110.045 -1.222 . . . . 45.119999999999997 110.045 -175.974 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' SO4 . . . . . 0.91 ' O3 ' ' O ' ' A' ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' TFA . . . . . 0.506 ' F3 ' ' OG1' ' B' ' 44' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 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 . . . . . 0.823 ' O ' ' OD1' ' A' ' 61' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' HOH . . . . . 0.91 ' O ' ' O3 ' ' A' ' 78' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 ' B' B ' 80' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 99' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 100' ' ' HOH . . . . . 0.85 ' O ' ' NH1' ' B' ' 34' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 89.2 m-20 . . . . . 0 N--CA 1.508 2.436 0 CA-C-O 120.629 0.252 . . . . 40.049999999999997 111.325 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -157.75 163.12 38.42 Favored 'General case' 0 CA--C 1.496 -1.109 0 N-CA-C 108.086 -1.079 . . . . 31.210000000000001 108.086 -173.37 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' LEU . . . . . 0.467 HD13 ' HB3' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -81.46 146.09 30.42 Favored 'General case' 0 C--O 1.262 1.714 0 N-CA-C 107.212 -1.403 . . . . 33.009999999999998 107.212 170.53 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -119.49 150.61 39.95 Favored 'General case' 0 C--O 1.242 0.68 0 N-CA-C 107.316 -1.365 . . . . 38.369999999999997 107.316 173.403 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 19.5 m -122.27 162.28 38.55 Favored Pre-proline 0 C--O 1.253 1.263 0 O-C-N 124.598 1.186 . . . . 29.460000000000001 111.505 -173.393 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_exo -70.34 164.52 34.81 Favored 'Trans proline' 0 C--O 1.275 2.347 0 N-CA-C 116.274 1.606 . . . . 27.449999999999999 116.274 -174.37 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 66.4 m -108.35 162.11 14.4 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 124.561 1.145 . . . . 27.600000000000001 108.646 176.141 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 99.8 m -111.51 124.9 53.23 Favored 'General case' 0 N--CA 1.435 -1.193 0 N-CA-C 106.197 -1.779 . . . . 30.690000000000001 106.197 -177.158 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 82.0 m -130.4 152.55 49.68 Favored 'General case' 0 N--CA 1.483 1.18 0 CA-C-O 118.452 -0.785 . . . . 34.689999999999998 110.512 179.301 -70.793 -55.786 -89.262 107.04 2.103 107.764 -66.135 -67.646 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 92.9 m -106.24 129.5 54.27 Favored 'General case' 0 N--CA 1.481 1.091 0 O-C-N 124.24 0.962 . . . . 34.359999999999999 109.996 173.424 -70.037 -83.269 -80.989 100.939 2.175 103.361 -75.377 -73.893 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -114.02 -5.95 13.13 Favored 'General case' 0 C--O 1.22 -0.478 0 CA-C-N 119.392 0.996 . . . . 35.770000000000003 112.447 175.372 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 54.9 p -139.7 151.0 45.53 Favored 'General case' 0 CA--C 1.537 0.442 0 N-CA-C 106.58 -1.637 . . . . 35.590000000000003 106.58 172.375 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 27.5 m-85 -109.56 142.68 40.31 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 114.937 -1.029 . . . . 35.640000000000001 110.316 -177.319 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 68.2 m -60.32 133.08 55.75 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 115.227 -0.897 . . . . 32.840000000000003 112.652 177.169 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.4 p -90.7 -15.01 31.08 Favored 'General case' 0 N--CA 1.476 0.842 0 O-C-N 124.441 1.088 . . . . 41.280000000000001 113.547 175.12 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 63.8 tttt -92.54 133.07 36.3 Favored 'General case' 0 CA--C 1.503 -0.847 0 N-CA-C 107.427 -1.323 . . . . 48.600000000000001 107.427 176.506 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 53.8 tttm -88.05 100.68 13.11 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 107.298 -1.371 . . . . 46.25 107.298 170.002 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 18.2 tt -65.84 154.24 7.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 C-N-CA 124.176 0.991 . . . . 36.869999999999997 111.102 178.274 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' SER . . . . . 0.837 ' OG ' ' HG3' ' A' ' 23' ' ' GLN . 28.1 t -61.77 134.38 56.66 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 108.497 -0.927 . . . . 38.259999999999998 108.497 176.821 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 51.9 tp -64.02 -30.86 71.9 Favored 'General case' 0 CA--C 1.515 -0.368 0 C-N-CA 120.004 -0.679 . . . . 31.309999999999999 110.985 178.12 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' GLN . . . . . 0.837 ' HG3' ' OG ' ' A' ' 21' ' ' SER . 18.0 tm0? -60.54 -21.38 62.46 Favored 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 114.772 1.397 . . . . 34.780000000000001 114.772 178.336 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 73.0 mtp180 -78.69 -10.33 59.72 Favored 'General case' 0 CA--C 1.492 -1.255 0 O-C-N 120.781 -1.199 . . . . 38.689999999999998 113.549 176.666 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 53.7 mt -96.71 143.77 27.34 Favored 'General case' 0 C--O 1.25 1.093 0 N-CA-C 115.154 1.539 . . . . 29.27 115.154 -169.621 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' LYS . . . . . 0.446 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 40.2 tttp -104.9 -39.08 6.4 Favored 'General case' 0 C--O 1.24 0.593 0 C-N-CA 124.389 1.075 . . . . 40.759999999999998 110.753 -178.782 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 89.0 p -170.67 174.65 4.91 Favored 'General case' 0 C--O 1.249 1.072 0 N-CA-C 108.308 -0.997 . . . . 32.960000000000001 108.308 -170.679 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 20.0 p90 -143.77 159.39 42.59 Favored 'General case' 0 N--CA 1.453 -0.29 0 O-C-N 124.73 1.269 . . . . 32.689999999999998 109.308 172.863 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 33.6 m -135.37 155.71 37.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 O-C-N 125.395 1.684 . . . . 33.469999999999999 109.408 170.227 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 45.5 mm -95.86 140.27 17.42 Favored 'Isoleucine or valine' 0 C--O 1.252 1.196 0 N-CA-C 105.496 -2.039 . . . . 34.350000000000001 105.496 169.127 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 18.6 p -59.68 154.14 18.58 Favored 'General case' 0 C--O 1.28 2.68 0 C-N-CA 119.991 -0.684 . . . . 29.539999999999999 112.801 -178.327 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 6.9 t -47.1 146.29 1.84 Allowed 'General case' 0 C--O 1.259 1.587 0 CA-C-O 123.148 1.452 . . . . 30.73 113.275 173.516 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 81.7 p -63.8 -14.34 52.04 Favored 'General case' 0 CA--C 1.546 0.801 0 N-CA-C 114.76 1.393 . . . . 34.909999999999997 114.76 179.331 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 88.8 mtt-85 -70.4 -21.44 62.85 Favored 'General case' 0 C--O 1.252 1.192 0 N-CA-C 114.388 1.255 . . . . 39.060000000000002 114.388 177.546 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 85.1 m -68.46 146.03 97.57 Favored Pre-proline 0 C--O 1.24 0.583 0 N-CA-C 108.202 -1.036 . . . . 33.640000000000001 108.202 -175.477 -67.646 -66.135 -89.262 107.764 2.103 107.04 -55.786 -70.793 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_exo -58.73 -34.29 98.87 Favored 'Trans proline' 0 CA--C 1.536 0.614 0 O-C-N 123.624 1.328 . . . . 34.07 114.031 177.7 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -130.54 139.96 50.47 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 108.838 -0.801 . . . . 52.030000000000001 108.838 -179.957 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -67.95 137.88 55.51 Favored 'General case' 0 CA--C 1.549 0.922 0 O-C-N 123.576 0.547 . . . . 51.100000000000001 110.381 175.322 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -149.09 156.95 42.98 Favored 'General case' 0 CA--C 1.48 -1.721 0 C-N-CA 119.757 -0.777 . . . . 29.050000000000001 109.128 178.795 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 93.7 t -97.77 137.21 26.0 Favored 'Isoleucine or valine' 0 C--O 1.248 1.002 0 O-C-N 125.678 1.861 . . . . 30.449999999999999 106.753 171.429 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 96.6 mt -115.27 116.55 52.85 Favored 'Isoleucine or valine' 0 C--O 1.255 1.385 0 N-CA-C 106.351 -1.722 . . . . 30.219999999999999 106.351 168.625 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 46.4 m-85 -83.03 140.92 32.42 Favored 'General case' 0 N--CA 1.432 -1.36 0 CA-C-N 115.987 -0.551 . . . . 29.719999999999999 110.083 171.685 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 9.4 ttt85 -109.4 126.15 53.14 Favored 'General case' 0 C--O 1.255 1.378 0 N-CA-C 107.17 -1.419 . . . . 53.530000000000001 107.17 173.138 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 20.9 p -84.46 163.21 19.59 Favored 'General case' 0 C--O 1.244 0.787 0 C-N-CA 118.617 -1.233 . . . . 28.600000000000001 108.254 -178.693 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 93.8 mttt -60.14 -23.24 63.75 Favored 'General case' 0 C--O 1.253 1.239 0 C-N-CA 122.817 0.447 . . . . 31.030000000000001 110.692 178.611 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 53.5 mt -93.2 0.77 57.22 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 117.9 -1.52 . . . . 28.780000000000001 112.507 177.948 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 103.2 2.05 48.07 Favored Glycine 0 N--CA 1.482 1.701 0 CA-C-O 118.718 -1.045 . . . . 33.770000000000003 114.657 171.505 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 35.7 ttmt -77.26 148.79 35.57 Favored 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 104.752 -2.314 . . . . 39.710000000000001 104.752 -175.365 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 88.9 mt-10 -108.18 130.87 55.11 Favored 'General case' 0 C--O 1.25 1.093 0 N-CA-C 107.343 -1.355 . . . . 48.579999999999998 107.343 172.682 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 96.8 mt -122.7 128.54 75.32 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 O-C-N 125.125 1.516 . . . . 37.810000000000002 108.929 -177.189 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 61.0 m -80.69 139.06 36.36 Favored 'General case' 0 C--O 1.265 1.888 0 O-C-N 124.734 1.271 . . . . 36.280000000000001 109.821 176.761 -73.893 -75.377 -80.989 103.361 2.175 100.939 -83.269 -70.037 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -148.12 152.77 37.88 Favored 'General case' 0 CA--C 1.495 -1.163 0 C-N-CA 120.044 -0.662 . . . . 26.649999999999999 110.96 179.147 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 67.0 t0 -83.88 118.6 71.79 Favored Pre-proline 0 C--O 1.183 -2.431 0 O-C-N 124.397 1.061 . . . . 29.829999999999998 108.205 -172.05 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -58.28 -21.97 55.14 Favored 'Trans proline' 0 C--O 1.268 2.017 0 C-N-CA 122.039 1.826 . . . . 30.41 114.401 179.26 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 51.1 mttp -79.8 -19.93 47.38 Favored 'General case' 0 C--O 1.211 -0.965 0 N-CA-C 113.338 0.866 . . . . 28.399999999999999 113.338 -178.739 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -72.76 139.12 46.91 Favored 'General case' 0 N--CA 1.505 2.278 0 O-C-N 121.325 -0.859 . . . . 42.890000000000001 113.031 -175.991 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 76.8 tttt -56.56 -46.51 80.67 Favored 'General case' 0 CA--C 1.551 0.986 0 O-C-N 121.483 -0.76 . . . . 43.439999999999998 109.557 -177.912 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 46.8 p-90 -61.93 -36.72 82.21 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 118.474 -1.29 . . . . 31.190000000000001 113.295 -175.658 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 75.0 t -66.53 -46.26 86.78 Favored 'Isoleucine or valine' 0 C--O 1.241 0.634 0 N-CA-C 106.826 -1.546 . . . . 24.690000000000001 106.826 -177.688 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 -60.37 -41.14 93.11 Favored 'General case' 0 C--O 1.243 0.714 0 N-CA-C 113.626 0.973 . . . . 30.030000000000001 113.626 176.998 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ASN . . . . . 0.823 ' OD1' ' O ' ' A' ' 111' ' ' HOH . 86.1 m-20 -65.24 -39.62 92.95 Favored 'General case' 0 C--O 1.242 0.678 0 N-CA-C 108.186 -1.042 . . . . 36.799999999999997 108.186 179.528 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 7.6 m-30 -68.08 -38.13 82.01 Favored 'General case' 0 CA--C 1.507 -0.694 0 C-N-CA 118.968 -1.093 . . . . 30.600000000000001 110.357 -178.647 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 73.9 mtp -62.57 -38.88 91.82 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 108.991 -0.744 . . . . 29.420000000000002 108.991 -179.88 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 23.7 tptm -63.1 -39.27 94.21 Favored 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 109.814 -0.439 . . . . 39.299999999999997 109.814 177.548 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 36.7 m80 -71.94 -39.32 69.5 Favored 'General case' 0 CA--C 1.499 -1.011 0 C-N-CA 118.333 -1.347 . . . . 34.479999999999997 112.194 -179.323 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 86.6 mt -74.57 -36.18 63.05 Favored 'General case' 0 N--CA 1.437 -1.086 0 N-CA-C 113.796 1.036 . . . . 38.390000000000001 113.796 -175.232 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.26 1.752 0 CA-C-O 122.891 1.273 . . . . 44.240000000000002 115.23 179.64 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 80.1 m-20 . . . . . 0 N--CA 1.514 2.733 0 CA-C-O 120.68 0.276 . . . . 42.149999999999999 111.075 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -151.46 157.31 42.17 Favored 'General case' 0 CA--C 1.499 -1.015 0 N-CA-C 106.858 -1.534 . . . . 27.609999999999999 106.858 -166.934 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 76.4 mt -80.63 148.95 30.03 Favored 'General case' 0 N--CA 1.439 -1.014 0 CA-C-N 114.403 -1.272 . . . . 27.699999999999999 108.269 170.403 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 6' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -122.37 149.25 44.05 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 106.421 -1.696 . . . . 41.289999999999999 106.421 175.458 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 12.9 m -119.77 159.45 46.45 Favored Pre-proline 0 C--O 1.284 2.906 0 O-C-N 123.802 0.689 . . . . 27.199999999999999 111.104 -174.012 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -67.37 165.8 25.75 Favored 'Trans proline' 0 C--O 1.27 2.086 0 N-CA-C 115.909 1.465 . . . . 28.420000000000002 115.909 -175.344 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 61.2 m -111.05 158.79 18.41 Favored 'General case' 0 C--O 1.253 1.262 0 N-CA-C 105.715 -1.957 . . . . 31.66 105.715 179.178 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 51.6 m -111.89 125.27 53.86 Favored 'General case' 0 N--CA 1.443 -0.776 0 CA-C-N 115.011 -0.995 . . . . 33.829999999999998 109.944 -179.637 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 11' ' ' CYS . . . . . . . . . . . . . 76.8 m -135.42 160.28 38.94 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 118.432 -1.307 . . . . 32.539999999999999 107.667 -176.333 -61.013 -60.353 -86.139 101.314 2.09 103.947 -65.722 -67.415 1 1 . 1 . 001 ecloud build full ' B' B ' 12' ' ' CYS . . . . . . . . . . . . . 85.8 m -113.69 127.76 56.16 Favored 'General case' 0 CA--C 1.495 -1.16 0 CA-C-N 114.643 -1.162 . . . . 32.25 112.013 176.304 -67.259 -83.856 -81.649 100.223 2.183 103.475 -81.143 -73.771 1 1 . 1 . 001 ecloud build full ' B' B ' 13' ' ' PHE . . . . . . . . . . . . . 73.2 m-85 -106.44 -15.23 14.86 Favored 'General case' 0 C--O 1.222 -0.391 0 N-CA-C 113.448 0.907 . . . . 32.450000000000003 113.448 179.952 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 67.8 p -139.53 152.68 47.12 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 106.158 -1.793 . . . . 32.270000000000003 106.158 176.406 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 37.0 m-85 -111.66 142.76 43.57 Favored 'General case' 0 C--O 1.244 0.773 0 N-CA-C 107.911 -1.144 . . . . 35.539999999999999 107.911 -174.12 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 74.0 m -61.16 134.52 57.11 Favored 'General case' 0 C--O 1.243 0.742 0 N-CA-C 112.304 0.483 . . . . 31.620000000000001 112.304 178.806 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -87.19 -25.57 23.98 Favored 'General case' 0 C--N 1.347 0.473 0 N-CA-C 114.273 1.212 . . . . 38.07 114.273 173.161 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 18' ' ' LYS . . . . . 0.467 ' HB3' HD13 ' A' ' 5' ' ' LEU . 80.8 tttt -82.58 125.75 31.51 Favored 'General case' 0 CA--C 1.51 -0.562 0 N-CA-C 109.697 -0.483 . . . . 43.740000000000002 109.697 176.635 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 19.4 tttt -75.87 103.37 5.92 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 120.577 -0.449 . . . . 46.289999999999999 110.228 166.104 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 20' ' ' ILE . . . . . . . . . . . . . 14.8 tt -66.26 149.32 11.59 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.41 0 C-N-CA 123.283 0.633 . . . . 37.850000000000001 109.967 179.418 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' SER . . . . . 0.884 ' OG ' ' HG3' ' B' ' 23' ' ' GLN . 27.1 t -55.04 130.24 41.04 Favored 'General case' 0 N--CA 1.445 -0.698 0 N-CA-C 113.209 0.818 . . . . 36.850000000000001 113.209 170.381 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 22' ' ' LEU . . . . . . . . . . . . . 52.3 tp -59.53 -33.06 70.91 Favored 'General case' 0 C--O 1.247 0.947 0 O-C-N 120.866 -1.147 . . . . 30.489999999999998 113.656 176.785 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 23' ' ' GLN . . . . . 0.884 ' HG3' ' OG ' ' B' ' 21' ' ' SER . 21.0 tm0? -60.93 -23.07 64.99 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.448 0.536 . . . . 34.770000000000003 112.448 -179.764 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 75.4 mtp180 -75.85 -15.19 60.26 Favored 'General case' 0 C--O 1.241 0.637 0 N-CA-C 113.893 1.072 . . . . 38.350000000000001 113.893 178.396 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 68.1 mt -94.18 147.94 22.68 Favored 'General case' 0 CA--C 1.513 -0.47 0 N-CA-C 115.121 1.526 . . . . 27.460000000000001 115.121 -168.653 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 31.9 tttt -111.49 -46.23 3.3 Favored 'General case' 0 C--O 1.243 0.757 0 CA-C-N 114.338 -1.301 . . . . 45.649999999999999 108.609 -177.109 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 77.3 p -160.27 173.12 16.18 Favored 'General case' 0 C--O 1.252 1.22 0 C-N-CA 119.643 -0.823 . . . . 31.050000000000001 108.9 -171.741 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' TYR . . . . . 0.476 ' CE1' ' HE3' ' B' ' 63' ' ' MET . 14.3 p90 -142.73 158.71 43.37 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.859 -1.064 . . . . 30.789999999999999 112.907 166.039 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 29' ' ' VAL . . . . . 0.635 ' HB ' ' O ' ' B' ' 90' ' ' HOH . 32.9 m -134.11 155.91 40.11 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.735 0 CA-C-N 114.965 -1.016 . . . . 28.91 109.357 170.384 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 50.6 mm -93.28 141.45 14.71 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.758 0 N-CA-C 106.628 -1.619 . . . . 27.010000000000002 106.628 168.657 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 31' ' ' THR . . . . . . . . . . . . . 33.7 p -62.03 151.83 34.2 Favored 'General case' 0 C--N 1.311 -1.08 0 C-N-CA 118.991 -1.084 . . . . 27.280000000000001 113.805 -179.421 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 6.6 t -51.71 142.85 13.9 Favored 'General case' 0 C--O 1.249 1.073 0 N-CA-C 115.196 1.554 . . . . 36.600000000000001 115.196 173.809 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 5.1 p -62.41 -10.42 11.43 Favored 'General case' 0 N--CA 1.443 -0.805 0 C-N-CA 118.876 -1.13 . . . . 34.350000000000001 113.122 179.018 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 34' ' ' ARG . . . . . 0.424 ' NH1' ' O ' ' B' ' 100' ' ' HOH . 93.7 mtt180 -68.02 -24.24 65.08 Favored 'General case' 0 C--O 1.252 1.186 0 C-N-CA 119.305 -0.958 . . . . 59.490000000000002 111.887 176.576 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 84.6 m -67.43 145.09 98.32 Favored Pre-proline 0 CA--C 1.498 -1.02 0 CA-C-O 117.843 -1.075 . . . . 30.329999999999998 109.773 -178.576 -67.415 -65.722 -86.139 103.947 2.09 101.314 -60.353 -61.013 1 1 . 1 . 001 ecloud build full ' B' B ' 36' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -70.2 -8.67 24.16 Favored 'Trans proline' 0 N--CA 1.492 1.43 0 N-CA-C 119.162 2.716 . . . . 30.329999999999998 119.162 177.825 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 37' ' ' GLN . . . . . 0.484 ' HG2' ' O ' ' B' ' 91' ' ' HOH . 11.5 pt20 -145.73 151.39 37.91 Favored 'General case' 0 C--O 1.253 1.239 0 O-C-N 121.102 -0.999 . . . . 37.939999999999998 111.077 171.641 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -81.52 135.67 35.6 Favored 'General case' 0 C--O 1.264 1.829 0 C-N-CA 119.605 -0.838 . . . . 33.770000000000003 110.093 -176.312 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -145.54 157.86 43.93 Favored 'General case' 0 CA--C 1.507 -0.673 0 C-N-CA 119.344 -0.942 . . . . 26.710000000000001 110.96 178.821 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 40' ' ' VAL . . . . . . . . . . . . . 71.3 t -99.97 137.07 28.63 Favored 'Isoleucine or valine' 0 C--O 1.253 1.246 0 CA-C-N 114.112 -1.404 . . . . 27.940000000000001 108.02 168.47 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 41' ' ' ILE . . . . . . . . . . . . . 66.2 mt -114.24 120.05 62.94 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.412 0 N-CA-C 104.681 -2.341 . . . . 27.140000000000001 104.681 170.443 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 42' ' ' PHE . . . . . . . . . . . . . 58.9 m-85 -89.57 142.89 27.26 Favored 'General case' 0 C--O 1.248 1.014 0 N-CA-C 108.516 -0.92 . . . . 29.890000000000001 108.516 171.009 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 43' ' ' ARG . . . . . . . . . . . . . 1.8 ttt180 -112.35 123.39 50.19 Favored 'General case' 0 C--O 1.237 0.441 0 N-CA-C 105.338 -2.097 . . . . 39.75 105.338 179.023 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 44' ' ' THR . . . . . 0.832 HG21 ' F2 ' ' B' ' 79' ' ' TFA . 27.2 p -83.45 165.05 19.5 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 117.908 -1.517 . . . . 29.34 108.817 -178.074 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 45' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -59.26 -25.28 63.94 Favored 'General case' 0 C--O 1.252 1.224 0 O-C-N 124.13 0.894 . . . . 33.909999999999997 111.826 178.22 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 33.5 mt -93.75 8.42 41.11 Favored 'General case' 0 C--O 1.246 0.888 0 C-N-CA 119.147 -1.021 . . . . 29.460000000000001 112.942 177.537 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 92.34 7.35 63.73 Favored Glycine 0 N--CA 1.514 3.855 0 N-CA-C 118.779 2.272 . . . . 32.479999999999997 118.779 174.024 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 36.1 ttmt -82.48 147.48 28.68 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 105.376 -2.083 . . . . 35.600000000000001 105.376 -176.638 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -107.33 131.03 54.68 Favored 'General case' 0 N--CA 1.483 1.204 0 N-CA-C 106.221 -1.77 . . . . 48.439999999999998 106.221 175.949 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 50' ' ' ILE . . . . . . . . . . . . . 17.3 mt -120.21 130.34 74.46 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 CA-C-O 118.253 -0.879 . . . . 32.079999999999998 110.448 -178.349 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 61.6 m -83.66 139.27 32.9 Favored 'General case' 0 N--CA 1.493 1.69 0 N-CA-C 108.163 -1.051 . . . . 35.310000000000002 108.163 178.496 -73.771 -81.143 -81.649 103.475 2.183 100.223 -83.856 -67.259 1 1 . 1 . 001 ecloud build full ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . -145.99 152.59 39.64 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 120.1 -0.64 . . . . 26.16 110.364 177.431 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 62.9 t0 -86.13 116.17 64.75 Favored Pre-proline 0 N--CA 1.498 1.944 0 CA-C-N 114.434 -1.257 . . . . 34.310000000000002 108.771 -171.727 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 54' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -69.25 -10.83 30.02 Favored 'Trans proline' 0 CA--C 1.54 0.81 0 C-N-CA 113.867 -3.622 . . . . 29.449999999999999 116.476 -178.561 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 37.0 mttt -70.38 -23.32 62.76 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 113.815 1.043 . . . . 44.280000000000001 113.815 173.383 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -73.8 139.41 45.13 Favored 'General case' 0 N--CA 1.473 0.721 0 O-C-N 123.776 0.673 . . . . 47.670000000000002 111.607 -172.999 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 40.3 tttt -58.28 -45.29 88.17 Favored 'General case' 0 CA--C 1.548 0.876 0 O-C-N 121.89 -0.506 . . . . 38.359999999999999 112.168 -176.551 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 58' ' ' TRP . . . . . . . . . . . . . 61.2 p-90 -65.01 -36.57 84.83 Favored 'General case' 0 CA--C 1.495 -1.157 0 O-C-N 121.552 -0.718 . . . . 33.939999999999998 110.744 -174.585 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 67.2 t -60.61 -50.18 81.45 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 O-C-N 124.512 1.132 . . . . 27.449999999999999 108.98 -179.875 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 60' ' ' GLN . . . . . . . . . . . . . 82.4 mt-30 -61.33 -39.96 92.47 Favored 'General case' 0 CA--C 1.554 1.124 0 C-N-CA 120.1 -0.64 . . . . 39.670000000000002 111.629 178.719 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 61' ' ' ASN . . . . . . . . . . . . . 79.3 m-20 -60.32 -45.73 92.39 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 109.909 -0.404 . . . . 37.57 109.909 177.683 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 62' ' ' TYR . . . . . . . . . . . . . 4.9 m-30 -62.36 -40.14 95.45 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 120.533 -0.467 . . . . 30.23 111.046 179.384 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 63' ' ' MET . . . . . 0.476 ' HE3' ' CE1' ' B' ' 28' ' ' TYR . 89.2 mtp -62.72 -34.64 77.6 Favored 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 109.398 -0.593 . . . . 34.43 109.398 -178.797 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 22.9 mttm -65.85 -45.63 81.46 Favored 'General case' 0 C--O 1.257 1.479 0 CA-C-N 115.634 -0.712 . . . . 42.299999999999997 109.289 -178.053 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 65' ' ' HIS . . . . . . . . . . . . . 19.6 m80 -66.01 -46.34 78.31 Favored 'General case' 0 CA--C 1.519 -0.237 0 O-C-N 124.356 1.035 . . . . 34.960000000000001 111.429 -179.202 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 29.2 mt -68.17 -32.31 72.47 Favored 'General case' 0 C--O 1.219 -0.53 0 C-N-CA 119.31 -0.956 . . . . 36.060000000000002 111.95 -179.514 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 67' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.944 0 N-CA-C 110.045 -1.222 . . . . 45.119999999999997 110.045 -175.974 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 76' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 77' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 78' ' ' SO4 . . . . . 0.91 ' O3 ' ' O ' ' A' ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 76' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 77' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 78' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 79' ' ' TFA . . . . . 0.832 ' F2 ' HG21 ' B' ' 44' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 80' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 81' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 82' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 83' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 84' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 85' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 86' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 87' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 88' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 89' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 90' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 91' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 92' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 93' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 94' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 95' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 96' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 97' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 98' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 99' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 100' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 111' ' ' HOH . . . . . 0.823 ' O ' ' OD1' ' A' ' 61' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 . . . . . 0.91 ' O ' ' O3 ' ' A' ' 78' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 ' B' B ' 80' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 81' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 82' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 83' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 84' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 85' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 86' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 87' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 88' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 89' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 90' ' ' HOH . . . . . 0.635 ' O ' ' HB ' ' B' ' 29' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 91' ' ' HOH . . . . . 0.484 ' O ' ' HG2' ' B' ' 37' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 92' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 93' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 94' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 95' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 96' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 97' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 98' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 99' ' ' HOH . . . . . 0.681 ' O ' ' NE2' ' B' ' 23' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 100' ' ' HOH . . . . . 0.424 ' O ' ' NH1' ' B' ' 34' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 89.2 m-20 . . . . . 0 N--CA 1.508 2.436 0 CA-C-O 120.629 0.252 . . . . 40.049999999999997 111.325 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -157.75 163.12 38.42 Favored 'General case' 0 CA--C 1.496 -1.109 0 N-CA-C 108.086 -1.079 . . . . 31.210000000000001 108.086 -173.37 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.467 HD13 ' HB3' ' B' ' 18' ' ' LYS . 0.0 OUTLIER -81.46 146.09 30.42 Favored 'General case' 0 C--O 1.262 1.714 0 N-CA-C 107.212 -1.403 . . . . 33.009999999999998 107.212 170.53 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -119.49 150.61 39.95 Favored 'General case' 0 C--O 1.242 0.68 0 N-CA-C 107.316 -1.365 . . . . 38.369999999999997 107.316 173.403 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 19.5 m -122.27 162.28 38.55 Favored Pre-proline 0 C--O 1.253 1.263 0 O-C-N 124.598 1.186 . . . . 29.460000000000001 111.505 -173.393 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_exo -70.34 164.52 34.81 Favored 'Trans proline' 0 C--O 1.275 2.347 0 N-CA-C 116.274 1.606 . . . . 27.449999999999999 116.274 -174.37 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 66.4 m -108.35 162.11 14.4 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 124.561 1.145 . . . . 27.600000000000001 108.646 176.141 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 99.8 m -111.51 124.9 53.23 Favored 'General case' 0 N--CA 1.435 -1.193 0 N-CA-C 106.197 -1.779 . . . . 30.690000000000001 106.197 -177.158 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 82.0 m -130.4 152.55 49.68 Favored 'General case' 0 N--CA 1.483 1.18 0 CA-C-O 118.452 -0.785 . . . . 34.689999999999998 110.512 179.301 -70.793 -55.786 -89.262 107.04 2.103 107.764 -66.135 -67.646 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 92.9 m -106.24 129.5 54.27 Favored 'General case' 0 N--CA 1.481 1.091 0 O-C-N 124.24 0.962 . . . . 34.359999999999999 109.996 173.424 -70.037 -83.269 -80.989 100.939 2.175 103.361 -75.377 -73.893 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -114.02 -5.95 13.13 Favored 'General case' 0 C--O 1.22 -0.478 0 CA-C-N 119.392 0.996 . . . . 35.770000000000003 112.447 175.372 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 54.9 p -139.7 151.0 45.53 Favored 'General case' 0 CA--C 1.537 0.442 0 N-CA-C 106.58 -1.637 . . . . 35.590000000000003 106.58 172.375 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 27.5 m-85 -109.56 142.68 40.31 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 114.937 -1.029 . . . . 35.640000000000001 110.316 -177.319 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 68.2 m -60.32 133.08 55.75 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 115.227 -0.897 . . . . 32.840000000000003 112.652 177.169 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.4 p -90.7 -15.01 31.08 Favored 'General case' 0 N--CA 1.476 0.842 0 O-C-N 124.441 1.088 . . . . 41.280000000000001 113.547 175.12 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 63.8 tttt -92.54 133.07 36.3 Favored 'General case' 0 CA--C 1.503 -0.847 0 N-CA-C 107.427 -1.323 . . . . 48.600000000000001 107.427 176.506 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 53.8 tttm -88.05 100.68 13.11 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 107.298 -1.371 . . . . 46.25 107.298 170.002 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 18.2 tt -65.84 154.24 7.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 C-N-CA 124.176 0.991 . . . . 36.869999999999997 111.102 178.274 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' SER . . . . . 0.837 ' OG ' ' HG3' ' A' ' 23' ' ' GLN . 28.1 t -61.77 134.38 56.66 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 108.497 -0.927 . . . . 38.259999999999998 108.497 176.821 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.546 HD21 ' CD2' ' A' ' 65' ' ' HIS . 51.9 tp -64.02 -30.86 71.9 Favored 'General case' 0 CA--C 1.515 -0.368 0 C-N-CA 120.004 -0.679 . . . . 31.309999999999999 110.985 178.12 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.837 ' HG3' ' OG ' ' A' ' 21' ' ' SER . 18.0 tm0? -60.54 -21.38 62.46 Favored 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 114.772 1.397 . . . . 34.780000000000001 114.772 178.336 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 73.0 mtp180 -78.69 -10.33 59.72 Favored 'General case' 0 CA--C 1.492 -1.255 0 O-C-N 120.781 -1.199 . . . . 38.689999999999998 113.549 176.666 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 53.7 mt -96.71 143.77 27.34 Favored 'General case' 0 C--O 1.25 1.093 0 N-CA-C 115.154 1.539 . . . . 29.27 115.154 -169.621 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.446 ' HB3' ' HE2' ' A' ' 26' ' ' LYS . 40.2 tttp -104.9 -39.08 6.4 Favored 'General case' 0 C--O 1.24 0.593 0 C-N-CA 124.389 1.075 . . . . 40.759999999999998 110.753 -178.782 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 89.0 p -170.67 174.65 4.91 Favored 'General case' 0 C--O 1.249 1.072 0 N-CA-C 108.308 -0.997 . . . . 32.960000000000001 108.308 -170.679 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 20.0 p90 -143.77 159.39 42.59 Favored 'General case' 0 N--CA 1.453 -0.29 0 O-C-N 124.73 1.269 . . . . 32.689999999999998 109.308 172.863 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 33.6 m -135.37 155.71 37.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 O-C-N 125.395 1.684 . . . . 33.469999999999999 109.408 170.227 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 45.5 mm -95.86 140.27 17.42 Favored 'Isoleucine or valine' 0 C--O 1.252 1.196 0 N-CA-C 105.496 -2.039 . . . . 34.350000000000001 105.496 169.127 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 18.6 p -59.68 154.14 18.58 Favored 'General case' 0 C--O 1.28 2.68 0 C-N-CA 119.991 -0.684 . . . . 29.539999999999999 112.801 -178.327 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 6.9 t -47.1 146.29 1.84 Allowed 'General case' 0 C--O 1.259 1.587 0 CA-C-O 123.148 1.452 . . . . 30.73 113.275 173.516 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 81.7 p -63.8 -14.34 52.04 Favored 'General case' 0 CA--C 1.546 0.801 0 N-CA-C 114.76 1.393 . . . . 34.909999999999997 114.76 179.331 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 88.8 mtt-85 -70.4 -21.44 62.85 Favored 'General case' 0 C--O 1.252 1.192 0 N-CA-C 114.388 1.255 . . . . 39.060000000000002 114.388 177.546 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 85.1 m -68.46 146.03 97.57 Favored Pre-proline 0 C--O 1.24 0.583 0 N-CA-C 108.202 -1.036 . . . . 33.640000000000001 108.202 -175.477 -67.646 -66.135 -89.262 107.764 2.103 107.04 -55.786 -70.793 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_exo -58.73 -34.29 98.87 Favored 'Trans proline' 0 CA--C 1.536 0.614 0 O-C-N 123.624 1.328 . . . . 34.07 114.031 177.7 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -130.54 139.96 50.47 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 108.838 -0.801 . . . . 52.030000000000001 108.838 -179.957 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -67.95 137.88 55.51 Favored 'General case' 0 CA--C 1.549 0.922 0 O-C-N 123.576 0.547 . . . . 51.100000000000001 110.381 175.322 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -149.09 156.95 42.98 Favored 'General case' 0 CA--C 1.48 -1.721 0 C-N-CA 119.757 -0.777 . . . . 29.050000000000001 109.128 178.795 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 93.7 t -97.77 137.21 26.0 Favored 'Isoleucine or valine' 0 C--O 1.248 1.002 0 O-C-N 125.678 1.861 . . . . 30.449999999999999 106.753 171.429 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 96.6 mt -115.27 116.55 52.85 Favored 'Isoleucine or valine' 0 C--O 1.255 1.385 0 N-CA-C 106.351 -1.722 . . . . 30.219999999999999 106.351 168.625 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 46.4 m-85 -83.03 140.92 32.42 Favored 'General case' 0 N--CA 1.432 -1.36 0 CA-C-N 115.987 -0.551 . . . . 29.719999999999999 110.083 171.685 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 9.4 ttt85 -109.4 126.15 53.14 Favored 'General case' 0 C--O 1.255 1.378 0 N-CA-C 107.17 -1.419 . . . . 53.530000000000001 107.17 173.138 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 20.9 p -84.46 163.21 19.59 Favored 'General case' 0 C--O 1.244 0.787 0 C-N-CA 118.617 -1.233 . . . . 28.600000000000001 108.254 -178.693 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 93.8 mttt -60.14 -23.24 63.75 Favored 'General case' 0 C--O 1.253 1.239 0 C-N-CA 122.817 0.447 . . . . 31.030000000000001 110.692 178.611 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 53.5 mt -93.2 0.77 57.22 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 117.9 -1.52 . . . . 28.780000000000001 112.507 177.948 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 103.2 2.05 48.07 Favored Glycine 0 N--CA 1.482 1.701 0 CA-C-O 118.718 -1.045 . . . . 33.770000000000003 114.657 171.505 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 35.7 ttmt -77.26 148.79 35.57 Favored 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 104.752 -2.314 . . . . 39.710000000000001 104.752 -175.365 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 88.9 mt-10 -108.18 130.87 55.11 Favored 'General case' 0 C--O 1.25 1.093 0 N-CA-C 107.343 -1.355 . . . . 48.579999999999998 107.343 172.682 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 96.8 mt -122.7 128.54 75.32 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 O-C-N 125.125 1.516 . . . . 37.810000000000002 108.929 -177.189 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 61.0 m -80.69 139.06 36.36 Favored 'General case' 0 C--O 1.265 1.888 0 O-C-N 124.734 1.271 . . . . 36.280000000000001 109.821 176.761 -73.893 -75.377 -80.989 103.361 2.175 100.939 -83.269 -70.037 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -148.12 152.77 37.88 Favored 'General case' 0 CA--C 1.495 -1.163 0 C-N-CA 120.044 -0.662 . . . . 26.649999999999999 110.96 179.147 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 67.0 t0 -83.88 118.6 71.79 Favored Pre-proline 0 C--O 1.183 -2.431 0 O-C-N 124.397 1.061 . . . . 29.829999999999998 108.205 -172.05 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -58.28 -21.97 55.14 Favored 'Trans proline' 0 C--O 1.268 2.017 0 C-N-CA 122.039 1.826 . . . . 30.41 114.401 179.26 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 51.1 mttp -79.8 -19.93 47.38 Favored 'General case' 0 C--O 1.211 -0.965 0 N-CA-C 113.338 0.866 . . . . 28.399999999999999 113.338 -178.739 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -72.76 139.12 46.91 Favored 'General case' 0 N--CA 1.505 2.278 0 O-C-N 121.325 -0.859 . . . . 42.890000000000001 113.031 -175.991 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 76.8 tttt -56.56 -46.51 80.67 Favored 'General case' 0 CA--C 1.551 0.986 0 O-C-N 121.483 -0.76 . . . . 43.439999999999998 109.557 -177.912 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 46.8 p-90 -61.93 -36.72 82.21 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 118.474 -1.29 . . . . 31.190000000000001 113.295 -175.658 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 75.0 t -66.53 -46.26 86.78 Favored 'Isoleucine or valine' 0 C--O 1.241 0.634 0 N-CA-C 106.826 -1.546 . . . . 24.690000000000001 106.826 -177.688 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 -60.37 -41.14 93.11 Favored 'General case' 0 C--O 1.243 0.714 0 N-CA-C 113.626 0.973 . . . . 30.030000000000001 113.626 176.998 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.823 ' OD1' ' O ' ' A' ' 111' ' ' HOH . 86.1 m-20 -65.24 -39.62 92.95 Favored 'General case' 0 C--O 1.242 0.678 0 N-CA-C 108.186 -1.042 . . . . 36.799999999999997 108.186 179.528 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 7.6 m-30 -68.08 -38.13 82.01 Favored 'General case' 0 CA--C 1.507 -0.694 0 C-N-CA 118.968 -1.093 . . . . 30.600000000000001 110.357 -178.647 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' MET . . . . . . . . . . . . . 73.9 mtp -62.57 -38.88 91.82 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 108.991 -0.744 . . . . 29.420000000000002 108.991 -179.88 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 23.7 tptm -63.1 -39.27 94.21 Favored 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 109.814 -0.439 . . . . 39.299999999999997 109.814 177.548 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' HIS . . . . . 0.546 ' CD2' HD21 ' A' ' 22' ' ' LEU . 36.7 m80 -71.94 -39.32 69.5 Favored 'General case' 0 CA--C 1.499 -1.011 0 C-N-CA 118.333 -1.347 . . . . 34.479999999999997 112.194 -179.323 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 86.6 mt -74.57 -36.18 63.05 Favored 'General case' 0 N--CA 1.437 -1.086 0 N-CA-C 113.796 1.036 . . . . 38.390000000000001 113.796 -175.232 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.26 1.752 0 CA-C-O 122.891 1.273 . . . . 44.240000000000002 115.23 179.64 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 80.1 m-20 . . . . . 0 N--CA 1.514 2.733 0 CA-C-O 120.68 0.276 . . . . 42.149999999999999 111.075 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' ALA . . . . . . . . . . . . . . . -151.46 157.31 42.17 Favored 'General case' 0 CA--C 1.499 -1.015 0 N-CA-C 106.858 -1.534 . . . . 27.609999999999999 106.858 -166.934 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 76.4 mt -80.63 148.95 30.03 Favored 'General case' 0 N--CA 1.439 -1.014 0 CA-C-N 114.403 -1.272 . . . . 27.699999999999999 108.269 170.403 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' ASN . . . . . 0.406 HD22 ' N ' ' B' ' 6' ' ' ASN . 0.7 OUTLIER -122.37 149.25 44.05 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 106.421 -1.696 . . . . 41.289999999999999 106.421 175.458 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 12.9 m -119.77 159.45 46.45 Favored Pre-proline 0 C--O 1.284 2.906 0 O-C-N 123.802 0.689 . . . . 27.199999999999999 111.104 -174.012 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -67.37 165.8 25.75 Favored 'Trans proline' 0 C--O 1.27 2.086 0 N-CA-C 115.909 1.465 . . . . 28.420000000000002 115.909 -175.344 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 61.2 m -111.05 158.79 18.41 Favored 'General case' 0 C--O 1.253 1.262 0 N-CA-C 105.715 -1.957 . . . . 31.66 105.715 179.178 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 51.6 m -111.89 125.27 53.86 Favored 'General case' 0 N--CA 1.443 -0.776 0 CA-C-N 115.011 -0.995 . . . . 33.829999999999998 109.944 -179.637 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' CYS . . . . . . . . . . . . . 76.8 m -135.42 160.28 38.94 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 118.432 -1.307 . . . . 32.539999999999999 107.667 -176.333 -61.013 -60.353 -86.139 101.314 2.09 103.947 -65.722 -67.415 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' CYS . . . . . . . . . . . . . 85.8 m -113.69 127.76 56.16 Favored 'General case' 0 CA--C 1.495 -1.16 0 CA-C-N 114.643 -1.162 . . . . 32.25 112.013 176.304 -67.259 -83.856 -81.649 100.223 2.183 103.475 -81.143 -73.771 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' PHE . . . . . . . . . . . . . 73.2 m-85 -106.44 -15.23 14.86 Favored 'General case' 0 C--O 1.222 -0.391 0 N-CA-C 113.448 0.907 . . . . 32.450000000000003 113.448 179.952 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 67.8 p -139.53 152.68 47.12 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 106.158 -1.793 . . . . 32.270000000000003 106.158 176.406 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' PHE . . . . . . . . . . . . . 37.0 m-85 -111.66 142.76 43.57 Favored 'General case' 0 C--O 1.244 0.773 0 N-CA-C 107.911 -1.144 . . . . 35.539999999999999 107.911 -174.12 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 74.0 m -61.16 134.52 57.11 Favored 'General case' 0 C--O 1.243 0.742 0 N-CA-C 112.304 0.483 . . . . 31.620000000000001 112.304 178.806 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -87.19 -25.57 23.98 Favored 'General case' 0 C--N 1.347 0.473 0 N-CA-C 114.273 1.212 . . . . 38.07 114.273 173.161 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' LYS . . . . . 0.467 ' HB3' HD13 ' A' ' 5' ' ' LEU . 80.8 tttt -82.58 125.75 31.51 Favored 'General case' 0 CA--C 1.51 -0.562 0 N-CA-C 109.697 -0.483 . . . . 43.740000000000002 109.697 176.635 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 19.4 tttt -75.87 103.37 5.92 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 120.577 -0.449 . . . . 46.289999999999999 110.228 166.104 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' ILE . . . . . . . . . . . . . 14.8 tt -66.26 149.32 11.59 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.41 0 C-N-CA 123.283 0.633 . . . . 37.850000000000001 109.967 179.418 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' SER . . . . . 0.884 ' OG ' ' HG3' ' B' ' 23' ' ' GLN . 27.1 t -55.04 130.24 41.04 Favored 'General case' 0 N--CA 1.445 -0.698 0 N-CA-C 113.209 0.818 . . . . 36.850000000000001 113.209 170.381 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' LEU . . . . . 0.498 HD21 ' CD2' ' B' ' 65' ' ' HIS . 52.3 tp -59.53 -33.06 70.91 Favored 'General case' 0 C--O 1.247 0.947 0 O-C-N 120.866 -1.147 . . . . 30.489999999999998 113.656 176.785 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' GLN . . . . . 0.884 ' HG3' ' OG ' ' B' ' 21' ' ' SER . 21.0 tm0? -60.93 -23.07 64.99 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.448 0.536 . . . . 34.770000000000003 112.448 -179.764 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 75.4 mtp180 -75.85 -15.19 60.26 Favored 'General case' 0 C--O 1.241 0.637 0 N-CA-C 113.893 1.072 . . . . 38.350000000000001 113.893 178.396 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 68.1 mt -94.18 147.94 22.68 Favored 'General case' 0 CA--C 1.513 -0.47 0 N-CA-C 115.121 1.526 . . . . 27.460000000000001 115.121 -168.653 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 31.9 tttt -111.49 -46.23 3.3 Favored 'General case' 0 C--O 1.243 0.757 0 CA-C-N 114.338 -1.301 . . . . 45.649999999999999 108.609 -177.109 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 77.3 p -160.27 173.12 16.18 Favored 'General case' 0 C--O 1.252 1.22 0 C-N-CA 119.643 -0.823 . . . . 31.050000000000001 108.9 -171.741 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' TYR . . . . . 0.476 ' CE1' ' HE3' ' B' ' 63' ' ' MET . 14.3 p90 -142.73 158.71 43.37 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.859 -1.064 . . . . 30.789999999999999 112.907 166.039 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' VAL . . . . . 0.635 ' HB ' ' O ' ' B' ' 90' ' ' HOH . 32.9 m -134.11 155.91 40.11 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.735 0 CA-C-N 114.965 -1.016 . . . . 28.91 109.357 170.384 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 50.6 mm -93.28 141.45 14.71 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.758 0 N-CA-C 106.628 -1.619 . . . . 27.010000000000002 106.628 168.657 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' THR . . . . . . . . . . . . . 33.7 p -62.03 151.83 34.2 Favored 'General case' 0 C--N 1.311 -1.08 0 C-N-CA 118.991 -1.084 . . . . 27.280000000000001 113.805 -179.421 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 6.6 t -51.71 142.85 13.9 Favored 'General case' 0 C--O 1.249 1.073 0 N-CA-C 115.196 1.554 . . . . 36.600000000000001 115.196 173.809 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 5.1 p -62.41 -10.42 11.43 Favored 'General case' 0 N--CA 1.443 -0.805 0 C-N-CA 118.876 -1.13 . . . . 34.350000000000001 113.122 179.018 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' ARG . . . . . 0.424 ' NH1' ' O ' ' B' ' 100' ' ' HOH . 93.7 mtt180 -68.02 -24.24 65.08 Favored 'General case' 0 C--O 1.252 1.186 0 C-N-CA 119.305 -0.958 . . . . 59.490000000000002 111.887 176.576 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' CYS . . . . . . . . . . . . . 84.6 m -67.43 145.09 98.32 Favored Pre-proline 0 CA--C 1.498 -1.02 0 CA-C-O 117.843 -1.075 . . . . 30.329999999999998 109.773 -178.576 -67.415 -65.722 -86.139 103.947 2.09 101.314 -60.353 -61.013 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -70.2 -8.67 24.16 Favored 'Trans proline' 0 N--CA 1.492 1.43 0 N-CA-C 119.162 2.716 . . . . 30.329999999999998 119.162 177.825 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' GLN . . . . . 0.484 ' HG2' ' O ' ' B' ' 91' ' ' HOH . 11.5 pt20 -145.73 151.39 37.91 Favored 'General case' 0 C--O 1.253 1.239 0 O-C-N 121.102 -0.999 . . . . 37.939999999999998 111.077 171.641 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -81.52 135.67 35.6 Favored 'General case' 0 C--O 1.264 1.829 0 C-N-CA 119.605 -0.838 . . . . 33.770000000000003 110.093 -176.312 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' ALA . . . . . . . . . . . . . . . -145.54 157.86 43.93 Favored 'General case' 0 CA--C 1.507 -0.673 0 C-N-CA 119.344 -0.942 . . . . 26.710000000000001 110.96 178.821 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' VAL . . . . . . . . . . . . . 71.3 t -99.97 137.07 28.63 Favored 'Isoleucine or valine' 0 C--O 1.253 1.246 0 CA-C-N 114.112 -1.404 . . . . 27.940000000000001 108.02 168.47 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' ILE . . . . . . . . . . . . . 66.2 mt -114.24 120.05 62.94 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.412 0 N-CA-C 104.681 -2.341 . . . . 27.140000000000001 104.681 170.443 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' PHE . . . . . . . . . . . . . 58.9 m-85 -89.57 142.89 27.26 Favored 'General case' 0 C--O 1.248 1.014 0 N-CA-C 108.516 -0.92 . . . . 29.890000000000001 108.516 171.009 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' ARG . . . . . . . . . . . . . 1.8 ttt180 -112.35 123.39 50.19 Favored 'General case' 0 C--O 1.237 0.441 0 N-CA-C 105.338 -2.097 . . . . 39.75 105.338 179.023 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' THR . . . . . 0.832 HG21 ' F2 ' ' B' ' 79' ' ' TFA . 27.2 p -83.45 165.05 19.5 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 117.908 -1.517 . . . . 29.34 108.817 -178.074 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -59.26 -25.28 63.94 Favored 'General case' 0 C--O 1.252 1.224 0 O-C-N 124.13 0.894 . . . . 33.909999999999997 111.826 178.22 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 33.5 mt -93.75 8.42 41.11 Favored 'General case' 0 C--O 1.246 0.888 0 C-N-CA 119.147 -1.021 . . . . 29.460000000000001 112.942 177.537 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' GLY . . . . . . . . . . . . . . . 92.34 7.35 63.73 Favored Glycine 0 N--CA 1.514 3.855 0 N-CA-C 118.779 2.272 . . . . 32.479999999999997 118.779 174.024 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 36.1 ttmt -82.48 147.48 28.68 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 105.376 -2.083 . . . . 35.600000000000001 105.376 -176.638 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -107.33 131.03 54.68 Favored 'General case' 0 N--CA 1.483 1.204 0 N-CA-C 106.221 -1.77 . . . . 48.439999999999998 106.221 175.949 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' ILE . . . . . . . . . . . . . 17.3 mt -120.21 130.34 74.46 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 CA-C-O 118.253 -0.879 . . . . 32.079999999999998 110.448 -178.349 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 61.6 m -83.66 139.27 32.9 Favored 'General case' 0 N--CA 1.493 1.69 0 N-CA-C 108.163 -1.051 . . . . 35.310000000000002 108.163 178.496 -73.771 -81.143 -81.649 103.475 2.183 100.223 -83.856 -67.259 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . -145.99 152.59 39.64 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 120.1 -0.64 . . . . 26.16 110.364 177.431 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 62.9 t0 -86.13 116.17 64.75 Favored Pre-proline 0 N--CA 1.498 1.944 0 CA-C-N 114.434 -1.257 . . . . 34.310000000000002 108.771 -171.727 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -69.25 -10.83 30.02 Favored 'Trans proline' 0 CA--C 1.54 0.81 0 C-N-CA 113.867 -3.622 . . . . 29.449999999999999 116.476 -178.561 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 37.0 mttt -70.38 -23.32 62.76 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 113.815 1.043 . . . . 44.280000000000001 113.815 173.383 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -73.8 139.41 45.13 Favored 'General case' 0 N--CA 1.473 0.721 0 O-C-N 123.776 0.673 . . . . 47.670000000000002 111.607 -172.999 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 40.3 tttt -58.28 -45.29 88.17 Favored 'General case' 0 CA--C 1.548 0.876 0 O-C-N 121.89 -0.506 . . . . 38.359999999999999 112.168 -176.551 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' TRP . . . . . . . . . . . . . 61.2 p-90 -65.01 -36.57 84.83 Favored 'General case' 0 CA--C 1.495 -1.157 0 O-C-N 121.552 -0.718 . . . . 33.939999999999998 110.744 -174.585 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 67.2 t -60.61 -50.18 81.45 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 O-C-N 124.512 1.132 . . . . 27.449999999999999 108.98 -179.875 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' GLN . . . . . . . . . . . . . 21.3 mt-30 -61.33 -39.96 92.47 Favored 'General case' 0 CA--C 1.554 1.124 0 C-N-CA 120.1 -0.64 . . . . 39.670000000000002 111.629 178.719 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' ASN . . . . . . . . . . . . . 79.3 m-20 -60.32 -45.73 92.39 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 109.909 -0.404 . . . . 37.57 109.909 177.683 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' TYR . . . . . . . . . . . . . 4.9 m-30 -62.36 -40.14 95.45 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 120.533 -0.467 . . . . 30.23 111.046 179.384 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' MET . . . . . 0.476 ' HE3' ' CE1' ' B' ' 28' ' ' TYR . 89.2 mtp -62.72 -34.64 77.6 Favored 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 109.398 -0.593 . . . . 34.43 109.398 -178.797 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 22.9 mttm -65.85 -45.63 81.46 Favored 'General case' 0 C--O 1.257 1.479 0 CA-C-N 115.634 -0.712 . . . . 42.299999999999997 109.289 -178.053 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' HIS . . . . . 0.498 ' CD2' HD21 ' B' ' 22' ' ' LEU . 19.6 m80 -66.01 -46.34 78.31 Favored 'General case' 0 CA--C 1.519 -0.237 0 O-C-N 124.356 1.035 . . . . 34.960000000000001 111.429 -179.202 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 29.2 mt -68.17 -32.31 72.47 Favored 'General case' 0 C--O 1.219 -0.53 0 C-N-CA 119.31 -0.956 . . . . 36.060000000000002 111.95 -179.514 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.944 0 N-CA-C 110.045 -1.222 . . . . 45.119999999999997 110.045 -175.974 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' SO4 . . . . . 0.91 ' O3 ' ' O ' ' A' ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' TFA . . . . . 0.832 ' F2 ' HG21 ' B' ' 44' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' HOH . . . . . 0.823 ' O ' ' OD1' ' A' ' 61' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 . . . . . 0.91 ' O ' ' O3 ' ' A' ' 78' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 ' B' B ' 80' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' HOH . . . . . 0.635 ' O ' ' HB ' ' B' ' 29' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' HOH . . . . . 0.484 ' O ' ' HG2' ' B' ' 37' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 99' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 100' ' ' HOH . . . . . 0.424 ' O ' ' NH1' ' B' ' 34' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_