data_4gwt_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 4gwt _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 ' 6' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.5 2.029 0 CA-C-O 121.735 0.779 . . . . 67.319999999999993 111.075 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 81.1 mt -79.44 152.75 76.06 Favored Pre-proline 0 CA--C 1.545 0.779 0 CA-C-N 115.213 -0.903 . . . . 50.700000000000003 109.875 177.944 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_exo -63.95 166.97 14.94 Favored 'Trans proline' 0 CA--C 1.541 0.858 0 C-N-CA 117.476 -1.216 . . . . 31.780000000000001 111.454 173.99 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_exo -56.96 139.78 90.58 Favored 'Trans proline' 0 CA--C 1.543 0.974 0 N-CA-C 113.697 0.614 . . . . 28.870000000000001 113.697 -176.142 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 92.27 -22.77 30.62 Favored Glycine 0 CA--C 1.523 0.546 0 N-CA-C 115.78 1.072 . . . . 27.920000000000002 115.78 177.572 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 94.6 m95 -81.36 142.67 32.81 Favored 'General case' 0 CA--C 1.492 -1.283 0 N-CA-C 113.143 0.794 . . . . 32.469999999999999 113.143 -174.547 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -129.49 145.18 51.47 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 107.854 -1.165 . . . . 45.090000000000003 107.854 174.149 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 11.5 tttt -88.44 127.63 35.51 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.411 -0.959 . . . . 74.030000000000001 108.411 170.745 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.6 mtt180 -129.87 172.5 11.62 Favored 'General case' 0 CA--C 1.508 -0.652 0 C-N-CA 120.516 -0.473 . . . . 49.619999999999997 110.679 -176.393 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 60.3 ttp -125.77 134.85 51.59 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 119.515 -0.874 . . . . 50.780000000000001 110.515 174.88 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 25.5 t -71.01 125.25 26.35 Favored 'General case' 0 N--CA 1.446 -0.668 0 O-C-N 124.37 1.044 . . . . 32.369999999999997 110.805 178.332 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.83 -9.85 58.94 Favored 'General case' 0 C--O 1.213 -0.864 0 CA-C-O 121.622 0.725 . . . . 98.799999999999997 111.624 176.996 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 1.4 t -94.6 -45.47 7.37 Favored 'General case' 0 N--CA 1.428 -1.565 0 CA-C-N 116.015 -0.539 . . . . 45.990000000000002 111.186 -177.64 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 82.8 p -111.15 -6.8 14.54 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 116.617 2.08 . . . . 42.850000000000001 116.617 -178.967 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.29 0.78 24.29 Favored Glycine 0 C--O 1.217 -0.932 0 C-N-CA 120.0 -1.095 . . . . 38.710000000000001 115.445 -168.513 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 75.4 mtp180 -78.03 148.06 34.51 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-N 118.702 1.251 . . . . 85.329999999999998 112.44 176.813 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.3 t -73.18 141.58 16.15 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-N 114.184 -1.371 . . . . 36.289999999999999 108.938 172.14 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 47.4 p90 -145.44 176.17 9.78 Favored 'General case' 0 C--O 1.248 1.026 0 N-CA-C 107.561 -1.274 . . . . 26.879999999999999 107.561 169.947 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 98.4 m-85 -123.11 136.67 54.89 Favored 'General case' 0 CA--C 1.507 -0.686 0 CA-C-N 115.494 -0.776 . . . . 42.469999999999999 110.022 -175.877 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -128.9 134.57 48.31 Favored 'General case' 0 N--CA 1.435 -1.215 0 N-CA-C 108.327 -0.99 . . . . 26.559999999999999 108.327 -176.563 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -107.5 114.3 28.21 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.544 -0.539 . . . . 33.759999999999998 109.544 178.258 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 7.4 p-80 -83.31 -4.45 58.46 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 117.75 -1.58 . . . . 38.479999999999997 114.062 -176.117 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 72.8 mt -78.55 -49.22 21.15 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.199 0 N-CA-C 109.36 -0.607 . . . . 37.259999999999998 109.36 171.182 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 80.9 p -99.63 -3.5 33.01 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 113.125 0.787 . . . . 32.850000000000001 113.125 -175.462 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 55.3 18.9 2.71 Favored 'General case' 0 C--O 1.211 -0.928 0 N-CA-C 117.123 2.268 . . . . 51.43 117.123 -166.0 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -75.76 149.18 38.04 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 118.672 0.669 . . . . 29.969999999999999 109.954 175.204 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 92.9 p -133.48 152.48 51.91 Favored 'General case' 0 CA--C 1.502 -0.888 0 N-CA-C 107.286 -1.376 . . . . 31.23 107.286 170.75 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 18.3 pt20 -159.6 158.0 30.83 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 108.585 -0.894 . . . . 33.829999999999998 108.585 177.339 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 97.5 m95 -76.54 -37.09 57.21 Favored 'General case' 0 CA--C 1.502 -0.89 0 CA-C-N 115.894 -0.593 . . . . 41.170000000000002 112.582 -179.052 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -85.44 143.81 28.36 Favored 'General case' 0 C--O 1.244 0.808 0 N-CA-C 112.721 0.637 . . . . 112.34 112.721 -176.626 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 34.9 ttt85 -56.55 130.24 76.58 Favored Pre-proline 0 CA--C 1.533 0.319 0 CA-C-N 115.312 -0.858 . . . . 74.099999999999994 110.137 174.059 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -78.02 161.38 29.76 Favored 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 117.115 -1.457 . . . . 56.310000000000002 114.498 -179.96 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.3 t . . . . . 0 N--CA 1.487 1.386 0 C-N-CA 127.573 2.349 . . . . 89.819999999999993 109.384 157.462 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' LMR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.5 2.029 0 CA-C-O 121.735 0.779 . . . . 67.319999999999993 111.075 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 81.1 mt -79.44 152.75 76.06 Favored Pre-proline 0 CA--C 1.545 0.779 0 CA-C-N 115.213 -0.903 . . . . 50.700000000000003 109.875 177.944 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_exo -63.95 166.97 14.94 Favored 'Trans proline' 0 CA--C 1.541 0.858 0 C-N-CA 117.476 -1.216 . . . . 31.780000000000001 111.454 173.99 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_exo -56.96 139.78 90.58 Favored 'Trans proline' 0 CA--C 1.543 0.974 0 N-CA-C 113.697 0.614 . . . . 28.870000000000001 113.697 -176.142 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 92.27 -22.77 30.62 Favored Glycine 0 CA--C 1.523 0.546 0 N-CA-C 115.78 1.072 . . . . 27.920000000000002 115.78 177.572 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' TRP . . . . . 0.43 ' CD2' ' HG3' ' A' ' 37' ' ' PRO . 94.6 m95 -81.36 142.67 32.81 Favored 'General case' 0 CA--C 1.492 -1.283 0 N-CA-C 113.143 0.794 . . . . 32.469999999999999 113.143 -174.547 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -129.49 145.18 51.47 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 107.854 -1.165 . . . . 45.090000000000003 107.854 174.149 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 11.5 tttt -88.44 127.63 35.51 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.411 -0.959 . . . . 74.030000000000001 108.411 170.745 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.6 mtt180 -129.87 172.5 11.62 Favored 'General case' 0 CA--C 1.508 -0.652 0 C-N-CA 120.516 -0.473 . . . . 49.619999999999997 110.679 -176.393 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 60.3 ttp -125.77 134.85 51.59 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 119.515 -0.874 . . . . 50.780000000000001 110.515 174.88 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 25.5 t -71.01 125.25 26.35 Favored 'General case' 0 N--CA 1.446 -0.668 0 O-C-N 124.37 1.044 . . . . 32.369999999999997 110.805 178.332 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ARG . . . . . 0.862 ' HB2' HH11 ' A' ' 17' ' ' ARG . 0.0 OUTLIER -75.83 -9.85 58.94 Favored 'General case' 0 C--O 1.213 -0.864 0 CA-C-O 121.622 0.725 . . . . 98.799999999999997 111.624 176.996 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 1.4 t -94.6 -45.47 7.37 Favored 'General case' 0 N--CA 1.428 -1.565 0 CA-C-N 116.015 -0.539 . . . . 45.990000000000002 111.186 -177.64 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 82.8 p -111.15 -6.8 14.54 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 116.617 2.08 . . . . 42.850000000000001 116.617 -178.967 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.29 0.78 24.29 Favored Glycine 0 C--O 1.217 -0.932 0 C-N-CA 120.0 -1.095 . . . . 38.710000000000001 115.445 -168.513 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 75.4 mtp180 -78.03 148.06 34.51 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-N 118.702 1.251 . . . . 85.329999999999998 112.44 176.813 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.3 t -73.18 141.58 16.15 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-N 114.184 -1.371 . . . . 36.289999999999999 108.938 172.14 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 47.4 p90 -145.44 176.17 9.78 Favored 'General case' 0 C--O 1.248 1.026 0 N-CA-C 107.561 -1.274 . . . . 26.879999999999999 107.561 169.947 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 98.4 m-85 -123.11 136.67 54.89 Favored 'General case' 0 CA--C 1.507 -0.686 0 CA-C-N 115.494 -0.776 . . . . 42.469999999999999 110.022 -175.877 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -128.9 134.57 48.31 Favored 'General case' 0 N--CA 1.435 -1.215 0 N-CA-C 108.327 -0.99 . . . . 26.559999999999999 108.327 -176.563 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -107.5 114.3 28.21 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.544 -0.539 . . . . 33.759999999999998 109.544 178.258 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 7.4 p-80 -83.31 -4.45 58.46 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 117.75 -1.58 . . . . 38.479999999999997 114.062 -176.117 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 72.8 mt -78.55 -49.22 21.15 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.199 0 N-CA-C 109.36 -0.607 . . . . 37.259999999999998 109.36 171.182 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 80.9 p -99.63 -3.5 33.01 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 113.125 0.787 . . . . 32.850000000000001 113.125 -175.462 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 55.3 18.9 2.71 Favored 'General case' 0 C--O 1.211 -0.928 0 N-CA-C 117.123 2.268 . . . . 51.43 117.123 -166.0 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -75.76 149.18 38.04 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 118.672 0.669 . . . . 29.969999999999999 109.954 175.204 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 92.9 p -133.48 152.48 51.91 Favored 'General case' 0 CA--C 1.502 -0.888 0 N-CA-C 107.286 -1.376 . . . . 31.23 107.286 170.75 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 18.3 pt20 -159.6 158.0 30.83 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 108.585 -0.894 . . . . 33.829999999999998 108.585 177.339 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 97.5 m95 -76.54 -37.09 57.21 Favored 'General case' 0 CA--C 1.502 -0.89 0 CA-C-N 115.894 -0.593 . . . . 41.170000000000002 112.582 -179.052 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -85.44 143.81 28.36 Favored 'General case' 0 C--O 1.244 0.808 0 N-CA-C 112.721 0.637 . . . . 112.34 112.721 -176.626 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 34.9 ttt85 -56.55 130.24 76.58 Favored Pre-proline 0 CA--C 1.533 0.319 0 CA-C-N 115.312 -0.858 . . . . 74.099999999999994 110.137 174.059 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' PRO . . . . . 0.487 ' O ' ' HB2' ' A' ' 38' ' ' SER . 59.1 Cg_endo -78.02 161.38 29.76 Favored 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 117.115 -1.457 . . . . 56.310000000000002 114.498 -179.96 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 38' ' ' SER . . . . . 0.487 ' HB2' ' O ' ' A' ' 37' ' ' PRO . 3.3 t . . . . . 0 N--CA 1.487 1.386 0 C-N-CA 127.573 2.349 . . . . 89.819999999999993 109.384 157.462 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' LMR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.5 2.029 0 CA-C-O 121.735 0.779 . . . . 67.319999999999993 111.075 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 81.1 mt -79.44 152.75 76.06 Favored Pre-proline 0 CA--C 1.545 0.779 0 CA-C-N 115.213 -0.903 . . . . 50.700000000000003 109.875 177.944 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_exo -63.95 166.97 14.94 Favored 'Trans proline' 0 CA--C 1.541 0.858 0 C-N-CA 117.476 -1.216 . . . . 31.780000000000001 111.454 173.99 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_exo -56.96 139.78 90.58 Favored 'Trans proline' 0 CA--C 1.543 0.974 0 N-CA-C 113.697 0.614 . . . . 28.870000000000001 113.697 -176.142 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 92.27 -22.77 30.62 Favored Glycine 0 CA--C 1.523 0.546 0 N-CA-C 115.78 1.072 . . . . 27.920000000000002 115.78 177.572 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' TRP . . . . . 0.43 ' CD2' ' HG3' ' A' ' 37' ' ' PRO . 94.6 m95 -81.36 142.67 32.81 Favored 'General case' 0 CA--C 1.492 -1.283 0 N-CA-C 113.143 0.794 . . . . 32.469999999999999 113.143 -174.547 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -129.49 145.18 51.47 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 107.854 -1.165 . . . . 45.090000000000003 107.854 174.149 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 11.5 tttt -88.44 127.63 35.51 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.411 -0.959 . . . . 74.030000000000001 108.411 170.745 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.6 mtt180 -129.87 172.5 11.62 Favored 'General case' 0 CA--C 1.508 -0.652 0 C-N-CA 120.516 -0.473 . . . . 49.619999999999997 110.679 -176.393 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 60.3 ttp -125.77 134.85 51.59 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 119.515 -0.874 . . . . 50.780000000000001 110.515 174.88 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 25.5 t -71.01 125.25 26.35 Favored 'General case' 0 N--CA 1.446 -0.668 0 O-C-N 124.37 1.044 . . . . 32.369999999999997 110.805 178.332 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.862 ' HB2' HH11 ' A' ' 17' ' ' ARG . 0.0 OUTLIER -75.83 -9.85 58.94 Favored 'General case' 0 C--O 1.213 -0.864 0 CA-C-O 121.622 0.725 . . . . 98.799999999999997 111.624 176.996 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 1.4 t -94.6 -45.47 7.37 Favored 'General case' 0 N--CA 1.428 -1.565 0 CA-C-N 116.015 -0.539 . . . . 45.990000000000002 111.186 -177.64 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 82.8 p -111.15 -6.8 14.54 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 116.617 2.08 . . . . 42.850000000000001 116.617 -178.967 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.29 0.78 24.29 Favored Glycine 0 C--O 1.217 -0.932 0 C-N-CA 120.0 -1.095 . . . . 38.710000000000001 115.445 -168.513 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 75.4 mtp180 -78.03 148.06 34.51 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-N 118.702 1.251 . . . . 85.329999999999998 112.44 176.813 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.3 t -73.18 141.58 16.15 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-N 114.184 -1.371 . . . . 36.289999999999999 108.938 172.14 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 47.4 p90 -145.44 176.17 9.78 Favored 'General case' 0 C--O 1.248 1.026 0 N-CA-C 107.561 -1.274 . . . . 26.879999999999999 107.561 169.947 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 98.4 m-85 -123.11 136.67 54.89 Favored 'General case' 0 CA--C 1.507 -0.686 0 CA-C-N 115.494 -0.776 . . . . 42.469999999999999 110.022 -175.877 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -128.9 134.57 48.31 Favored 'General case' 0 N--CA 1.435 -1.215 0 N-CA-C 108.327 -0.99 . . . . 26.559999999999999 108.327 -176.563 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -107.5 114.3 28.21 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.544 -0.539 . . . . 33.759999999999998 109.544 178.258 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 7.4 p-80 -83.31 -4.45 58.46 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 117.75 -1.58 . . . . 38.479999999999997 114.062 -176.117 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 72.8 mt -78.55 -49.22 21.15 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.199 0 N-CA-C 109.36 -0.607 . . . . 37.259999999999998 109.36 171.182 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 80.9 p -99.63 -3.5 33.01 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 113.125 0.787 . . . . 32.850000000000001 113.125 -175.462 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 98.2 m-20 55.3 18.9 2.71 Favored 'General case' 0 C--O 1.211 -0.928 0 N-CA-C 117.123 2.268 . . . . 51.43 117.123 -166.0 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -75.76 149.18 38.04 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 118.672 0.669 . . . . 29.969999999999999 109.954 175.204 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 92.9 p -133.48 152.48 51.91 Favored 'General case' 0 CA--C 1.502 -0.888 0 N-CA-C 107.286 -1.376 . . . . 31.23 107.286 170.75 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 18.3 pt20 -159.6 158.0 30.83 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 108.585 -0.894 . . . . 33.829999999999998 108.585 177.339 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 97.5 m95 -76.54 -37.09 57.21 Favored 'General case' 0 CA--C 1.502 -0.89 0 CA-C-N 115.894 -0.593 . . . . 41.170000000000002 112.582 -179.052 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -85.44 143.81 28.36 Favored 'General case' 0 C--O 1.244 0.808 0 N-CA-C 112.721 0.637 . . . . 112.34 112.721 -176.626 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 34.9 ttt85 -56.55 130.24 76.58 Favored Pre-proline 0 CA--C 1.533 0.319 0 CA-C-N 115.312 -0.858 . . . . 74.099999999999994 110.137 174.059 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.487 ' O ' ' HB2' ' A' ' 38' ' ' SER . 59.1 Cg_endo -78.02 161.38 29.76 Favored 'Trans proline' 0 CA--C 1.539 0.726 0 C-N-CA 117.115 -1.457 . . . . 56.310000000000002 114.498 -179.96 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' SER . . . . . 0.487 ' HB2' ' O ' ' A' ' 37' ' ' PRO . 3.3 t . . . . . 0 N--CA 1.487 1.386 0 C-N-CA 127.573 2.349 . . . . 89.819999999999993 109.384 157.462 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' LMR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_