data_3zq8_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 3zq8 _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 ' 1' ' ' FVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 84.1 -143.87 21.46 Favored Glycine 0 CA--C 1.492 -1.385 0 N-CA-C 105.856 -2.898 . . . . 28.34 105.856 174.225 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -155.82 147.1 22.59 Favored 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 111.797 0.295 . . . . 27.19 111.797 -173.432 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -153.9 87.37 1.21 Allowed 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 105.593 -2.002 . . . . 16.16 105.593 177.711 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 11.2 t -140.83 125.72 18.53 Favored 'Isoleucine or valine' 0 C--O 1.248 0.978 0 N-CA-C 108.432 -0.951 . . . . 18.24 108.432 -175.247 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 27.4 t90 -159.58 108.21 1.8 Allowed 'General case' 0 C--O 1.264 1.817 0 N-CA-C 107.995 -1.113 . . . . 23.51 107.995 174.523 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 6.0 t-105 -161.78 90.07 0.76 Allowed 'General case' 0 C--O 1.247 0.923 0 N-CA-C 106.317 -1.734 . . . . 14.89 106.317 -169.688 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 36.1 t-105 -156.97 88.96 1.05 Allowed 'General case' 0 CA--C 1.555 1.169 0 CA-C-N 115.319 -0.855 . . . . 23.11 109.658 -171.691 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 48.4 t-105 -164.4 81.98 0.4 Allowed 'General case' 0 N--CA 1.48 1.062 0 CA-C-O 122.065 0.936 . . . . 33.12 108.537 -174.781 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ETA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 1' ' ' FVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 2' ' ' GLY . . . . . . . . . . . . . . . 70.59 -136.54 26.26 Favored Glycine 0 C--O 1.193 -2.414 0 C-N-CA 119.467 -1.349 . . . . 13.14 112.02 179.797 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . -143.8 120.87 11.42 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 106.846 -1.539 . . . . 14.82 106.846 -175.465 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' ALA . . . . . . . . . . . . . . . -152.17 133.84 14.7 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 106.661 -1.607 . . . . 16.09 106.661 -175.403 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 8.4 m -143.88 118.9 4.02 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 N-CA-C 108.001 -1.111 . . . . 18.08 108.001 -178.986 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' TRP . . . . . . . . . . . . . 16.4 t90 -154.79 105.21 2.57 Favored 'General case' 0 N--CA 1.433 -1.311 0 N-CA-C 106.246 -1.761 . . . . 16.59 106.246 178.534 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 10.4 t90 -156.37 117.14 3.73 Favored 'General case' 0 C--O 1.259 1.577 0 N-CA-C 107.135 -1.432 . . . . 39.34 107.135 -170.61 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' TRP . . . . . . . . . . . . . 65.7 t-105 -158.06 86.09 0.89 Allowed 'General case' 0 C--O 1.252 1.199 0 N-CA-C 108.41 -0.959 . . . . 22.88 108.41 -177.32 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' TRP . . . . . . . . . . . . . 56.6 t-105 -150.95 113.71 4.71 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 120.64 -0.424 . . . . 46.36 110.21 -178.005 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' ETA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 1' ' ' FVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 2' ' ' GLY . . . . . . . . . . . . . . . -67.64 153.54 52.92 Favored Glycine 0 N--CA 1.475 1.253 0 C-N-CA 119.57 -1.3 . . . . 14.01 112.925 173.164 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 3' ' ' ALA . . . . . . . . . . . . . . . -139.42 129.59 25.24 Favored 'General case' 0 C--O 1.251 1.141 0 C-N-CA 118.753 -1.179 . . . . 14.71 108.344 177.973 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 4' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 5' ' ' ALA . . . . . . . . . . . . . . . -159.48 105.54 1.67 Allowed 'General case' 0 CA--C 1.513 -0.459 0 O-C-N 121.26 -0.9 . . . . 12.85 109.449 179.906 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 6' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 7' ' ' VAL . . . . . . . . . . . . . 54.2 t -145.59 120.75 3.22 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.004 0 CA-C-N 114.38 -1.282 . . . . 14.39 108.479 174.63 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 8' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 9' ' ' TRP . . . . . . . . . . . . . 42.1 t90 -153.47 115.3 4.28 Favored 'General case' 0 C--O 1.251 1.142 0 C-N-CA 119.353 -0.939 . . . . 17.47 110.038 -176.631 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 10' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 11' ' ' TRP . . . . . 0.555 ' CZ3' ' CD1' ' D' ' 9' ' ' TRP . 42.4 t-105 -159.47 78.41 0.72 Allowed 'General case' 0 C--O 1.241 0.609 0 N-CA-C 105.758 -1.942 . . . . 27.74 105.758 -175.974 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 12' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 13' ' ' TRP . . . . . . . . . . . . . 52.2 t-105 -159.17 88.35 0.88 Allowed 'General case' 0 C--O 1.264 1.84 0 N-CA-C 104.95 -2.241 . . . . 22.08 104.95 -167.4 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 14' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 15' ' ' TRP . . . . . . . . . . . . . 51.8 t-105 -163.87 95.4 0.79 Allowed 'General case' 0 C--O 1.255 1.351 0 O-C-N 123.952 0.783 . . . . 21.75 109.483 -178.892 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 16' ' ' ETA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 1' ' ' FVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 2' ' ' GLY . . . . . . . . . . . . . . . 63.0 -138.26 44.07 Favored Glycine 0 N--CA 1.501 3.013 0 C-N-CA 120.195 -1.002 . . . . 12.79 112.354 -179.898 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 3' ' ' ALA . . . . . . . . . . . . . . . -149.98 132.76 15.96 Favored 'General case' 0 N--CA 1.427 -1.62 0 N-CA-C 108.06 -1.089 . . . . 12.96 108.06 -171.481 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 4' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 5' ' ' ALA . . . . . . . . . . . . . . . -151.31 135.56 16.8 Favored 'General case' 0 C--O 1.258 1.516 0 N-CA-C 114.557 1.318 . . . . 19.38 114.557 -175.681 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 6' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 7' ' ' VAL . . . . . . . . . . . . . 5.5 m -145.88 85.59 0.18 Allowed 'Isoleucine or valine' 0 C--O 1.254 1.296 0 N-CA-C 108.006 -1.109 . . . . 17.27 108.006 -177.832 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 8' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 9' ' ' TRP . . . . . 0.555 ' CD1' ' CZ3' ' C' ' 11' ' ' TRP . 17.5 m-90 -144.39 123.32 12.75 Favored 'General case' 0 N--CA 1.491 1.578 0 N-CA-C 105.56 -2.015 . . . . 16.81 105.56 -176.412 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 10' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 11' ' ' TRP . . . . . . . . . . . . . 16.8 t90 -159.18 122.07 3.63 Favored 'General case' 0 C--O 1.27 2.14 0 N-CA-C 106.572 -1.64 . . . . 14.3 106.572 177.728 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 12' ' ' DLE . . . . . 0.474 ' O ' ' CD1' ' D' ' 13' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 13' ' ' TRP . . . . . 0.474 ' CD1' ' O ' ' D' ' 12' ' ' DLE . 54.6 t-105 -146.34 96.24 2.74 Favored 'General case' 0 C--O 1.255 1.346 0 N-CA-C 108.69 -0.856 . . . . 25.23 108.69 -176.579 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 14' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 15' ' ' TRP . . . . . . . . . . . . . 6.3 t-105 -152.94 116.62 4.75 Favored 'General case' 0 N--CA 1.44 -0.955 0 C-N-CA 119.136 -1.026 . . . . 36.93 108.275 179.892 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 16' ' ' ETA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C 1016 ' ' MVC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C 1017 ' ' MVC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C 1018 ' ' MVC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C 2001 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C 2002 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' FVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 84.1 -143.87 21.46 Favored Glycine 0 CA--C 1.492 -1.385 0 N-CA-C 105.856 -2.898 . . . . 28.34 105.856 174.225 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -155.82 147.1 22.59 Favored 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 111.797 0.295 . . . . 27.190000000000001 111.797 -173.432 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -153.9 87.37 1.21 Allowed 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 105.593 -2.002 . . . . 16.16 105.593 177.711 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' DVA . . . . . 0.516 HG12 HG23 ' A' ' 7' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' VAL . . . . . 0.516 HG23 HG12 ' A' ' 6' ' ' DVA . 11.2 t -140.83 125.72 18.53 Favored 'Isoleucine or valine' 0 C--O 1.248 0.978 0 N-CA-C 108.432 -0.951 . . . . 18.239999999999998 108.432 -175.247 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 8' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 27.4 t90 -159.58 108.21 1.8 Allowed 'General case' 0 C--O 1.264 1.817 0 N-CA-C 107.995 -1.113 . . . . 23.510000000000002 107.995 174.523 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 6.0 t-105 -161.78 90.07 0.76 Allowed 'General case' 0 C--O 1.247 0.923 0 N-CA-C 106.317 -1.734 . . . . 14.890000000000001 106.317 -169.688 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 36.1 t-105 -156.97 88.96 1.05 Allowed 'General case' 0 CA--C 1.555 1.169 0 CA-C-N 115.319 -0.855 . . . . 23.109999999999999 109.658 -171.691 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 15' ' ' TRP . . . . . 0.512 ' CH2' ' HB2' ' D' ' 5' ' ' ALA . 48.4 t-105 -164.4 81.98 0.4 Allowed 'General case' 0 N--CA 1.48 1.062 0 CA-C-O 122.065 0.936 . . . . 33.119999999999997 108.537 -174.781 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ETA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 1' ' ' FVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 2' ' ' GLY . . . . . . . . . . . . . . . 70.59 -136.54 26.26 Favored Glycine 0 C--O 1.193 -2.414 0 C-N-CA 119.467 -1.349 . . . . 13.140000000000001 112.02 179.797 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . -143.8 120.87 11.42 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 106.846 -1.539 . . . . 14.82 106.846 -175.465 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 4' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 5' ' ' ALA . . . . . . . . . . . . . . . -152.17 133.84 14.7 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 106.661 -1.607 . . . . 16.09 106.661 -175.403 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 6' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 8.4 m -143.88 118.9 4.02 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 N-CA-C 108.001 -1.111 . . . . 18.079999999999998 108.001 -178.986 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 8' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 9' ' ' TRP . . . . . . . . . . . . . 16.4 t90 -154.79 105.21 2.57 Favored 'General case' 0 N--CA 1.433 -1.311 0 N-CA-C 106.246 -1.761 . . . . 16.59 106.246 178.534 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 10.4 t90 -156.37 117.14 3.73 Favored 'General case' 0 C--O 1.259 1.577 0 N-CA-C 107.135 -1.432 . . . . 39.340000000000003 107.135 -170.61 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 12' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 13' ' ' TRP . . . . . . . . . . . . . 65.7 t-105 -158.06 86.09 0.89 Allowed 'General case' 0 C--O 1.252 1.199 0 N-CA-C 108.41 -0.959 . . . . 22.879999999999999 108.41 -177.32 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 15' ' ' TRP . . . . . 0.64 ' HZ2' ' HB1' ' D' ' 16' ' ' ETA . 56.6 t-105 -150.95 113.71 4.71 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 120.64 -0.424 . . . . 46.359999999999999 110.21 -178.005 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 16' ' ' ETA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 1' ' ' FVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 2' ' ' GLY . . . . . . . . . . . . . . . -67.64 153.54 52.92 Favored Glycine 0 N--CA 1.475 1.253 0 C-N-CA 119.57 -1.3 . . . . 14.01 112.925 173.164 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 3' ' ' ALA . . . . . . . . . . . . . . . -139.42 129.59 25.24 Favored 'General case' 0 C--O 1.251 1.141 0 C-N-CA 118.753 -1.179 . . . . 14.710000000000001 108.344 177.973 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 4' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 5' ' ' ALA . . . . . . . . . . . . . . . -159.48 105.54 1.67 Allowed 'General case' 0 CA--C 1.513 -0.459 0 O-C-N 121.26 -0.9 . . . . 12.85 109.449 179.906 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 6' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 7' ' ' VAL . . . . . 0.45 HG23 ' CE2' ' D' ' 13' ' ' TRP . 54.2 t -145.59 120.75 3.22 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.004 0 CA-C-N 114.38 -1.282 . . . . 14.390000000000001 108.479 174.63 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 8' ' ' DVA . . . . . 0.581 HG23 ' HE1' ' D' ' 13' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 9' ' ' TRP . . . . . . . . . . . . . 42.1 t90 -153.47 115.3 4.28 Favored 'General case' 0 C--O 1.251 1.142 0 C-N-CA 119.353 -0.939 . . . . 17.469999999999999 110.038 -176.631 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 10' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 11' ' ' TRP . . . . . 0.555 ' CZ3' ' CD1' ' D' ' 9' ' ' TRP . 42.4 t-105 -159.47 78.41 0.72 Allowed 'General case' 0 C--O 1.241 0.609 0 N-CA-C 105.758 -1.942 . . . . 27.739999999999998 105.758 -175.974 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 12' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 13' ' ' TRP . . . . . . . . . . . . . 52.2 t-105 -159.17 88.35 0.88 Allowed 'General case' 0 C--O 1.264 1.84 0 N-CA-C 104.95 -2.241 . . . . 22.079999999999998 104.95 -167.4 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 14' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 15' ' ' TRP . . . . . . . . . . . . . 51.8 t-105 -163.87 95.4 0.79 Allowed 'General case' 0 C--O 1.255 1.351 0 O-C-N 123.952 0.783 . . . . 21.75 109.483 -178.892 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 16' ' ' ETA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 1' ' ' FVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 2' ' ' GLY . . . . . . . . . . . . . . . 63.0 -138.26 44.07 Favored Glycine 0 N--CA 1.501 3.013 0 C-N-CA 120.195 -1.002 . . . . 12.789999999999999 112.354 -179.898 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 3' ' ' ALA . . . . . . . . . . . . . . . -149.98 132.76 15.96 Favored 'General case' 0 N--CA 1.427 -1.62 0 N-CA-C 108.06 -1.089 . . . . 12.960000000000001 108.06 -171.481 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 4' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 5' ' ' ALA . . . . . 0.512 ' HB2' ' CH2' ' A' ' 15' ' ' TRP . . . -151.31 135.56 16.8 Favored 'General case' 0 C--O 1.258 1.516 0 N-CA-C 114.557 1.318 . . . . 19.379999999999999 114.557 -175.681 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 6' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 7' ' ' VAL . . . . . . . . . . . . . 5.5 m -145.88 85.59 0.18 Allowed 'Isoleucine or valine' 0 C--O 1.254 1.296 0 N-CA-C 108.006 -1.109 . . . . 17.27 108.006 -177.832 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 8' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 9' ' ' TRP . . . . . 0.555 ' CD1' ' CZ3' ' C' ' 11' ' ' TRP . 17.5 m-90 -144.39 123.32 12.75 Favored 'General case' 0 N--CA 1.491 1.578 0 N-CA-C 105.56 -2.015 . . . . 17.530000000000001 105.56 -176.412 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 10' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 11' ' ' TRP . . . . . . . . . . . . . 16.8 t90 -159.18 122.07 3.63 Favored 'General case' 0 C--O 1.27 2.14 0 N-CA-C 106.572 -1.64 . . . . 14.300000000000001 106.572 177.728 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 12' ' ' DLE . . . . . 0.474 ' O ' ' CD1' ' D' ' 13' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 13' ' ' TRP . . . . . 0.581 ' HE1' HG23 ' C' ' 8' ' ' DVA . 54.6 t-105 -146.34 96.24 2.74 Favored 'General case' 0 C--O 1.255 1.346 0 N-CA-C 108.69 -0.856 . . . . 25.23 108.69 -176.579 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 14' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 15' ' ' TRP . . . . . . . . . . . . . 6.3 t-105 -152.94 116.62 4.75 Favored 'General case' 0 N--CA 1.44 -0.955 0 C-N-CA 119.136 -1.026 . . . . 36.93 108.275 179.892 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 16' ' ' ETA . . . . . 0.64 ' HB1' ' HZ2' ' B' ' 15' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C 1016 ' ' MVC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C 1017 ' ' MVC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C 1018 ' ' MVC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C 2001 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C 2002 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' FVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 84.1 -143.87 21.46 Favored Glycine 0 CA--C 1.492 -1.385 0 N-CA-C 105.856 -2.898 . . . . 28.34 105.856 174.225 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -155.82 147.1 22.59 Favored 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 111.797 0.295 . . . . 27.190000000000001 111.797 -173.432 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -153.9 87.37 1.21 Allowed 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 105.593 -2.002 . . . . 16.16 105.593 177.711 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' DVA . . . . . 0.516 HG12 HG23 ' A' ' 7' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.516 HG23 HG12 ' A' ' 6' ' ' DVA . 11.2 t -140.83 125.72 18.53 Favored 'Isoleucine or valine' 0 C--O 1.248 0.978 0 N-CA-C 108.432 -0.951 . . . . 18.239999999999998 108.432 -175.247 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 27.4 t90 -159.58 108.21 1.8 Allowed 'General case' 0 C--O 1.264 1.817 0 N-CA-C 107.995 -1.113 . . . . 23.510000000000002 107.995 174.523 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 6.0 t-105 -161.78 90.07 0.76 Allowed 'General case' 0 C--O 1.247 0.923 0 N-CA-C 106.317 -1.734 . . . . 14.890000000000001 106.317 -169.688 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 36.1 t-105 -156.97 88.96 1.05 Allowed 'General case' 0 CA--C 1.555 1.169 0 CA-C-N 115.319 -0.855 . . . . 23.109999999999999 109.658 -171.691 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.512 ' CH2' ' HB2' ' D' ' 5' ' ' ALA . 48.4 t-105 -164.4 81.98 0.4 Allowed 'General case' 0 N--CA 1.48 1.062 0 CA-C-O 122.065 0.936 . . . . 33.119999999999997 108.537 -174.781 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ETA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 1' ' ' FVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 2' ' ' GLY . . . . . . . . . . . . . . . 70.59 -136.54 26.26 Favored Glycine 0 C--O 1.193 -2.414 0 C-N-CA 119.467 -1.349 . . . . 13.140000000000001 112.02 179.797 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . -143.8 120.87 11.42 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 106.846 -1.539 . . . . 14.82 106.846 -175.465 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' ALA . . . . . . . . . . . . . . . -152.17 133.84 14.7 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 106.661 -1.607 . . . . 16.09 106.661 -175.403 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' VAL . . . . . . . . . . . . . 8.4 m -143.88 118.9 4.02 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 N-CA-C 108.001 -1.111 . . . . 18.079999999999998 108.001 -178.986 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' TRP . . . . . . . . . . . . . 16.4 t90 -154.79 105.21 2.57 Favored 'General case' 0 N--CA 1.433 -1.311 0 N-CA-C 106.246 -1.761 . . . . 16.59 106.246 178.534 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 10.4 t90 -156.37 117.14 3.73 Favored 'General case' 0 C--O 1.259 1.577 0 N-CA-C 107.135 -1.432 . . . . 39.340000000000003 107.135 -170.61 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' TRP . . . . . . . . . . . . . 65.7 t-105 -158.06 86.09 0.89 Allowed 'General case' 0 C--O 1.252 1.199 0 N-CA-C 108.41 -0.959 . . . . 22.879999999999999 108.41 -177.32 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' TRP . . . . . 0.64 ' HZ2' ' HB1' ' D' ' 16' ' ' ETA . 56.6 t-105 -150.95 113.71 4.71 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 120.64 -0.424 . . . . 46.359999999999999 110.21 -178.005 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' ETA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 1' ' ' FVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 2' ' ' GLY . . . . . . . . . . . . . . . -67.64 153.54 52.92 Favored Glycine 0 N--CA 1.475 1.253 0 C-N-CA 119.57 -1.3 . . . . 14.01 112.925 173.164 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 3' ' ' ALA . . . . . . . . . . . . . . . -139.42 129.59 25.24 Favored 'General case' 0 C--O 1.251 1.141 0 C-N-CA 118.753 -1.179 . . . . 14.710000000000001 108.344 177.973 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 4' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 5' ' ' ALA . . . . . . . . . . . . . . . -159.48 105.54 1.67 Allowed 'General case' 0 CA--C 1.513 -0.459 0 O-C-N 121.26 -0.9 . . . . 12.85 109.449 179.906 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 6' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 7' ' ' VAL . . . . . 0.45 HG23 ' CE2' ' D' ' 13' ' ' TRP . 54.2 t -145.59 120.75 3.22 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.004 0 CA-C-N 114.38 -1.282 . . . . 14.390000000000001 108.479 174.63 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 8' ' ' DVA . . . . . 0.581 HG23 ' HE1' ' D' ' 13' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 9' ' ' TRP . . . . . . . . . . . . . 42.1 t90 -153.47 115.3 4.28 Favored 'General case' 0 C--O 1.251 1.142 0 C-N-CA 119.353 -0.939 . . . . 17.469999999999999 110.038 -176.631 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 10' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 11' ' ' TRP . . . . . 0.555 ' CZ3' ' CD1' ' D' ' 9' ' ' TRP . 42.4 t-105 -159.47 78.41 0.72 Allowed 'General case' 0 C--O 1.241 0.609 0 N-CA-C 105.758 -1.942 . . . . 27.739999999999998 105.758 -175.974 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 12' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 13' ' ' TRP . . . . . . . . . . . . . 52.2 t-105 -159.17 88.35 0.88 Allowed 'General case' 0 C--O 1.264 1.84 0 N-CA-C 104.95 -2.241 . . . . 22.079999999999998 104.95 -167.4 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 14' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 15' ' ' TRP . . . . . . . . . . . . . 51.8 t-105 -163.87 95.4 0.79 Allowed 'General case' 0 C--O 1.255 1.351 0 O-C-N 123.952 0.783 . . . . 21.75 109.483 -178.892 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 16' ' ' ETA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 1' ' ' FVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 2' ' ' GLY . . . . . . . . . . . . . . . 63.0 -138.26 44.07 Favored Glycine 0 N--CA 1.501 3.013 0 C-N-CA 120.195 -1.002 . . . . 12.789999999999999 112.354 -179.898 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 3' ' ' ALA . . . . . . . . . . . . . . . -149.98 132.76 15.96 Favored 'General case' 0 N--CA 1.427 -1.62 0 N-CA-C 108.06 -1.089 . . . . 12.960000000000001 108.06 -171.481 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 4' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 5' ' ' ALA . . . . . 0.512 ' HB2' ' CH2' ' A' ' 15' ' ' TRP . . . -151.31 135.56 16.8 Favored 'General case' 0 C--O 1.258 1.516 0 N-CA-C 114.557 1.318 . . . . 19.379999999999999 114.557 -175.681 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 6' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 7' ' ' VAL . . . . . . . . . . . . . 5.5 m -145.88 85.59 0.18 Allowed 'Isoleucine or valine' 0 C--O 1.254 1.296 0 N-CA-C 108.006 -1.109 . . . . 17.27 108.006 -177.832 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 8' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 9' ' ' TRP . . . . . 0.555 ' CD1' ' CZ3' ' C' ' 11' ' ' TRP . 17.5 m-90 -144.39 123.32 12.75 Favored 'General case' 0 N--CA 1.491 1.578 0 N-CA-C 105.56 -2.015 . . . . 17.530000000000001 105.56 -176.412 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 10' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 11' ' ' TRP . . . . . . . . . . . . . 16.8 t90 -159.18 122.07 3.63 Favored 'General case' 0 C--O 1.27 2.14 0 N-CA-C 106.572 -1.64 . . . . 14.300000000000001 106.572 177.728 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 12' ' ' DLE . . . . . 0.474 ' O ' ' CD1' ' D' ' 13' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 13' ' ' TRP . . . . . 0.581 ' HE1' HG23 ' C' ' 8' ' ' DVA . 54.6 t-105 -146.34 96.24 2.74 Favored 'General case' 0 C--O 1.255 1.346 0 N-CA-C 108.69 -0.856 . . . . 25.23 108.69 -176.579 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 14' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 15' ' ' TRP . . . . . . . . . . . . . 6.3 t-105 -152.94 116.62 4.75 Favored 'General case' 0 N--CA 1.44 -0.955 0 C-N-CA 119.136 -1.026 . . . . 36.93 108.275 179.892 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 16' ' ' ETA . . . . . 0.64 ' HB1' ' HZ2' ' B' ' 15' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C 1016 ' ' MVC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C 1017 ' ' MVC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C 1018 ' ' MVC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C 2001 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C 2002 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_