data_2y3j_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 2y3j _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' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.397 0 N-CA-C 112.345 0.498 . . . . 28.699999999999999 112.345 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 2.1 mt -139.63 107.82 3.14 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.102 0 N-CA-C 116.951 2.204 . . . . 34.710000000000001 116.951 -167.994 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -111.47 143.52 21.13 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 N-CA-C 115.522 1.675 . . . . 35.020000000000003 115.522 164.621 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -135.59 105.13 0.52 Allowed Glycine 0 CA--C 1.518 0.252 0 N-CA-C 109.388 -1.485 . . . . 39.939999999999998 109.388 171.472 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -121.84 141.41 51.28 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 120.394 -0.522 . . . . 37.82 112.239 -175.178 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.474 0.765 0 N-CA-C 117.426 2.38 . . . . 59.229999999999997 117.426 -171.732 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.774 0 CA-C-O 120.905 0.383 . . . . 47.68 110.971 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 2' ' ' ILE . . . . . . . . . . . . 0.289 0.1 OUTLIER -141.68 118.85 7.73 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 N-CA-C 113.388 0.885 . . . . 44.57 113.388 -175.418 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' ILE . . . . . 0.481 ' N ' ' O ' ' D' ' 2' ' ' ILE . 6.0 mt -114.83 129.69 70.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 N-CA-C 114.797 1.406 . . . . 37.479999999999997 114.797 -174.409 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' GLY . . . . . . . . . . . . . . . -128.04 106.41 0.79 Allowed Glycine 0 CA--C 1.51 -0.221 0 C-N-CA 120.607 -0.806 . . . . 36.880000000000003 111.841 177.794 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 2.0 mt -116.48 112.85 21.99 Favored 'General case' 0 N--CA 1.476 0.825 0 N-CA-C 112.426 0.528 . . . . 48.859999999999999 112.426 -179.729 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' MET . . . . . . . . . . . . . 44.9 ttp . . . . . 0 C--O 1.239 0.506 0 N-CA-C 117.011 2.226 . . . . 52.240000000000002 117.011 -168.045 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.764 0 N-CA-C 114.391 1.256 . . . . 22.25 114.391 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 2' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -128.8 119.37 49.54 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.439 0 N-CA-C 115.724 1.75 . . . . 20.879999999999999 115.724 -172.455 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 3' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -121.76 158.08 25.35 Favored 'Isoleucine or valine' 0 C--O 1.24 0.562 0 N-CA-C 116.202 1.927 . . . . 18.93 116.202 166.9 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 4' ' ' GLY . . . . . . . . . . . . . . . -160.01 135.3 4.02 Favored Glycine 0 N--CA 1.426 -2.0 0 C-N-CA 120.261 -0.971 . . . . 19.850000000000001 115.486 177.039 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 5' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -139.6 122.05 16.14 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 117.44 -1.704 . . . . 21.399999999999999 114.319 173.194 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 6' ' ' MET . . . . . . . . . . . . . 3.1 tpp . . . . . 0 N--CA 1.443 -0.791 0 CA-C-N 114.574 -1.194 . . . . 39.210000000000001 109.448 -176.773 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.323 0 N-CA-C 112.285 0.476 . . . . 18.969999999999999 112.285 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 2' ' ' ILE . . . . . 0.481 ' O ' ' N ' ' B' ' 3' ' ' ILE . 0.0 OUTLIER -159.44 108.47 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.893 0 N-CA-C 117.475 2.398 . . . . 18.440000000000001 117.475 -170.192 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' D' D ' 3' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -107.21 163.85 5.04 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 N-CA-C 115.015 1.487 . . . . 18.969999999999999 115.015 166.523 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 4' ' ' GLY . . . . . . . . . . . . . . . -156.93 123.64 1.32 Allowed Glycine 0 C--O 1.248 0.981 0 CA-C-N 115.291 -0.868 . . . . 17.649999999999999 113.231 177.996 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 5' ' ' LEU . . . . . . . . . . . . 0.354 0.1 OUTLIER -135.79 161.04 36.71 Favored 'General case' 0 N--CA 1.484 1.262 0 N-CA-C 120.206 3.41 . . . . 22.100000000000001 120.206 174.741 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' D' D ' 6' ' ' MET . . . . . . . . . . . . . 1.7 ttp . . . . . 0 N--CA 1.445 -0.705 0 CA-C-N 114.256 -1.338 . . . . 36.369999999999997 110.8 -176.27 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.501 2.109 0 N-CA-C 109.654 -0.498 . . . . 15.35 109.654 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 2' ' ' ILE . . . . . . . . . . . . . 2.0 pt -124.99 131.09 73.01 Favored 'Isoleucine or valine' 0 C--O 1.239 0.529 0 N-CA-C 117.749 2.5 . . . . 22.23 117.749 -169.271 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 3' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -117.1 137.95 49.34 Favored 'Isoleucine or valine' 0 C--O 1.255 1.363 0 CA-C-O 121.63 0.729 . . . . 35.200000000000003 112.107 171.438 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' E' E ' 4' ' ' GLY . . . . . . . . . . . . . . . -134.44 125.82 3.95 Favored Glycine 0 N--CA 1.475 1.265 0 N-CA-C 115.873 1.109 . . . . 23.210000000000001 115.873 166.824 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 5' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -119.97 143.36 48.06 Favored 'General case' 0 N--CA 1.485 1.31 0 N-CA-C 113.664 0.987 . . . . 26.329999999999998 113.664 169.524 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' E' E ' 6' ' ' MET . . . . . . . . . . . . . 3.6 ttp . . . . . 0 N--CA 1.47 0.574 0 N-CA-C 116.746 2.128 . . . . 31.66 116.746 168.552 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 1' ' ' ALA . . . . . 0.483 ' O ' ' N ' ' H' ' 2' ' ' ILE . . . . . . . . 0 N--CA 1.517 2.91 0 N-CA-C 115.666 1.728 . . . . 15.32 115.666 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 2' ' ' ILE . . . . . 0.883 ' CG2' ' CD1' ' H' ' 2' ' ' ILE . 0.6 OUTLIER -130.79 136.88 57.28 Favored 'Isoleucine or valine' 0 C--O 1.262 1.729 0 CA-C-N 114.071 -1.422 . . . . 14.56 114.838 -169.222 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' F' F ' 3' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -131.51 124.12 53.86 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.619 0 N-CA-C 117.437 2.384 . . . . 19.710000000000001 117.437 164.928 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' F' F ' 4' ' ' GLY . . . . . . . . . . . . . . . -106.59 136.34 13.26 Favored Glycine 0 C--N 1.345 1.047 0 CA-C-O 119.582 -0.565 . . . . 14.630000000000001 113.28 166.046 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 5' ' ' LEU . . . . . 0.448 ' O ' ' N ' ' H' ' 6' ' ' MET . 0.2 OUTLIER -124.14 123.88 41.28 Favored 'General case' 0 N--CA 1.489 1.495 0 CA-C-O 123.851 1.786 . . . . 18.32 112.327 169.121 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' F' F ' 6' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.436 -1.167 0 CA-C-O 124.288 1.994 . . . . 22.16 107.05 178.748 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.082 0 CA-C-O 121.066 0.46 . . . . 21.280000000000001 110.13 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' G' G ' 2' ' ' ILE . . . . . . . . . . . . . 1.6 mp -148.64 123.04 1.91 Allowed 'Isoleucine or valine' 0 C--O 1.246 0.874 0 N-CA-C 119.202 3.038 . . . . 27.699999999999999 119.202 -164.673 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 3' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -118.39 136.79 54.44 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.347 0 N-CA-C 115.491 1.664 . . . . 23.239999999999998 115.491 178.208 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' G' G ' 4' ' ' GLY . . . . . . . . . . . . . . . -130.5 130.75 6.27 Favored Glycine 0 C--O 1.255 1.421 0 CA-C-N 114.426 -1.261 . . . . 23.120000000000001 113.494 175.349 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 5' ' ' LEU . . . . . . . . . . . . 0.343 0.1 OUTLIER -134.87 142.72 46.67 Favored 'General case' 0 C--O 1.258 1.547 0 N-CA-C 119.131 3.011 . . . . 22.420000000000002 119.131 166.56 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' G' G ' 6' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.497 -1.089 0 CA-C-N 112.821 -1.991 . . . . 29.039999999999999 108.399 -173.004 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 0.869 0 N-CA-C 107.722 -1.214 . . . . 8.8800000000000008 107.722 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 2' ' ' ILE . . . . . 0.883 ' CD1' ' CG2' ' F' ' 2' ' ' ILE . 0.0 OUTLIER -137.49 150.45 25.8 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 C-N-CA 115.752 -2.379 . . . . 8.6799999999999997 116.976 177.183 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 3' ' ' ILE . . . . . . . . . . . . 0.263 0.0 OUTLIER -135.43 123.44 37.96 Favored 'Isoleucine or valine' 0 C--O 1.263 1.766 0 O-C-N 124.764 1.29 . . . . 12.460000000000001 113.266 176.803 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 4' ' ' GLY . . . . . . . . . . . . . . . -114.83 133.03 10.78 Favored Glycine 0 N--CA 1.506 3.351 0 C-N-CA 117.791 -2.147 . . . . 8.8699999999999992 111.365 165.672 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 5' ' ' LEU . . . . . . . . . . . . 0.295 0.1 OUTLIER -126.19 141.17 52.04 Favored 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 118.233 2.679 . . . . 10.4 118.233 161.983 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 6' ' ' MET . . . . . 0.448 ' N ' ' O ' ' F' ' 5' ' ' LEU . 2.3 ttp . . . . . 0 C--N 1.298 -1.666 0 CA-C-O 116.359 -1.781 . . . . 29.289999999999999 110.361 178.36 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B 2001 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E 2001 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.397 0 N-CA-C 112.345 0.498 . . . . 28.699999999999999 112.345 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' ILE . . . . . 0.775 HD12 HG23 ' C' ' 2' ' ' ILE . 2.1 mt -139.63 107.82 3.14 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.102 0 N-CA-C 116.951 2.204 . . . . 34.710000000000001 116.951 -167.994 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -111.47 143.52 21.13 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 N-CA-C 115.522 1.675 . . . . 35.020000000000003 115.522 164.621 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -135.59 105.13 0.52 Allowed Glycine 0 CA--C 1.518 0.252 0 N-CA-C 109.388 -1.485 . . . . 39.939999999999998 109.388 171.472 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -121.84 141.41 51.28 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 120.394 -0.522 . . . . 37.82 112.239 -175.178 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.474 0.765 0 N-CA-C 117.426 2.38 . . . . 59.229999999999997 117.426 -171.732 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.774 0 CA-C-O 120.905 0.383 . . . . 47.68 110.971 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 2' ' ' ILE . . . . . 0.975 ' HB ' HG13 ' D' ' 2' ' ' ILE 0.289 0.1 OUTLIER -141.68 118.85 7.73 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 N-CA-C 113.388 0.885 . . . . 44.57 113.388 -175.418 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' B' B ' 3' ' ' ILE . . . . . 0.51 ' O ' ' HA ' ' D' ' 3' ' ' ILE . 6.0 mt -114.83 129.69 70.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 N-CA-C 114.797 1.406 . . . . 37.479999999999997 114.797 -174.409 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 4' ' ' GLY . . . . . . . . . . . . . . . -128.04 106.41 0.79 Allowed Glycine 0 CA--C 1.51 -0.221 0 C-N-CA 120.607 -0.806 . . . . 36.880000000000003 111.841 177.794 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 5' ' ' LEU . . . . . 0.424 ' O ' ' HB3' ' D' ' 5' ' ' LEU . 2.0 mt -116.48 112.85 21.99 Favored 'General case' 0 N--CA 1.476 0.825 0 N-CA-C 112.426 0.528 . . . . 48.859999999999999 112.426 -179.729 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 6' ' ' MET . . . . . 0.421 ' HE1' ' OXT' ' C' ' 6' ' ' MET . 44.9 ttp . . . . . 0 C--O 1.239 0.506 0 N-CA-C 117.011 2.226 . . . . 52.240000000000002 117.011 -168.045 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.764 0 N-CA-C 114.391 1.256 . . . . 22.25 114.391 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 2' ' ' ILE . . . . . 0.775 HG23 HD12 ' A' ' 2' ' ' ILE . 0.0 OUTLIER -128.8 119.37 49.54 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.439 0 N-CA-C 115.724 1.75 . . . . 20.879999999999999 115.724 -172.455 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 3' ' ' ILE . . . . . 0.615 HG13 HD11 ' B' ' 2' ' ' ILE . 0.8 OUTLIER -121.76 158.08 25.35 Favored 'Isoleucine or valine' 0 C--O 1.24 0.562 0 N-CA-C 116.202 1.927 . . . . 18.93 116.202 166.9 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 4' ' ' GLY . . . . . . . . . . . . . . . -160.01 135.3 4.02 Favored Glycine 0 N--CA 1.426 -2.0 0 C-N-CA 120.261 -0.971 . . . . 19.850000000000001 115.486 177.039 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 5' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -139.6 122.05 16.14 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 117.44 -1.704 . . . . 21.399999999999999 114.319 173.194 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 6' ' ' MET . . . . . 0.421 ' OXT' ' HE1' ' B' ' 6' ' ' MET . 3.1 tpp . . . . . 0 N--CA 1.443 -0.791 0 CA-C-N 114.574 -1.194 . . . . 39.210000000000001 109.448 -176.773 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.323 0 N-CA-C 112.285 0.476 . . . . 18.969999999999999 112.285 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 2' ' ' ILE . . . . . 0.975 HG13 ' HB ' ' B' ' 2' ' ' ILE . 0.0 OUTLIER -159.44 108.47 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.893 0 N-CA-C 117.475 2.398 . . . . 18.440000000000001 117.475 -170.192 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' D' D ' 3' ' ' ILE . . . . . 0.519 HG22 ' H ' ' D' ' 4' ' ' GLY . 0.1 OUTLIER -107.21 163.85 5.04 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 N-CA-C 115.015 1.487 . . . . 18.969999999999999 115.015 166.523 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' D' D ' 4' ' ' GLY . . . . . 0.519 ' H ' HG22 ' D' ' 3' ' ' ILE . . . -156.93 123.64 1.32 Allowed Glycine 0 C--O 1.248 0.981 0 CA-C-N 115.291 -0.868 . . . . 17.649999999999999 113.231 177.996 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 5' ' ' LEU . . . . . 0.424 ' HB3' ' O ' ' B' ' 5' ' ' LEU 0.354 0.1 OUTLIER -135.79 161.04 36.71 Favored 'General case' 0 N--CA 1.484 1.262 0 N-CA-C 120.206 3.41 . . . . 22.100000000000001 120.206 174.741 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' D' D ' 6' ' ' MET . . . . . 0.408 ' HE2' ' HG3' ' B' ' 6' ' ' MET . 1.7 ttp . . . . . 0 N--CA 1.445 -0.705 0 CA-C-N 114.256 -1.338 . . . . 36.369999999999997 110.8 -176.27 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.501 2.109 0 N-CA-C 109.654 -0.498 . . . . 15.35 109.654 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 2' ' ' ILE . . . . . 0.905 HG13 HG23 ' G' ' 2' ' ' ILE . 2.0 pt -124.99 131.09 73.01 Favored 'Isoleucine or valine' 0 C--O 1.239 0.529 0 N-CA-C 117.749 2.5 . . . . 22.23 117.749 -169.271 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 3' ' ' ILE . . . . . 0.883 HD11 ' HB ' ' H' ' 2' ' ' ILE . 0.1 OUTLIER -117.1 137.95 49.34 Favored 'Isoleucine or valine' 0 C--O 1.255 1.363 0 CA-C-O 121.63 0.729 . . . . 35.200000000000003 112.107 171.438 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' E' E ' 4' ' ' GLY . . . . . . . . . . . . . . . -134.44 125.82 3.95 Favored Glycine 0 N--CA 1.475 1.265 0 N-CA-C 115.873 1.109 . . . . 23.210000000000001 115.873 166.824 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 5' ' ' LEU . . . . . 0.42 HD23 ' N ' ' E' ' 5' ' ' LEU . 0.1 OUTLIER -119.97 143.36 48.06 Favored 'General case' 0 N--CA 1.485 1.31 0 N-CA-C 113.664 0.987 . . . . 26.329999999999998 113.664 169.524 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' E' E ' 6' ' ' MET . . . . . . . . . . . . . 3.6 ttp . . . . . 0 N--CA 1.47 0.574 0 N-CA-C 116.746 2.128 . . . . 31.66 116.746 168.552 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.517 2.91 0 N-CA-C 115.666 1.728 . . . . 15.32 115.666 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 2' ' ' ILE . . . . . 0.883 ' CG2' ' CD1' ' H' ' 2' ' ' ILE . 0.6 OUTLIER -130.79 136.88 57.28 Favored 'Isoleucine or valine' 0 C--O 1.262 1.729 0 CA-C-N 114.071 -1.422 . . . . 14.56 114.838 -169.222 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' F' F ' 3' ' ' ILE . . . . . 0.525 HG13 HG23 ' H' ' 3' ' ' ILE . 0.0 OUTLIER -131.51 124.12 53.86 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.619 0 N-CA-C 117.437 2.384 . . . . 19.710000000000001 117.437 164.928 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' F' F ' 4' ' ' GLY . . . . . 0.601 ' HA2' ' O ' ' H' ' 4' ' ' GLY . . . -106.59 136.34 13.26 Favored Glycine 0 C--N 1.345 1.047 0 CA-C-O 119.582 -0.565 . . . . 14.630000000000001 113.28 166.046 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 5' ' ' LEU . . . . . 0.528 HD23 ' C ' ' F' ' 4' ' ' GLY . 0.2 OUTLIER -124.14 123.88 41.28 Favored 'General case' 0 N--CA 1.489 1.495 0 CA-C-O 123.851 1.786 . . . . 18.32 112.327 169.121 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' F' F ' 6' ' ' MET . . . . . 0.585 ' HA ' ' O ' ' H' ' 6' ' ' MET . 1.0 OUTLIER . . . . . 0 N--CA 1.436 -1.167 0 CA-C-O 124.288 1.994 . . . . 22.16 107.05 178.748 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' G' G ' 1' ' ' ALA . . . . . 0.549 ' C ' HG13 ' G' ' 2' ' ' ILE . . . . . . . . 0 N--CA 1.481 1.082 0 CA-C-O 121.066 0.46 . . . . 21.280000000000001 110.13 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 2' ' ' ILE . . . . . 0.905 HG23 HG13 ' E' ' 2' ' ' ILE . 1.6 mp -148.64 123.04 1.91 Allowed 'Isoleucine or valine' 0 C--O 1.246 0.874 0 N-CA-C 119.202 3.038 . . . . 27.699999999999999 119.202 -164.673 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' G' G ' 3' ' ' ILE . . . . . 0.858 HG13 HD12 ' F' ' 2' ' ' ILE . 0.5 OUTLIER -118.39 136.79 54.44 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.347 0 N-CA-C 115.491 1.664 . . . . 23.239999999999998 115.491 178.208 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' G' G ' 4' ' ' GLY . . . . . . . . . . . . . . . -130.5 130.75 6.27 Favored Glycine 0 C--O 1.255 1.421 0 CA-C-N 114.426 -1.261 . . . . 23.120000000000001 113.494 175.349 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 5' ' ' LEU . . . . . . . . . . . . 0.343 0.1 OUTLIER -134.87 142.72 46.67 Favored 'General case' 0 C--O 1.258 1.547 0 N-CA-C 119.131 3.011 . . . . 22.420000000000002 119.131 166.56 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' G' G ' 6' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.497 -1.089 0 CA-C-N 112.821 -1.991 . . . . 29.039999999999999 108.399 -173.004 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 0.869 0 N-CA-C 107.722 -1.214 . . . . 8.8800000000000008 107.722 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 2' ' ' ILE . . . . . 0.883 ' CD1' ' CG2' ' F' ' 2' ' ' ILE . 0.0 OUTLIER -137.49 150.45 25.8 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 C-N-CA 115.752 -2.379 . . . . 8.6799999999999997 116.976 177.183 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 3' ' ' ILE . . . . . 0.525 HG23 HG13 ' F' ' 3' ' ' ILE 0.263 0.0 OUTLIER -135.43 123.44 37.96 Favored 'Isoleucine or valine' 0 C--O 1.263 1.766 0 O-C-N 124.764 1.29 . . . . 12.460000000000001 113.266 176.803 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' H' H ' 4' ' ' GLY . . . . . 0.601 ' O ' ' HA2' ' F' ' 4' ' ' GLY . . . -114.83 133.03 10.78 Favored Glycine 0 N--CA 1.506 3.351 0 C-N-CA 117.791 -2.147 . . . . 8.8699999999999992 111.365 165.672 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 5' ' ' LEU . . . . . . . . . . . . 0.295 0.1 OUTLIER -126.19 141.17 52.04 Favored 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 118.233 2.679 . . . . 10.4 118.233 161.983 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 6' ' ' MET . . . . . 0.585 ' O ' ' HA ' ' F' ' 6' ' ' MET . 2.3 ttp . . . . . 0 C--N 1.298 -1.666 0 CA-C-O 116.359 -1.781 . . . . 29.289999999999999 110.361 178.36 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 2001 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E 2001 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.397 0 N-CA-C 112.345 0.498 . . . . 28.699999999999999 112.345 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.775 HD12 HG23 ' C' ' 2' ' ' ILE . 2.1 mt -139.63 107.82 3.14 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.102 0 N-CA-C 116.951 2.204 . . . . 34.710000000000001 116.951 -167.994 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -111.47 143.52 21.13 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 N-CA-C 115.522 1.675 . . . . 35.020000000000003 115.522 164.621 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -135.59 105.13 0.52 Allowed Glycine 0 CA--C 1.518 0.252 0 N-CA-C 109.388 -1.485 . . . . 39.939999999999998 109.388 171.472 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -121.84 141.41 51.28 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 120.394 -0.522 . . . . 37.82 112.239 -175.178 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.474 0.765 0 N-CA-C 117.426 2.38 . . . . 59.229999999999997 117.426 -171.732 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.774 0 CA-C-O 120.905 0.383 . . . . 47.68 110.971 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 2' ' ' ILE . . . . . 0.975 ' HB ' HG13 ' D' ' 2' ' ' ILE 0.289 0.1 OUTLIER -141.68 118.85 7.73 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 N-CA-C 113.388 0.885 . . . . 44.57 113.388 -175.418 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' ILE . . . . . 0.51 ' O ' ' HA ' ' D' ' 3' ' ' ILE . 6.0 mt -114.83 129.69 70.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 N-CA-C 114.797 1.406 . . . . 37.479999999999997 114.797 -174.409 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' GLY . . . . . . . . . . . . . . . -128.04 106.41 0.79 Allowed Glycine 0 CA--C 1.51 -0.221 0 C-N-CA 120.607 -0.806 . . . . 36.880000000000003 111.841 177.794 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.424 ' O ' ' HB3' ' D' ' 5' ' ' LEU . 2.0 mt -116.48 112.85 21.99 Favored 'General case' 0 N--CA 1.476 0.825 0 N-CA-C 112.426 0.528 . . . . 48.859999999999999 112.426 -179.729 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' MET . . . . . 0.421 ' HE1' ' OXT' ' C' ' 6' ' ' MET . 44.9 ttp . . . . . 0 C--O 1.239 0.506 0 N-CA-C 117.011 2.226 . . . . 52.240000000000002 117.011 -168.045 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.764 0 N-CA-C 114.391 1.256 . . . . 22.25 114.391 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 2' ' ' ILE . . . . . 0.775 HG23 HD12 ' A' ' 2' ' ' ILE . 0.0 OUTLIER -128.8 119.37 49.54 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.439 0 N-CA-C 115.724 1.75 . . . . 20.879999999999999 115.724 -172.455 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 3' ' ' ILE . . . . . 0.615 HG13 HD11 ' B' ' 2' ' ' ILE . 0.8 OUTLIER -121.76 158.08 25.35 Favored 'Isoleucine or valine' 0 C--O 1.24 0.562 0 N-CA-C 116.202 1.927 . . . . 18.93 116.202 166.9 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 4' ' ' GLY . . . . . . . . . . . . . . . -160.01 135.3 4.02 Favored Glycine 0 N--CA 1.426 -2.0 0 C-N-CA 120.261 -0.971 . . . . 19.850000000000001 115.486 177.039 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 5' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -139.6 122.05 16.14 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 117.44 -1.704 . . . . 21.399999999999999 114.319 173.194 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 6' ' ' MET . . . . . 0.421 ' OXT' ' HE1' ' B' ' 6' ' ' MET . 3.1 tpp . . . . . 0 N--CA 1.443 -0.791 0 CA-C-N 114.574 -1.194 . . . . 39.210000000000001 109.448 -176.773 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.323 0 N-CA-C 112.285 0.476 . . . . 18.969999999999999 112.285 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 2' ' ' ILE . . . . . 0.975 HG13 ' HB ' ' B' ' 2' ' ' ILE . 0.0 OUTLIER -159.44 108.47 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.893 0 N-CA-C 117.475 2.398 . . . . 18.440000000000001 117.475 -170.192 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' D' D ' 3' ' ' ILE . . . . . 0.519 HG22 ' H ' ' D' ' 4' ' ' GLY . 0.1 OUTLIER -107.21 163.85 5.04 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 N-CA-C 115.015 1.487 . . . . 18.969999999999999 115.015 166.523 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' D' D ' 4' ' ' GLY . . . . . 0.519 ' H ' HG22 ' D' ' 3' ' ' ILE . . . -156.93 123.64 1.32 Allowed Glycine 0 C--O 1.248 0.981 0 CA-C-N 115.291 -0.868 . . . . 17.649999999999999 113.231 177.996 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 5' ' ' LEU . . . . . 0.424 ' HB3' ' O ' ' B' ' 5' ' ' LEU 0.354 0.1 OUTLIER -135.79 161.04 36.71 Favored 'General case' 0 N--CA 1.484 1.262 0 N-CA-C 120.206 3.41 . . . . 22.100000000000001 120.206 174.741 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' D' D ' 6' ' ' MET . . . . . 0.408 ' HE2' ' HG3' ' B' ' 6' ' ' MET . 1.7 ttp . . . . . 0 N--CA 1.445 -0.705 0 CA-C-N 114.256 -1.338 . . . . 36.369999999999997 110.8 -176.27 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.501 2.109 0 N-CA-C 109.654 -0.498 . . . . 15.35 109.654 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 2' ' ' ILE . . . . . 0.905 HG13 HG23 ' G' ' 2' ' ' ILE . 2.0 pt -124.99 131.09 73.01 Favored 'Isoleucine or valine' 0 C--O 1.239 0.529 0 N-CA-C 117.749 2.5 . . . . 22.23 117.749 -169.271 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 3' ' ' ILE . . . . . 0.883 HD11 ' HB ' ' H' ' 2' ' ' ILE . 0.1 OUTLIER -117.1 137.95 49.34 Favored 'Isoleucine or valine' 0 C--O 1.255 1.363 0 CA-C-O 121.63 0.729 . . . . 35.200000000000003 112.107 171.438 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' E' E ' 4' ' ' GLY . . . . . . . . . . . . . . . -134.44 125.82 3.95 Favored Glycine 0 N--CA 1.475 1.265 0 N-CA-C 115.873 1.109 . . . . 23.210000000000001 115.873 166.824 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 5' ' ' LEU . . . . . 0.42 HD23 ' N ' ' E' ' 5' ' ' LEU . 0.1 OUTLIER -119.97 143.36 48.06 Favored 'General case' 0 N--CA 1.485 1.31 0 N-CA-C 113.664 0.987 . . . . 26.329999999999998 113.664 169.524 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' E' E ' 6' ' ' MET . . . . . . . . . . . . . 3.6 ttp . . . . . 0 N--CA 1.47 0.574 0 N-CA-C 116.746 2.128 . . . . 31.66 116.746 168.552 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.517 2.91 0 N-CA-C 115.666 1.728 . . . . 15.32 115.666 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 2' ' ' ILE . . . . . 0.883 ' CG2' ' CD1' ' H' ' 2' ' ' ILE . 0.6 OUTLIER -130.79 136.88 57.28 Favored 'Isoleucine or valine' 0 C--O 1.262 1.729 0 CA-C-N 114.071 -1.422 . . . . 14.56 114.838 -169.222 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' F' F ' 3' ' ' ILE . . . . . 0.525 HG13 HG23 ' H' ' 3' ' ' ILE . 0.0 OUTLIER -131.51 124.12 53.86 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.619 0 N-CA-C 117.437 2.384 . . . . 19.710000000000001 117.437 164.928 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' F' F ' 4' ' ' GLY . . . . . 0.601 ' HA2' ' O ' ' H' ' 4' ' ' GLY . . . -106.59 136.34 13.26 Favored Glycine 0 C--N 1.345 1.047 0 CA-C-O 119.582 -0.565 . . . . 14.630000000000001 113.28 166.046 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 5' ' ' LEU . . . . . 0.528 HD23 ' C ' ' F' ' 4' ' ' GLY . 0.2 OUTLIER -124.14 123.88 41.28 Favored 'General case' 0 N--CA 1.489 1.495 0 CA-C-O 123.851 1.786 . . . . 18.32 112.327 169.121 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' F' F ' 6' ' ' MET . . . . . 0.585 ' HA ' ' O ' ' H' ' 6' ' ' MET . 1.0 OUTLIER . . . . . 0 N--CA 1.436 -1.167 0 CA-C-O 124.288 1.994 . . . . 22.16 107.05 178.748 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' G' G ' 1' ' ' ALA . . . . . 0.549 ' C ' HG13 ' G' ' 2' ' ' ILE . . . . . . . . 0 N--CA 1.481 1.082 0 CA-C-O 121.066 0.46 . . . . 21.280000000000001 110.13 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 2' ' ' ILE . . . . . 0.905 HG23 HG13 ' E' ' 2' ' ' ILE . 1.6 mp -148.64 123.04 1.91 Allowed 'Isoleucine or valine' 0 C--O 1.246 0.874 0 N-CA-C 119.202 3.038 . . . . 27.699999999999999 119.202 -164.673 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' G' G ' 3' ' ' ILE . . . . . 0.858 HG13 HD12 ' F' ' 2' ' ' ILE . 0.5 OUTLIER -118.39 136.79 54.44 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.347 0 N-CA-C 115.491 1.664 . . . . 23.239999999999998 115.491 178.208 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' G' G ' 4' ' ' GLY . . . . . . . . . . . . . . . -130.5 130.75 6.27 Favored Glycine 0 C--O 1.255 1.421 0 CA-C-N 114.426 -1.261 . . . . 23.120000000000001 113.494 175.349 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 5' ' ' LEU . . . . . . . . . . . . 0.343 0.1 OUTLIER -134.87 142.72 46.67 Favored 'General case' 0 C--O 1.258 1.547 0 N-CA-C 119.131 3.011 . . . . 22.420000000000002 119.131 166.56 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' G' G ' 6' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.497 -1.089 0 CA-C-N 112.821 -1.991 . . . . 29.039999999999999 108.399 -173.004 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 0.869 0 N-CA-C 107.722 -1.214 . . . . 8.8800000000000008 107.722 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 2' ' ' ILE . . . . . 0.883 ' CD1' ' CG2' ' F' ' 2' ' ' ILE . 0.0 OUTLIER -137.49 150.45 25.8 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 C-N-CA 115.752 -2.379 . . . . 8.6799999999999997 116.976 177.183 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 3' ' ' ILE . . . . . 0.525 HG23 HG13 ' F' ' 3' ' ' ILE 0.263 0.0 OUTLIER -135.43 123.44 37.96 Favored 'Isoleucine or valine' 0 C--O 1.263 1.766 0 O-C-N 124.764 1.29 . . . . 12.460000000000001 113.266 176.803 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' H' H ' 4' ' ' GLY . . . . . 0.601 ' O ' ' HA2' ' F' ' 4' ' ' GLY . . . -114.83 133.03 10.78 Favored Glycine 0 N--CA 1.506 3.351 0 C-N-CA 117.791 -2.147 . . . . 8.8699999999999992 111.365 165.672 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 5' ' ' LEU . . . . . . . . . . . . 0.295 0.1 OUTLIER -126.19 141.17 52.04 Favored 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 118.233 2.679 . . . . 10.4 118.233 161.983 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 6' ' ' MET . . . . . 0.585 ' O ' ' HA ' ' F' ' 6' ' ' MET . 2.3 ttp . . . . . 0 C--N 1.298 -1.666 0 CA-C-O 116.359 -1.781 . . . . 29.289999999999999 110.361 178.36 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 2001 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E 2001 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_