data_2ifo_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 2ifo _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' ' ' SER . . . . . . . . . . . . . 75.5 m . . . . . 0 N--CA 1.486 1.343 0 N-CA-C 111.663 0.246 . . . . 10.0 111.663 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -58.8 -76.09 0.23 Allowed Glycine 0 CA--C 1.521 0.411 0 C-N-CA 120.823 -0.703 . . . . 10.0 114.785 -179.718 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -56.55 -52.53 49.69 Favored Glycine 0 C--O 1.227 -0.326 0 C-N-CA 121.211 -0.518 . . . . 10.0 114.318 -179.587 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -63.41 -73.58 0.52 Allowed Glycine 0 CA--C 1.52 0.345 0 C-N-CA 120.57 -0.824 . . . . 10.0 114.777 -179.877 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -58.86 -57.52 19.45 Favored Glycine 0 CA--C 1.518 0.236 0 N-CA-C 117.819 1.888 . . . . 10.0 117.819 -178.457 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 54.7 t -63.51 -55.2 24.27 Favored 'Isoleucine or valine' 0 C--O 1.237 0.429 0 N-CA-C 114.28 1.215 . . . . 10.0 114.28 -178.43 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -59.98 -43.7 94.95 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 112.543 0.571 . . . . 10.0 112.543 -179.08 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 39.9 t -64.09 -33.46 62.49 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 N-CA-C 109.379 -0.6 . . . . 10.0 109.379 178.956 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -60.82 -42.04 99.39 Favored Glycine 0 N--CA 1.449 -0.463 0 N-CA-C 108.271 -1.931 . . . . 10.0 108.271 178.596 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -62.27 -35.87 80.32 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 109.206 -0.665 . . . . 10.0 109.206 178.916 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 40.6 t -59.1 -47.2 90.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 N-CA-C 109.145 -0.687 . . . . 10.0 109.145 -179.838 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 74.1 t -59.71 -60.05 3.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.739 -0.664 . . . . 10.0 111.668 -179.299 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 74.4 m -60.38 -41.56 94.03 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 114.536 1.309 . . . . 10.0 114.536 -178.675 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -71.54 -43.29 66.69 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 113.532 0.938 . . . . 10.0 113.532 -178.947 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.6 mp -70.34 -56.87 9.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 N-CA-C 114.563 1.32 . . . . 10.0 114.563 -178.681 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.67 -22.02 60.99 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 119.484 -0.886 . . . . 10.0 110.787 -179.528 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -72.96 -49.28 17.37 Favored Glycine 0 N--CA 1.449 -0.488 0 N-CA-C 110.113 -1.195 . . . . 10.0 110.113 178.561 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.43 -22.86 66.23 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 108.553 -0.906 . . . . 10.0 108.553 179.5 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -74.24 -21.5 59.76 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.916 -0.584 . . . . 10.0 111.467 179.274 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -53.14 -54.03 31.28 Favored Glycine 0 CA--C 1.521 0.444 0 N-CA-C 109.44 -1.464 . . . . 10.0 109.44 179.025 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_exo -57.89 -27.03 77.05 Favored 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 121.572 1.514 . . . . 10.0 112.091 179.342 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 1.1 mp -64.24 -42.06 94.31 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.967 0 N-CA-C 106.375 -1.713 . . . . 10.0 106.375 178.265 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.44 -26.05 65.32 Favored 'General case' 0 C--O 1.233 0.19 0 N-CA-C 108.481 -0.933 . . . . 10.0 108.481 179.403 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.4 -38.55 91.41 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 109.251 -0.648 . . . . 10.0 109.251 179.143 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 20.6 mt -61.07 -33.56 56.47 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.102 0 N-CA-C 106.161 -1.792 . . . . 10.0 106.161 178.355 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -59.11 -45.4 95.34 Favored Glycine 0 N--CA 1.452 -0.255 0 CA-C-N 115.597 -0.728 . . . . 10.0 111.562 179.423 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -63.94 -48.98 70.8 Favored Glycine 0 N--CA 1.448 -0.53 0 N-CA-C 110.054 -1.218 . . . . 10.0 110.054 179.025 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.37 -37.66 84.16 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 112.946 0.721 . . . . 10.0 112.946 -179.863 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 9.1 t -66.04 -36.89 78.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 108.683 -0.858 . . . . 10.0 108.683 179.5 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 24.8 mt -65.15 -37.13 86.42 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.258 -0.883 . . . . 10.0 111.971 179.842 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 72.0 p -58.15 -46.55 85.48 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 121.281 0.562 . . . . 10.0 109.841 -179.722 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 31.4 t -69.86 -54.34 19.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 N-CA-C 114.076 1.139 . . . . 10.0 114.076 -179.558 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 62.8 mtt -53.48 -48.38 68.97 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 115.55 1.685 . . . . 10.0 115.55 -178.503 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 14.9 p -68.39 -26.45 33.74 Favored 'Isoleucine or valine' 0 C--O 1.238 0.472 0 N-CA-C 107.926 -1.138 . . . . 10.0 107.926 178.269 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -62.76 -50.59 62.63 Favored Glycine 0 CA--C 1.504 -0.643 0 CA-C-N 115.109 -0.951 . . . . 10.0 111.458 -179.495 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ILE . . . . . 0.479 ' O ' ' CD2' ' A' ' 39' ' ' TYR . 0.3 OUTLIER -63.78 -27.25 42.49 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.904 0 C-N-CA 119.465 -0.894 . . . . 10.0 112.886 178.576 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 9.6 tttt -86.76 -21.28 26.64 Favored 'General case' 0 C--N 1.318 -0.764 0 C-N-CA 116.633 -2.027 . . . . 10.0 115.299 179.022 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 7.4 p -61.54 -28.17 43.51 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 N-CA-C 101.79 -3.411 . . . . 10.0 101.79 176.297 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' TYR . . . . . 0.479 ' CD2' ' O ' ' A' ' 36' ' ' ILE . 0.0 OUTLIER -71.75 -39.11 70.24 Favored 'General case' 0 C--O 1.241 0.628 0 N-CA-C 107.242 -1.392 . . . . 10.0 107.242 177.692 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 83.2 tttt -67.83 -39.99 83.83 Favored 'General case' 0 C--O 1.242 0.681 0 N-CA-C 113.135 0.791 . . . . 10.0 113.135 179.358 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 69.0 m95 -75.01 -29.62 60.9 Favored 'General case' 0 C--N 1.328 -0.366 0 O-C-N 121.793 -0.567 . . . . 10.0 111.837 -179.831 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' VAL . . . . . 0.468 ' O ' ' N ' ' A' ' 46' ' ' MET . 75.1 t -64.8 -51.48 66.57 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.953 0 N-CA-C 106.23 -1.767 . . . . 10.0 106.23 178.226 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 32.7 ptt180 -60.81 -21.62 63.32 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 114.022 1.119 . . . . 10.0 114.022 -179.56 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 2.5 tpt180 -69.4 -56.11 8.4 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 103.115 -2.921 . . . . 10.0 103.115 178.431 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -88.14 31.25 0.8 Allowed 'General case' 0 C--N 1.319 -0.752 0 C-N-CA 127.887 2.475 . . . . 10.0 105.352 177.122 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' MET . . . . . 0.468 ' N ' ' O ' ' A' ' 42' ' ' VAL . 1.9 mtm . . . . . 0 C--O 1.253 1.243 0 N-CA-C 118.527 2.788 . . . . 10.0 118.527 -168.357 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 75.5 m . . . . . 0 N--CA 1.486 1.343 0 N-CA-C 111.663 0.246 . . . . 10.0 111.663 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -58.8 -76.09 0.23 Allowed Glycine 0 CA--C 1.521 0.411 0 C-N-CA 120.823 -0.703 . . . . 10.0 114.785 -179.718 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' GLY . . . . . 0.682 ' O ' ' HB2' ' A' ' 7' ' ' ASP . . . -56.55 -52.53 49.69 Favored Glycine 0 C--O 1.227 -0.326 0 C-N-CA 121.211 -0.518 . . . . 10.0 114.318 -179.587 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -63.41 -73.58 0.52 Allowed Glycine 0 CA--C 1.52 0.345 0 C-N-CA 120.57 -0.824 . . . . 10.0 114.777 -179.877 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -58.86 -57.52 19.45 Favored Glycine 0 CA--C 1.518 0.236 0 N-CA-C 117.819 1.888 . . . . 10.0 117.819 -178.457 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 54.7 t -63.51 -55.2 24.27 Favored 'Isoleucine or valine' 0 C--O 1.237 0.429 0 N-CA-C 114.28 1.215 . . . . 10.0 114.28 -178.43 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' ASP . . . . . 0.682 ' HB2' ' O ' ' A' ' 3' ' ' GLY . 3.8 m-20 -59.98 -43.7 94.95 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 112.543 0.571 . . . . 10.0 112.543 -179.08 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 8' ' ' VAL . . . . . 0.462 ' HA ' HG23 ' A' ' 11' ' ' VAL . 39.9 t -64.09 -33.46 62.49 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 N-CA-C 109.379 -0.6 . . . . 10.0 109.379 178.956 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -60.82 -42.04 99.39 Favored Glycine 0 N--CA 1.449 -0.463 0 N-CA-C 108.271 -1.931 . . . . 10.0 108.271 178.596 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -62.27 -35.87 80.32 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 109.206 -0.665 . . . . 10.0 109.206 178.916 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' VAL . . . . . 0.462 HG23 ' HA ' ' A' ' 8' ' ' VAL . 40.6 t -59.1 -47.2 90.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 N-CA-C 109.145 -0.687 . . . . 10.0 109.145 -179.838 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 12' ' ' VAL . . . . . 0.753 ' O ' ' HG3' ' A' ' 16' ' ' GLN . 74.1 t -59.71 -60.05 3.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.739 -0.664 . . . . 10.0 111.668 -179.299 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 74.4 m -60.38 -41.56 94.03 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 114.536 1.309 . . . . 10.0 114.536 -178.675 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -71.54 -43.29 66.69 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 113.532 0.938 . . . . 10.0 113.532 -178.947 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.6 mp -70.34 -56.87 9.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 N-CA-C 114.563 1.32 . . . . 10.0 114.563 -178.681 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' GLN . . . . . 0.753 ' HG3' ' O ' ' A' ' 12' ' ' VAL . 0.0 OUTLIER -72.67 -22.02 60.99 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 119.484 -0.886 . . . . 10.0 110.787 -179.528 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -72.96 -49.28 17.37 Favored Glycine 0 N--CA 1.449 -0.488 0 N-CA-C 110.113 -1.195 . . . . 10.0 110.113 178.561 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ALA . . . . . 0.411 ' O ' ' HD2' ' A' ' 21' ' ' PRO . . . -66.43 -22.86 66.23 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 108.553 -0.906 . . . . 10.0 108.553 179.5 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -74.24 -21.5 59.76 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.916 -0.584 . . . . 10.0 111.467 179.274 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -53.14 -54.03 31.28 Favored Glycine 0 CA--C 1.521 0.444 0 N-CA-C 109.44 -1.464 . . . . 10.0 109.44 179.025 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' PRO . . . . . 0.418 ' O ' ' HB3' ' A' ' 24' ' ' ALA . 1.3 Cg_exo -57.89 -27.03 77.05 Favored 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 121.572 1.514 . . . . 10.0 112.091 179.342 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 1.1 mp -64.24 -42.06 94.31 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.967 0 N-CA-C 106.375 -1.713 . . . . 10.0 106.375 178.265 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.44 -26.05 65.32 Favored 'General case' 0 C--O 1.233 0.19 0 N-CA-C 108.481 -0.933 . . . . 10.0 108.481 179.403 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ALA . . . . . 0.418 ' HB3' ' O ' ' A' ' 21' ' ' PRO . . . -64.4 -38.55 91.41 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 109.251 -0.648 . . . . 10.0 109.251 179.143 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 20.6 mt -61.07 -33.56 56.47 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.102 0 N-CA-C 106.161 -1.792 . . . . 10.0 106.161 178.355 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -59.11 -45.4 95.34 Favored Glycine 0 N--CA 1.452 -0.255 0 CA-C-N 115.597 -0.728 . . . . 10.0 111.562 179.423 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -63.94 -48.98 70.8 Favored Glycine 0 N--CA 1.448 -0.53 0 N-CA-C 110.054 -1.218 . . . . 10.0 110.054 179.025 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.37 -37.66 84.16 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 112.946 0.721 . . . . 10.0 112.946 -179.863 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 9.1 t -66.04 -36.89 78.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 108.683 -0.858 . . . . 10.0 108.683 179.5 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' LEU . . . . . 0.488 ' O ' HG12 ' A' ' 34' ' ' VAL . 24.8 mt -65.15 -37.13 86.42 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.258 -0.883 . . . . 10.0 111.971 179.842 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 72.0 p -58.15 -46.55 85.48 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 121.281 0.562 . . . . 10.0 109.841 -179.722 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 31.4 t -69.86 -54.34 19.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 N-CA-C 114.076 1.139 . . . . 10.0 114.076 -179.558 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 62.8 mtt -53.48 -48.38 68.97 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 115.55 1.685 . . . . 10.0 115.55 -178.503 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' VAL . . . . . 0.488 HG12 ' O ' ' A' ' 30' ' ' LEU . 14.9 p -68.39 -26.45 33.74 Favored 'Isoleucine or valine' 0 C--O 1.238 0.472 0 N-CA-C 107.926 -1.138 . . . . 10.0 107.926 178.269 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 35' ' ' GLY . . . . . 0.716 ' O ' HG12 ' A' ' 38' ' ' VAL . . . -62.76 -50.59 62.63 Favored Glycine 0 CA--C 1.504 -0.643 0 CA-C-N 115.109 -0.951 . . . . 10.0 111.458 -179.495 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ILE . . . . . 0.479 ' O ' ' CD2' ' A' ' 39' ' ' TYR . 0.3 OUTLIER -63.78 -27.25 42.49 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.904 0 C-N-CA 119.465 -0.894 . . . . 10.0 112.886 178.576 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 37' ' ' LYS . . . . . 0.855 ' HG3' ' HB3' ' A' ' 40' ' ' LYS . 9.6 tttt -86.76 -21.28 26.64 Favored 'General case' 0 C--N 1.318 -0.764 0 C-N-CA 116.633 -2.027 . . . . 10.0 115.299 179.022 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 38' ' ' VAL . . . . . 0.716 HG12 ' O ' ' A' ' 35' ' ' GLY . 7.4 p -61.54 -28.17 43.51 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 N-CA-C 101.79 -3.411 . . . . 10.0 101.79 176.297 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 39' ' ' TYR . . . . . 0.479 ' CD2' ' O ' ' A' ' 36' ' ' ILE . 0.0 OUTLIER -71.75 -39.11 70.24 Favored 'General case' 0 C--O 1.241 0.628 0 N-CA-C 107.242 -1.392 . . . . 10.0 107.242 177.692 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 40' ' ' LYS . . . . . 0.855 ' HB3' ' HG3' ' A' ' 37' ' ' LYS . 83.2 tttt -67.83 -39.99 83.83 Favored 'General case' 0 C--O 1.242 0.681 0 N-CA-C 113.135 0.791 . . . . 10.0 113.135 179.358 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 69.0 m95 -75.01 -29.62 60.9 Favored 'General case' 0 C--N 1.328 -0.366 0 O-C-N 121.793 -0.567 . . . . 10.0 111.837 -179.831 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' VAL . . . . . 0.686 HG23 ' O ' ' A' ' 38' ' ' VAL . 75.1 t -64.8 -51.48 66.57 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.953 0 N-CA-C 106.23 -1.767 . . . . 10.0 106.23 178.226 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ARG . . . . . 0.783 ' HE ' ' HA ' ' A' ' 40' ' ' LYS . 32.7 ptt180 -60.81 -21.62 63.32 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 114.022 1.119 . . . . 10.0 114.022 -179.56 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 2.5 tpt180 -69.4 -56.11 8.4 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 103.115 -2.921 . . . . 10.0 103.115 178.431 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -88.14 31.25 0.8 Allowed 'General case' 0 C--N 1.319 -0.752 0 C-N-CA 127.887 2.475 . . . . 10.0 105.352 177.122 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' MET . . . . . 0.504 ' HA ' ' HA ' ' A' ' 43' ' ' ARG . 1.9 mtm . . . . . 0 C--O 1.253 1.243 0 N-CA-C 118.527 2.788 . . . . 10.0 118.527 -168.357 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 75.5 m . . . . . 0 N--CA 1.486 1.343 0 N-CA-C 111.663 0.246 . . . . 10.0 111.663 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -58.8 -76.09 0.23 Allowed Glycine 0 CA--C 1.521 0.411 0 C-N-CA 120.823 -0.703 . . . . 10.0 114.785 -179.718 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' GLY . . . . . 0.682 ' O ' ' HB2' ' A' ' 7' ' ' ASP . . . -56.55 -52.53 49.69 Favored Glycine 0 C--O 1.227 -0.326 0 C-N-CA 121.211 -0.518 . . . . 10.0 114.318 -179.587 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -63.41 -73.58 0.52 Allowed Glycine 0 CA--C 1.52 0.345 0 C-N-CA 120.57 -0.824 . . . . 10.0 114.777 -179.877 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -58.86 -57.52 19.45 Favored Glycine 0 CA--C 1.518 0.236 0 N-CA-C 117.819 1.888 . . . . 10.0 117.819 -178.457 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 54.7 t -63.51 -55.2 24.27 Favored 'Isoleucine or valine' 0 C--O 1.237 0.429 0 N-CA-C 114.28 1.215 . . . . 10.0 114.28 -178.43 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' ASP . . . . . 0.682 ' HB2' ' O ' ' A' ' 3' ' ' GLY . 3.8 m-20 -59.98 -43.7 94.95 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 112.543 0.571 . . . . 10.0 112.543 -179.08 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.462 ' HA ' HG23 ' A' ' 11' ' ' VAL . 39.9 t -64.09 -33.46 62.49 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 N-CA-C 109.379 -0.6 . . . . 10.0 109.379 178.956 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -60.82 -42.04 99.39 Favored Glycine 0 N--CA 1.449 -0.463 0 N-CA-C 108.271 -1.931 . . . . 10.0 108.271 178.596 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -62.27 -35.87 80.32 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 109.206 -0.665 . . . . 10.0 109.206 178.916 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.462 HG23 ' HA ' ' A' ' 8' ' ' VAL . 40.6 t -59.1 -47.2 90.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 N-CA-C 109.145 -0.687 . . . . 10.0 109.145 -179.838 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.753 ' O ' ' HG3' ' A' ' 16' ' ' GLN . 74.1 t -59.71 -60.05 3.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.739 -0.664 . . . . 10.0 111.668 -179.299 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 74.4 m -60.38 -41.56 94.03 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 114.536 1.309 . . . . 10.0 114.536 -178.675 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -71.54 -43.29 66.69 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 113.532 0.938 . . . . 10.0 113.532 -178.947 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.6 mp -70.34 -56.87 9.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 N-CA-C 114.563 1.32 . . . . 10.0 114.563 -178.681 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.753 ' HG3' ' O ' ' A' ' 12' ' ' VAL . 0.0 OUTLIER -72.67 -22.02 60.99 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 119.484 -0.886 . . . . 10.0 110.787 -179.528 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -72.96 -49.28 17.37 Favored Glycine 0 N--CA 1.449 -0.488 0 N-CA-C 110.113 -1.195 . . . . 10.0 110.113 178.561 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.411 ' O ' ' HD2' ' A' ' 21' ' ' PRO . . . -66.43 -22.86 66.23 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 108.553 -0.906 . . . . 10.0 108.553 179.5 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -74.24 -21.5 59.76 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.916 -0.584 . . . . 10.0 111.467 179.274 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -53.14 -54.03 31.28 Favored Glycine 0 CA--C 1.521 0.444 0 N-CA-C 109.44 -1.464 . . . . 10.0 109.44 179.025 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.418 ' O ' ' HB3' ' A' ' 24' ' ' ALA . 1.3 Cg_exo -57.89 -27.03 77.05 Favored 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 121.572 1.514 . . . . 10.0 112.091 179.342 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 1.1 mp -64.24 -42.06 94.31 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.967 0 N-CA-C 106.375 -1.713 . . . . 10.0 106.375 178.265 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.44 -26.05 65.32 Favored 'General case' 0 C--O 1.233 0.19 0 N-CA-C 108.481 -0.933 . . . . 10.0 108.481 179.403 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.418 ' HB3' ' O ' ' A' ' 21' ' ' PRO . . . -64.4 -38.55 91.41 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 109.251 -0.648 . . . . 10.0 109.251 179.143 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 20.6 mt -61.07 -33.56 56.47 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.102 0 N-CA-C 106.161 -1.792 . . . . 10.0 106.161 178.355 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -59.11 -45.4 95.34 Favored Glycine 0 N--CA 1.452 -0.255 0 CA-C-N 115.597 -0.728 . . . . 10.0 111.562 179.423 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -63.94 -48.98 70.8 Favored Glycine 0 N--CA 1.448 -0.53 0 N-CA-C 110.054 -1.218 . . . . 10.0 110.054 179.025 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.37 -37.66 84.16 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 112.946 0.721 . . . . 10.0 112.946 -179.863 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 9.1 t -66.04 -36.89 78.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 108.683 -0.858 . . . . 10.0 108.683 179.5 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.488 ' O ' HG12 ' A' ' 34' ' ' VAL . 24.8 mt -65.15 -37.13 86.42 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.258 -0.883 . . . . 10.0 111.971 179.842 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 72.0 p -58.15 -46.55 85.48 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 121.281 0.562 . . . . 10.0 109.841 -179.722 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 31.4 t -69.86 -54.34 19.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 N-CA-C 114.076 1.139 . . . . 10.0 114.076 -179.558 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' MET . . . . . . . . . . . . . 62.8 mtt -53.48 -48.38 68.97 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 115.55 1.685 . . . . 10.0 115.55 -178.503 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.488 HG12 ' O ' ' A' ' 30' ' ' LEU . 14.9 p -68.39 -26.45 33.74 Favored 'Isoleucine or valine' 0 C--O 1.238 0.472 0 N-CA-C 107.926 -1.138 . . . . 10.0 107.926 178.269 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.716 ' O ' HG12 ' A' ' 38' ' ' VAL . . . -62.76 -50.59 62.63 Favored Glycine 0 CA--C 1.504 -0.643 0 CA-C-N 115.109 -0.951 . . . . 10.0 111.458 -179.495 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.479 ' O ' ' CD2' ' A' ' 39' ' ' TYR . 0.3 OUTLIER -63.78 -27.25 42.49 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.904 0 C-N-CA 119.465 -0.894 . . . . 10.0 112.886 178.576 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.855 ' HG3' ' HB3' ' A' ' 40' ' ' LYS . 9.6 tttt -86.76 -21.28 26.64 Favored 'General case' 0 C--N 1.318 -0.764 0 C-N-CA 116.633 -2.027 . . . . 10.0 115.299 179.022 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.716 HG12 ' O ' ' A' ' 35' ' ' GLY . 7.4 p -61.54 -28.17 43.51 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 N-CA-C 101.79 -3.411 . . . . 10.0 101.79 176.297 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' TYR . . . . . 0.479 ' CD2' ' O ' ' A' ' 36' ' ' ILE . 0.0 OUTLIER -71.75 -39.11 70.24 Favored 'General case' 0 C--O 1.241 0.628 0 N-CA-C 107.242 -1.392 . . . . 10.0 107.242 177.692 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.855 ' HB3' ' HG3' ' A' ' 37' ' ' LYS . 83.2 tttt -67.83 -39.99 83.83 Favored 'General case' 0 C--O 1.242 0.681 0 N-CA-C 113.135 0.791 . . . . 10.0 113.135 179.358 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 69.0 m95 -75.01 -29.62 60.9 Favored 'General case' 0 C--N 1.328 -0.366 0 O-C-N 121.793 -0.567 . . . . 10.0 111.837 -179.831 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.686 HG23 ' O ' ' A' ' 38' ' ' VAL . 75.1 t -64.8 -51.48 66.57 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.953 0 N-CA-C 106.23 -1.767 . . . . 10.0 106.23 178.226 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.783 ' HE ' ' HA ' ' A' ' 40' ' ' LYS . 32.7 ptt180 -60.81 -21.62 63.32 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 114.022 1.119 . . . . 10.0 114.022 -179.56 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 2.5 tpt180 -69.4 -56.11 8.4 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 103.115 -2.921 . . . . 10.0 103.115 178.431 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -88.14 31.25 0.8 Allowed 'General case' 0 C--N 1.319 -0.752 0 C-N-CA 127.887 2.475 . . . . 10.0 105.352 177.122 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' MET . . . . . 0.504 ' HA ' ' HA ' ' A' ' 43' ' ' ARG . 1.9 mtm . . . . . 0 C--O 1.253 1.243 0 N-CA-C 118.527 2.788 . . . . 10.0 118.527 -168.357 . . . . . . . . 1 1 . 1 stop_ save_