data_1abq_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 1abq _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 ' 65' ' ' LEU . . . . . . . . . . . . . 75.4 mt . . . . . 0 N--CA 1.484 1.263 0 N-CA-C 109.446 -0.576 . . . . 38.27 109.446 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -140.63 154.21 46.35 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 104.265 -2.495 . . . . 42.24 104.265 178.028 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -131.21 148.0 32.89 Favored 'Isoleucine or valine' 0 C--O 1.248 0.975 0 N-CA-C 108.195 -1.039 . . . . 32.4 108.195 178.723 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ALA . . . . . 0.402 ' O ' ' N ' ' A' ' 85' ' ' GLY . . . -82.64 130.87 35.19 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 114.711 -1.131 . . . . 23.21 112.974 -179.882 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 34.1 mt -93.61 -28.31 16.09 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 114.204 1.187 . . . . 28.87 114.204 178.915 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 -142.08 165.17 28.17 Favored 'General case' 0 C--N 1.343 0.307 0 N-CA-C 108.61 -0.885 . . . . 36.4 108.61 -179.886 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -82.88 140.52 32.82 Favored 'General case' 0 CA--C 1.507 -0.697 0 O-C-N 124.536 1.148 . . . . 20.62 108.036 179.491 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -133.72 118.2 17.83 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 107.318 -1.364 . . . . 14.86 107.318 -179.73 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 38.7 t -92.82 124.65 45.33 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.532 0 N-CA-C 105.887 -1.894 . . . . 17.88 105.887 178.382 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.6 127.58 32.16 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 112.862 0.69 . . . . 22.16 112.862 179.225 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 11.3 p -109.86 -92.89 0.44 Allowed 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 120.578 -0.449 . . . . 40.26 110.673 179.255 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -122.8 -171.76 13.81 Favored Glycine 0 N--CA 1.451 -0.31 0 N-CA-C 106.85 -2.5 . . . . 48.96 106.85 179.221 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 24.3 t70 65.14 35.32 7.96 Favored 'General case' 0 CA--C 1.557 1.232 0 CA-C-N 117.827 0.813 . . . . 55.15 109.46 179.811 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.2 p30 29.67 64.24 0.14 Allowed 'General case' 0 N--CA 1.475 0.82 0 CA-C-O 122.913 1.339 . . . . 45.4 111.963 -177.337 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -84.91 177.45 7.96 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 112.596 -2.093 . . . . 29.67 107.819 -179.361 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 26.2 tp -127.44 151.35 48.94 Favored 'General case' 0 C--O 1.211 -0.937 0 N-CA-C 106.799 -1.556 . . . . 16.89 106.799 178.881 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 73.6 m -91.96 139.97 30.12 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 121.987 0.899 . . . . 15.87 110.211 177.275 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -140.45 144.87 26.72 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.967 0 CA-C-N 115.985 -0.552 . . . . 21.32 109.995 -176.584 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 3.1 p -112.28 157.59 20.75 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 123.49 0.716 . . . . 27.5 110.199 -179.1 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 36.0 ttpt -60.93 142.9 56.01 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 114.692 1.367 . . . . 44.94 114.692 -178.752 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' GLY . . . . . 0.402 ' N ' ' O ' ' A' ' 68' ' ' ALA . . . 72.25 8.19 69.58 Favored Glycine 0 CA--C 1.529 0.91 0 N-CA-C 114.635 0.614 . . . . 23.74 114.635 -178.61 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -76.28 146.4 38.97 Favored 'General case' 0 CA--C 1.562 1.427 0 N-CA-C 115.246 1.573 . . . . 25.38 115.246 179.948 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 26.7 mmtp -94.71 124.98 39.07 Favored 'General case' 0 C--O 1.242 0.697 0 N-CA-C 108.399 -0.963 . . . . 33.06 108.399 179.644 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -138.07 157.34 46.53 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 114.629 -1.169 . . . . 33.24 108.249 -179.113 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -120.72 121.56 38.51 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 109.245 -0.65 . . . . 35.93 109.245 178.531 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 40.6 t -82.64 128.38 38.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 N-CA-C 115.322 1.601 . . . . 21.78 115.322 -178.535 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 68.4 mt -99.83 -24.04 14.79 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 113.633 0.975 . . . . 24.89 113.633 179.739 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 170.02 173.66 37.59 Favored Glycine 0 C--O 1.213 -1.205 0 C-N-CA 118.931 -1.604 . . . . 16.68 110.598 179.673 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 38.5 m-85 -110.74 -170.88 1.72 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 118.101 0.95 . . . . 34.34 112.316 -177.918 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' ASN . . . . . 0.515 ' O ' ' ND1' ' A' ' 95' ' ' HIS . 3.2 p-10 -108.19 -3.55 18.42 Favored 'General case' 0 N--CA 1.446 -0.657 0 N-CA-C 116.804 2.15 . . . . 28.28 116.804 -178.156 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' HIS . . . . . 0.515 ' ND1' ' O ' ' A' ' 94' ' ' ASN 0.258 4.4 p-80 116.0 -67.68 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 114.363 1.246 . . . . 41.68 114.363 -179.73 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' ASN . . . . . 0.453 ' N ' ' CG ' ' A' ' 95' ' ' HIS . 20.9 p30 -72.35 -7.88 51.96 Favored 'General case' 0 CA--C 1.512 -0.499 0 N-CA-C 107.569 -1.271 . . . . 37.85 107.569 178.54 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 82.62 7.83 86.91 Favored Glycine 0 CA--C 1.525 0.668 0 N-CA-C 117.292 1.677 . . . . 37.01 117.292 178.74 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 88.8 mt-10 -77.07 -19.42 57.11 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 118.193 2.664 . . . . 44.06 118.193 -178.206 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 79.4 m95 -137.15 143.09 42.27 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 113.469 0.914 . . . . 37.63 113.469 -179.294 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 84.5 m -117.91 141.29 48.61 Favored 'General case' 0 C--O 1.215 -0.723 0 N-CA-C 109.572 -0.529 . . . . 40.6 109.572 178.808 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -93.42 112.62 24.57 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 105.592 -2.003 . . . . 29.6 105.592 178.199 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -123.45 170.99 9.81 Favored 'General case' 0 CA--C 1.505 -0.765 0 N-CA-C 116.539 2.052 . . . . 12.16 116.539 -175.534 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -132.59 138.94 47.59 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 105.771 -1.936 . . . . 22.42 105.771 178.56 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 16.6 p -136.5 -166.12 1.84 Allowed 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 104.271 -2.492 . . . . 23.47 104.271 177.469 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 1.7 mpmm? -79.77 2.51 22.66 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 121.868 -0.52 . . . . 39.02 109.957 -179.736 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -115.35 -13.73 11.66 Favored 'General case' 0 CA--C 1.518 -0.277 0 N-CA-C 115.555 1.687 . . . . 35.96 115.555 -178.748 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 155.05 -151.25 22.89 Favored Glycine 0 C--O 1.248 0.999 0 C-N-CA 116.908 -2.568 . . . . 14.74 114.068 -177.87 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 14.7 tt0 -148.61 131.98 16.6 Favored 'General case' 0 N--CA 1.471 0.578 0 O-C-N 125.073 1.102 . . . . 11.09 111.844 -175.279 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 178.11 -179.46 48.47 Favored Glycine 0 C--O 1.223 -0.56 0 C-N-CA 119.958 -1.115 . . . . 11.7 115.698 -179.803 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' TRP . . . . . . . . . . . . . 97.0 m95 -82.42 128.01 33.84 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 113.804 1.038 . . . . 21.66 113.804 -179.047 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 12.7 m -129.41 148.85 70.96 Favored Pre-proline 0 N--CA 1.479 0.98 0 N-CA-C 106.38 -1.711 . . . . 24.92 106.38 178.455 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_exo -60.6 147.24 95.27 Favored 'Trans proline' 0 C--N 1.36 1.152 0 CA-C-N 119.017 0.685 . . . . 25.29 112.71 -179.729 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 79.9 p -62.1 -54.12 45.81 Favored 'General case' 0 C--O 1.261 1.68 0 C-N-CA 124.509 1.123 . . . . 32.14 109.972 -175.344 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 34.1 p30 -69.46 2.77 2.79 Favored 'General case' 0 CA--C 1.55 0.963 0 N-CA-C 116.907 2.188 . . . . 33.32 116.907 -177.348 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -90.13 -13.32 35.95 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 113.254 0.835 . . . . 27.77 113.254 178.853 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 2.2 pt -122.94 161.69 24.04 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 N-CA-C 112.235 0.457 . . . . 35.42 112.235 -178.745 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' THR . . . . . 0.727 ' CG2' ' CG2' ' A' ' 119' ' ' VAL . 5.9 t -130.84 124.37 20.69 Favored Pre-proline 0 C--O 1.243 0.718 0 N-CA-C 114.729 1.381 . . . . 38.68 114.729 178.786 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_endo -58.53 -10.22 8.58 Favored 'Trans proline' 0 C--N 1.356 0.961 0 C-N-CA 124.588 3.526 . . . . 41.33 113.484 179.231 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' VAL . . . . . 0.727 ' CG2' ' CG2' ' A' ' 117' ' ' THR . 32.6 m -68.16 -176.53 0.15 Allowed 'Isoleucine or valine' 0 C--O 1.255 1.346 0 CA-C-O 115.728 -2.082 . . . . 51.05 109.797 173.799 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' ASN . . . . . 0.467 ' CB ' ' O ' ' A' ' 119' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--N 1.291 -1.97 0 O-C-N 125.164 1.54 . . . . 55.81 113.47 179.218 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 1' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 65' ' ' LEU . . . . . 0.827 HD13 ' HD2' ' A' ' 87' ' ' LYS . 75.4 mt . . . . . 0 N--CA 1.484 1.263 0 N-CA-C 109.446 -0.576 . . . . 38.27 109.446 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -140.63 154.21 46.35 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 104.265 -2.495 . . . . 42.24 104.265 178.028 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' VAL . . . . . 0.623 ' HA ' ' O ' ' A' ' 86' ' ' GLU . 0.4 OUTLIER -131.21 148.0 32.89 Favored 'Isoleucine or valine' 0 C--O 1.248 0.975 0 N-CA-C 108.195 -1.039 . . . . 32.4 108.195 178.723 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -82.64 130.87 35.19 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 114.711 -1.131 . . . . 23.21 112.974 -179.882 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 34.1 mt -93.61 -28.31 16.09 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 114.204 1.187 . . . . 28.87 114.204 178.915 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 -142.08 165.17 28.17 Favored 'General case' 0 C--N 1.343 0.307 0 N-CA-C 108.61 -0.885 . . . . 36.4 108.61 -179.886 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -82.88 140.52 32.82 Favored 'General case' 0 CA--C 1.507 -0.697 0 O-C-N 124.536 1.148 . . . . 20.62 108.036 179.491 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -133.72 118.2 17.83 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 107.318 -1.364 . . . . 14.86 107.318 -179.73 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 38.7 t -92.82 124.65 45.33 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.532 0 N-CA-C 105.887 -1.894 . . . . 17.88 105.887 178.382 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.6 127.58 32.16 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 112.862 0.69 . . . . 22.16 112.862 179.225 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 11.3 p -109.86 -92.89 0.44 Allowed 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 120.578 -0.449 . . . . 40.26 110.673 179.255 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' GLY . . . . . 0.406 ' O ' ' HB3' ' A' ' 77' ' ' ASP . . . -122.8 -171.76 13.81 Favored Glycine 0 N--CA 1.451 -0.31 0 N-CA-C 106.85 -2.5 . . . . 48.96 106.85 179.221 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 77' ' ' ASP . . . . . 0.406 ' HB3' ' O ' ' A' ' 76' ' ' GLY . 24.3 t70 65.14 35.32 7.96 Favored 'General case' 0 CA--C 1.557 1.232 0 CA-C-N 117.827 0.813 . . . . 55.15 109.46 179.811 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 5.8 p-10 29.67 64.24 0.14 Allowed 'General case' 0 N--CA 1.475 0.82 0 CA-C-O 122.913 1.339 . . . . 45.4 111.963 -177.337 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -84.91 177.45 7.96 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 112.596 -2.093 . . . . 29.67 107.819 -179.361 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 26.2 tp -127.44 151.35 48.94 Favored 'General case' 0 C--O 1.211 -0.937 0 N-CA-C 106.799 -1.556 . . . . 16.89 106.799 178.881 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' SER . . . . . 0.6 ' O ' HD12 ' A' ' 82' ' ' ILE . 73.6 m -91.96 139.97 30.12 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 121.987 0.899 . . . . 15.87 110.211 177.275 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ILE . . . . . 0.6 HD12 ' O ' ' A' ' 81' ' ' SER . 1.0 OUTLIER -140.45 144.87 26.72 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.967 0 CA-C-N 115.985 -0.552 . . . . 21.32 109.995 -176.584 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 3.1 p -112.28 157.59 20.75 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 123.49 0.716 . . . . 27.5 110.199 -179.1 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 36.0 ttpt -60.93 142.9 56.01 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 114.692 1.367 . . . . 44.94 114.692 -178.752 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 72.25 8.19 69.58 Favored Glycine 0 CA--C 1.529 0.91 0 N-CA-C 114.635 0.614 . . . . 23.74 114.635 -178.61 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' GLU . . . . . 0.623 ' O ' ' HA ' ' A' ' 67' ' ' VAL . 6.4 tt0 -76.28 146.4 38.97 Favored 'General case' 0 CA--C 1.562 1.427 0 N-CA-C 115.246 1.573 . . . . 25.38 115.246 179.948 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 87' ' ' LYS . . . . . 0.827 ' HD2' HD13 ' A' ' 65' ' ' LEU . 26.7 mmtp -94.71 124.98 39.07 Favored 'General case' 0 C--O 1.242 0.697 0 N-CA-C 108.399 -0.963 . . . . 33.06 108.399 179.644 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -138.07 157.34 46.53 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 114.629 -1.169 . . . . 33.24 108.249 -179.113 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 89' ' ' ARG . . . . . 0.572 HH12 ' NZ ' ' A' ' 105' ' ' LYS . 0.4 OUTLIER -120.72 121.56 38.51 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 109.245 -0.65 . . . . 35.93 109.245 178.531 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 40.6 t -82.64 128.38 38.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 N-CA-C 115.322 1.601 . . . . 21.78 115.322 -178.535 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 68.4 mt -99.83 -24.04 14.79 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 113.633 0.975 . . . . 24.89 113.633 179.739 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 170.02 173.66 37.59 Favored Glycine 0 C--O 1.213 -1.205 0 C-N-CA 118.931 -1.604 . . . . 16.68 110.598 179.673 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 38.5 m-85 -110.74 -170.88 1.72 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 118.101 0.95 . . . . 34.34 112.316 -177.918 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' ASN . . . . . 0.507 ' O ' ' ND1' ' A' ' 95' ' ' HIS . 3.2 p-10 -108.19 -3.55 18.42 Favored 'General case' 0 N--CA 1.446 -0.657 0 N-CA-C 116.804 2.15 . . . . 28.28 116.804 -178.156 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 95' ' ' HIS . . . . . 0.507 ' ND1' ' O ' ' A' ' 94' ' ' ASN 0.258 4.4 p-80 116.0 -67.68 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 114.363 1.246 . . . . 41.68 114.363 -179.73 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 96' ' ' ASN . . . . . 0.453 ' N ' ' CG ' ' A' ' 95' ' ' HIS . 20.9 p30 -72.35 -7.88 51.96 Favored 'General case' 0 CA--C 1.512 -0.499 0 N-CA-C 107.569 -1.271 . . . . 37.85 107.569 178.54 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 82.62 7.83 86.91 Favored Glycine 0 CA--C 1.525 0.668 0 N-CA-C 117.292 1.677 . . . . 37.01 117.292 178.74 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 88.8 mt-10 -77.07 -19.42 57.11 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 118.193 2.664 . . . . 44.06 118.193 -178.206 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 79.4 m95 -137.15 143.09 42.27 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 113.469 0.914 . . . . 37.63 113.469 -179.294 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 84.5 m -117.91 141.29 48.61 Favored 'General case' 0 C--O 1.215 -0.723 0 N-CA-C 109.572 -0.529 . . . . 40.6 109.572 178.808 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -93.42 112.62 24.57 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 105.592 -2.003 . . . . 29.6 105.592 178.199 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' ALA . . . . . 0.508 ' O ' ' HA ' ' A' ' 108' ' ' GLN . . . -123.45 170.99 9.81 Favored 'General case' 0 CA--C 1.505 -0.765 0 N-CA-C 116.539 2.052 . . . . 12.16 116.539 -175.534 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -132.59 138.94 47.59 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 105.771 -1.936 . . . . 22.42 105.771 178.56 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 16.6 p -136.5 -166.12 1.84 Allowed 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 104.271 -2.492 . . . . 23.47 104.271 177.469 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' LYS . . . . . 0.572 ' NZ ' HH12 ' A' ' 89' ' ' ARG . 1.7 mpmm? -79.77 2.51 22.66 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 121.868 -0.52 . . . . 39.02 109.957 -179.736 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 82.6 m-20 -115.35 -13.73 11.66 Favored 'General case' 0 CA--C 1.518 -0.277 0 N-CA-C 115.555 1.687 . . . . 35.96 115.555 -178.748 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 155.05 -151.25 22.89 Favored Glycine 0 C--O 1.248 0.999 0 C-N-CA 116.908 -2.568 . . . . 14.74 114.068 -177.87 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' GLN . . . . . 0.508 ' HA ' ' O ' ' A' ' 102' ' ' ALA . 41.6 tt0 -148.61 131.98 16.6 Favored 'General case' 0 N--CA 1.471 0.578 0 O-C-N 125.073 1.102 . . . . 11.09 111.844 -175.279 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 178.11 -179.46 48.47 Favored Glycine 0 C--O 1.223 -0.56 0 C-N-CA 119.958 -1.115 . . . . 11.7 115.698 -179.803 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' TRP . . . . . . . . . . . . . 97.0 m95 -82.42 128.01 33.84 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 113.804 1.038 . . . . 21.66 113.804 -179.047 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 12.7 m -129.41 148.85 70.96 Favored Pre-proline 0 N--CA 1.479 0.98 0 N-CA-C 106.38 -1.711 . . . . 24.92 106.38 178.455 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_exo -60.6 147.24 95.27 Favored 'Trans proline' 0 C--N 1.36 1.152 0 CA-C-N 119.017 0.685 . . . . 25.29 112.71 -179.729 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 79.9 p -62.1 -54.12 45.81 Favored 'General case' 0 C--O 1.261 1.68 0 C-N-CA 124.509 1.123 . . . . 32.14 109.972 -175.344 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' ASN . . . . . 0.598 ' HB2' ' O ' ' A' ' 3' ' ' HOH . 34.1 p30 -69.46 2.77 2.79 Favored 'General case' 0 CA--C 1.55 0.963 0 N-CA-C 116.907 2.188 . . . . 33.32 116.907 -177.348 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -90.13 -13.32 35.95 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 113.254 0.835 . . . . 27.77 113.254 178.853 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 2.2 pt -122.94 161.69 24.04 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 N-CA-C 112.235 0.457 . . . . 35.42 112.235 -178.745 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' THR . . . . . 0.997 HG23 HG22 ' A' ' 119' ' ' VAL . 5.9 t -130.84 124.37 20.69 Favored Pre-proline 0 C--O 1.243 0.718 0 N-CA-C 114.729 1.381 . . . . 38.68 114.729 178.786 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_endo -58.53 -10.22 8.58 Favored 'Trans proline' 0 C--N 1.356 0.961 0 C-N-CA 124.588 3.526 . . . . 41.33 113.484 179.231 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' VAL . . . . . 0.997 HG22 HG23 ' A' ' 117' ' ' THR . 32.6 m -68.16 -176.53 0.15 Allowed 'Isoleucine or valine' 0 C--O 1.255 1.346 0 CA-C-O 115.728 -2.082 . . . . 51.05 109.797 173.799 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 120' ' ' ASN . . . . . 0.467 ' CB ' ' O ' ' A' ' 119' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--N 1.291 -1.97 0 O-C-N 125.164 1.54 . . . . 55.81 113.47 179.218 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 1' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 3' ' ' HOH . . . . . 0.598 ' O ' ' HB2' ' A' ' 114' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 5' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 6' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 7' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 8' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 9' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 10' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 11' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 12' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 13' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 14' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 15' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 16' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 17' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 18' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 19' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 20' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 21' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 22' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 23' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 24' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 25' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 26' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 27' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 28' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 29' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 30' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 31' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 32' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 33' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 34' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 35' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 36' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 37' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 38' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 39' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 40' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 41' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 42' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 43' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 44' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 45' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 46' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.827 HD13 ' HD2' ' A' ' 87' ' ' LYS . 75.4 mt . . . . . 0 N--CA 1.484 1.263 0 N-CA-C 109.446 -0.576 . . . . 38.270000000000003 109.446 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -140.63 154.21 46.35 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 104.265 -2.495 . . . . 42.240000000000002 104.265 178.028 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.623 ' HA ' ' O ' ' A' ' 86' ' ' GLU . 0.4 OUTLIER -131.21 148.0 32.89 Favored 'Isoleucine or valine' 0 C--O 1.248 0.975 0 N-CA-C 108.195 -1.039 . . . . 32.399999999999999 108.195 178.723 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -82.64 130.87 35.19 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 114.711 -1.131 . . . . 23.210000000000001 112.974 -179.882 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 34.1 mt -93.61 -28.31 16.09 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 114.204 1.187 . . . . 28.870000000000001 114.204 178.915 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 -142.08 165.17 28.17 Favored 'General case' 0 C--N 1.343 0.307 0 N-CA-C 108.61 -0.885 . . . . 36.399999999999999 108.61 -179.886 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -82.88 140.52 32.82 Favored 'General case' 0 CA--C 1.507 -0.697 0 O-C-N 124.536 1.148 . . . . 20.620000000000001 108.036 179.491 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -133.72 118.2 17.83 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 107.318 -1.364 . . . . 14.859999999999999 107.318 -179.73 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 38.7 t -92.82 124.65 45.33 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.532 0 N-CA-C 105.887 -1.894 . . . . 17.879999999999999 105.887 178.382 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.6 127.58 32.16 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 112.862 0.69 . . . . 22.16 112.862 179.225 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 11.3 p -109.86 -92.89 0.44 Allowed 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 120.578 -0.449 . . . . 40.259999999999998 110.673 179.255 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' GLY . . . . . 0.406 ' O ' ' HB3' ' A' ' 77' ' ' ASP . . . -122.8 -171.76 13.81 Favored Glycine 0 N--CA 1.451 -0.31 0 N-CA-C 106.85 -2.5 . . . . 48.960000000000001 106.85 179.221 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' ASP . . . . . 0.406 ' HB3' ' O ' ' A' ' 76' ' ' GLY . 24.3 t70 65.14 35.32 7.96 Favored 'General case' 0 CA--C 1.557 1.232 0 CA-C-N 117.827 0.813 . . . . 55.149999999999999 109.46 179.811 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.2 p30 29.67 64.24 0.14 Allowed 'General case' 0 N--CA 1.475 0.82 0 CA-C-O 122.913 1.339 . . . . 45.399999999999999 111.963 -177.337 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -84.91 177.45 7.96 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 112.596 -2.093 . . . . 29.670000000000002 107.819 -179.361 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 26.2 tp -127.44 151.35 48.94 Favored 'General case' 0 C--O 1.211 -0.937 0 N-CA-C 106.799 -1.556 . . . . 16.890000000000001 106.799 178.881 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' SER . . . . . 0.6 ' O ' HD12 ' A' ' 82' ' ' ILE . 73.6 m -91.96 139.97 30.12 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 121.987 0.899 . . . . 15.869999999999999 110.211 177.275 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.6 HD12 ' O ' ' A' ' 81' ' ' SER . 1.0 OUTLIER -140.45 144.87 26.72 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.967 0 CA-C-N 115.985 -0.552 . . . . 21.32 109.995 -176.584 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 3.1 p -112.28 157.59 20.75 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 123.49 0.716 . . . . 27.5 110.199 -179.1 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 36.0 ttpt -60.93 142.9 56.01 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 114.692 1.367 . . . . 44.939999999999998 114.692 -178.752 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 72.25 8.19 69.58 Favored Glycine 0 CA--C 1.529 0.91 0 N-CA-C 114.635 0.614 . . . . 23.739999999999998 114.635 -178.61 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.623 ' O ' ' HA ' ' A' ' 67' ' ' VAL . 6.4 tt0 -76.28 146.4 38.97 Favored 'General case' 0 CA--C 1.562 1.427 0 N-CA-C 115.246 1.573 . . . . 25.379999999999999 115.246 179.948 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.827 ' HD2' HD13 ' A' ' 65' ' ' LEU . 26.7 mmtp -94.71 124.98 39.07 Favored 'General case' 0 C--O 1.242 0.697 0 N-CA-C 108.399 -0.963 . . . . 33.060000000000002 108.399 179.644 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -138.07 157.34 46.53 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 114.629 -1.169 . . . . 33.240000000000002 108.249 -179.113 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' ARG . . . . . 0.572 HH12 ' NZ ' ' A' ' 105' ' ' LYS . 0.4 OUTLIER -120.72 121.56 38.51 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 109.245 -0.65 . . . . 35.93 109.245 178.531 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 40.6 t -82.64 128.38 38.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 N-CA-C 115.322 1.601 . . . . 21.780000000000001 115.322 -178.535 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 68.4 mt -99.83 -24.04 14.79 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 113.633 0.975 . . . . 24.890000000000001 113.633 179.739 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 170.02 173.66 37.59 Favored Glycine 0 C--O 1.213 -1.205 0 C-N-CA 118.931 -1.604 . . . . 16.68 110.598 179.673 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 38.5 m-85 -110.74 -170.88 1.72 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 118.101 0.95 . . . . 34.340000000000003 112.316 -177.918 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' ASN . . . . . 0.507 ' O ' ' ND1' ' A' ' 95' ' ' HIS . 3.2 p-10 -108.19 -3.55 18.42 Favored 'General case' 0 N--CA 1.446 -0.657 0 N-CA-C 116.804 2.15 . . . . 28.280000000000001 116.804 -178.156 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' HIS . . . . . 0.507 ' ND1' ' O ' ' A' ' 94' ' ' ASN 0.258 4.4 p-80 116.0 -67.68 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 114.363 1.246 . . . . 41.68 114.363 -179.73 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' ASN . . . . . 0.453 ' N ' ' CG ' ' A' ' 95' ' ' HIS . 20.9 p30 -72.35 -7.88 51.96 Favored 'General case' 0 CA--C 1.512 -0.499 0 N-CA-C 107.569 -1.271 . . . . 37.850000000000001 107.569 178.54 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 82.62 7.83 86.91 Favored Glycine 0 CA--C 1.525 0.668 0 N-CA-C 117.292 1.677 . . . . 37.009999999999998 117.292 178.74 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 88.8 mt-10 -77.07 -19.42 57.11 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 118.193 2.664 . . . . 44.060000000000002 118.193 -178.206 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 79.4 m95 -137.15 143.09 42.27 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 113.469 0.914 . . . . 37.630000000000003 113.469 -179.294 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 84.5 m -117.91 141.29 48.61 Favored 'General case' 0 C--O 1.215 -0.723 0 N-CA-C 109.572 -0.529 . . . . 40.600000000000001 109.572 178.808 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -93.42 112.62 24.57 Favored 'General case' 0 CA--C 1.514 -0.413 0 N-CA-C 105.592 -2.003 . . . . 29.600000000000001 105.592 178.199 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.508 ' O ' ' HA ' ' A' ' 108' ' ' GLN . . . -123.45 170.99 9.81 Favored 'General case' 0 CA--C 1.505 -0.765 0 N-CA-C 116.539 2.052 . . . . 12.16 116.539 -175.534 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' GLN . . . . . 0.417 HE21 ' NE2' ' A' ' 108' ' ' GLN . 96.1 mt-30 -132.59 138.94 47.59 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 105.771 -1.936 . . . . 22.420000000000002 105.771 178.56 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 16.6 p -136.5 -166.12 1.84 Allowed 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 104.271 -2.492 . . . . 23.469999999999999 104.271 177.469 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' LYS . . . . . 0.572 ' NZ ' HH12 ' A' ' 89' ' ' ARG . 1.7 mpmm? -79.77 2.51 22.66 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 121.868 -0.52 . . . . 39.020000000000003 109.957 -179.736 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -115.35 -13.73 11.66 Favored 'General case' 0 CA--C 1.518 -0.277 0 N-CA-C 115.555 1.687 . . . . 35.960000000000001 115.555 -178.748 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 155.05 -151.25 22.89 Favored Glycine 0 C--O 1.248 0.999 0 C-N-CA 116.908 -2.568 . . . . 14.74 114.068 -177.87 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.508 ' HA ' ' O ' ' A' ' 102' ' ' ALA . 14.7 tt0 -148.61 131.98 16.6 Favored 'General case' 0 N--CA 1.471 0.578 0 O-C-N 125.073 1.102 . . . . 11.09 111.844 -175.279 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 178.11 -179.46 48.47 Favored Glycine 0 C--O 1.223 -0.56 0 C-N-CA 119.958 -1.115 . . . . 11.699999999999999 115.698 -179.803 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' TRP . . . . . . . . . . . . . 97.0 m95 -82.42 128.01 33.84 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 113.804 1.038 . . . . 21.66 113.804 -179.047 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 12.7 m -129.41 148.85 70.96 Favored Pre-proline 0 N--CA 1.479 0.98 0 N-CA-C 106.38 -1.711 . . . . 24.920000000000002 106.38 178.455 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_exo -60.6 147.24 95.27 Favored 'Trans proline' 0 C--N 1.36 1.152 0 CA-C-N 119.017 0.685 . . . . 25.289999999999999 112.71 -179.729 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 79.9 p -62.1 -54.12 45.81 Favored 'General case' 0 C--O 1.261 1.68 0 C-N-CA 124.509 1.123 . . . . 32.140000000000001 109.972 -175.344 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' ASN . . . . . 0.598 ' HB2' ' O ' ' A' ' 3' ' ' HOH . 34.1 p30 -69.46 2.77 2.79 Favored 'General case' 0 CA--C 1.55 0.963 0 N-CA-C 116.907 2.188 . . . . 33.32 116.907 -177.348 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -90.13 -13.32 35.95 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 113.254 0.835 . . . . 27.77 113.254 178.853 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 2.2 pt -122.94 161.69 24.04 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 N-CA-C 112.235 0.457 . . . . 35.420000000000002 112.235 -178.745 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' THR . . . . . 0.997 HG23 HG22 ' A' ' 119' ' ' VAL . 5.9 t -130.84 124.37 20.69 Favored Pre-proline 0 C--O 1.243 0.718 0 N-CA-C 114.729 1.381 . . . . 38.68 114.729 178.786 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_endo -58.53 -10.22 8.58 Favored 'Trans proline' 0 C--N 1.356 0.961 0 C-N-CA 124.588 3.526 . . . . 41.329999999999998 113.484 179.231 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.997 HG22 HG23 ' A' ' 117' ' ' THR . 32.6 m -68.16 -176.53 0.15 Allowed 'Isoleucine or valine' 0 C--O 1.255 1.346 0 CA-C-O 115.728 -2.082 . . . . 51.049999999999997 109.797 173.799 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' ASN . . . . . 0.467 ' CB ' ' O ' ' A' ' 119' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--N 1.291 -1.97 0 O-C-N 125.164 1.54 . . . . 55.810000000000002 113.47 179.218 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' HOH . . . . . 0.598 ' O ' ' HB2' ' A' ' 114' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_