data_6hfx_residue ############################ # Computer software used # ############################ 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 6hfx _Structure_validation_residue.Date_analyzed 2019-04-19 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 ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 24.0 p . . . . . 0 C--O 1.234 0.254 0 CA-C-O 121.077 0.465 . . . . 139.83 110.971 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -91.4 123.52 34.89 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 108.8 -0.815 . . . . 140.31 108.8 174.445 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' ILE . . . . . . . . . . . . . 23.9 mt -118.88 143.05 31.07 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 C-N-CA 123.269 0.628 . . . . 81.23 109.688 -173.01 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -77.2 141.56 40.03 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 108.711 -0.848 . . . . 89.13 108.711 178.033 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -47.64 -40.49 19.85 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.625 -0.716 . . . . 115.7 112.895 -176.583 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' ASN . . . . . . . . . . . . . 19.1 p30 -76.55 -2.47 32.56 Favored 'General case' 0 C--O 1.239 0.545 0 C-N-CA 119.322 -0.951 . . . . 68.42 112.814 -166.973 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' VAL . . . . . . . . . . . . . 2.3 m -130.39 13.22 2.19 Favored 'Isoleucine or valine' 0 C--O 1.242 0.661 0 C-N-CA 119.895 -0.722 . . . . 63.8 110.046 177.286 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 3.2 ptt180 -94.19 127.6 40.12 Favored 'General case' 0 C--O 1.238 0.461 0 N-CA-C 110.07 -0.344 . . . . 106.23 110.07 178.593 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 22.0 t -115.75 138.51 45.94 Favored 'Isoleucine or valine' 0 C--O 1.237 0.396 0 N-CA-C 107.967 -1.123 . . . . 56.6 107.967 165.355 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' VAL . . . . . . . . . . . . . 20.9 t -111.06 122.11 64.94 Favored 'Isoleucine or valine' 0 C--O 1.242 0.699 0 N-CA-C 107.891 -1.152 . . . . 52.42 107.891 175.212 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' VAL . . . . . . . . . . . . . 70.8 t -108.49 103.68 15.87 Favored 'Isoleucine or valine' 0 C--O 1.236 0.372 0 N-CA-C 107.635 -1.246 . . . . 56.26 107.635 -178.495 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 87.9 m-85 -83.72 142.23 30.87 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.881 0.372 . . . . 56.31 110.399 179.68 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 38.0 mt -104.22 143.31 16.09 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 CA-C-N 115.618 -0.719 . . . . 68.0 109.645 -170.713 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -54.77 136.9 45.8 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.93 -0.577 . . . . 76.85 110.047 176.455 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 90.2 mttt -60.88 -17.97 53.51 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 112.955 0.724 . . . . 67.6 112.955 -178.527 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.14 -2.66 52.34 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 113.406 0.891 . . . . 110.14 113.406 -175.267 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -119.74 130.86 73.62 Favored 'Isoleucine or valine' 0 C--O 1.235 0.339 0 N-CA-C 108.944 -0.762 . . . . 72.91 108.944 -175.679 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -109.65 86.5 2.31 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.563 0.697 . . . . 98.82 109.187 -173.476 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' ASP . . . . . 0.44 ' OD2' ' OH ' ' B' ' 137' ' ' TYR . 8.3 t70 -78.26 -24.36 46.89 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 113.254 0.835 . . . . 51.65 113.254 -170.585 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 31.3 t30 -98.09 -8.09 28.4 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 114.511 1.3 . . . . 66.9 114.511 -171.926 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' SER . . . . . . . . . . . . . 62.3 m -95.23 123.39 38.71 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 119.234 0.925 . . . . 78.38 109.934 -175.762 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.27 -31.94 69.53 Favored 'General case' 0 C--O 1.24 0.602 0 C-N-CA 119.002 -1.079 . . . . 104.5 111.18 176.902 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' THR . . . . . 0.468 ' CA ' ' O ' ' B' ' 201' ' ' HOH . 29.6 p -113.8 152.7 30.25 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 124.45 1.1 . . . . 71.62 111.238 -176.644 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' ILE . . . . . . . . . . . . . 15.9 pt -137.87 179.86 3.16 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.751 0 N-CA-C 107.38 -1.341 . . . . 62.55 107.38 171.327 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -107.25 131.6 54.01 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 109.708 -0.479 . . . . 54.1 109.708 -177.036 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 17.8 tptm -145.12 122.71 11.77 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 107.421 -1.325 . . . . 120.92 107.421 177.887 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 73.4 mm-40 54.98 32.04 17.25 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 120.926 0.394 . . . . 95.85 111.548 179.311 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . 83.47 -9.12 62.55 Favored Glycine 0 N--CA 1.44 -1.043 0 O-C-N 121.328 -0.858 . . . . 53.13 115.211 176.967 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' GLN . . . . . . . . . . . . . 27.8 mm-40 -99.75 150.21 22.55 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 108.003 -1.11 . . . . 73.39 108.003 176.178 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -85.67 113.8 22.16 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 107.883 -1.155 . . . . 64.36 107.883 170.843 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' VAL . . . . . . . . . . . . . 27.0 m -123.36 178.62 3.2 Favored 'Isoleucine or valine' 0 C--O 1.235 0.3 0 CA-C-N 116.619 -0.264 . . . . 69.98 110.48 -178.856 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 15.4 p -74.56 144.46 44.0 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 121.49 0.662 . . . . 77.64 111.539 -170.585 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 40.7 t-20 -89.87 112.07 23.3 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.13 -0.941 . . . . 73.23 109.211 178.581 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 13.5 m-20 -55.49 -50.77 69.05 Favored 'General case' 0 C--O 1.239 0.531 0 CA-C-O 120.945 0.402 . . . . 120.49 111.19 178.562 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 42.6 m-20 -70.96 5.37 2.05 Favored 'General case' 0 CA--C 1.512 -0.493 0 C-N-CA 124.42 1.088 . . . . 87.41 113.299 -171.472 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' TYR . . . . . . . . . . . . . 56.9 t80 -62.16 127.44 31.36 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 118.959 0.8 . . . . 64.83 110.312 -169.208 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 60.29 27.03 16.55 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 113.295 0.85 . . . . 58.69 113.295 173.003 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 42.0 mmtt -69.84 -53.52 17.73 Favored 'General case' 0 C--O 1.238 0.481 0 C-N-CA 118.113 -1.435 . . . . 77.9 110.483 172.111 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 72.0 t -62.73 -44.18 99.27 Favored 'Isoleucine or valine' 0 C--O 1.24 0.603 0 C-N-CA 119.679 -0.808 . . . . 58.87 110.318 178.146 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' TYR . . . . . . . . . . . . . 67.7 t80 -52.16 -50.68 61.32 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 120.342 -0.543 . . . . 49.7 111.445 173.818 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 94.6 m-20 -57.05 -52.7 64.21 Favored 'General case' 0 C--O 1.238 0.489 0 C-N-CA 120.183 -0.607 . . . . 71.92 111.271 -178.637 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' SER . . . . . . . . . . . . . 24.6 m -53.31 -47.12 69.52 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 120.131 -0.628 . . . . 66.83 110.693 -179.065 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 86.6 mt -64.74 -50.31 67.38 Favored 'General case' 0 C--O 1.239 0.515 0 C-N-CA 120.233 -0.587 . . . . 60.39 111.477 -176.9 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' LYS . . . . . . . . . . . . . 15.9 tptm -64.54 -17.66 64.14 Favored 'General case' 0 C--O 1.238 0.49 0 O-C-N 122.202 -0.311 . . . . 71.74 111.72 -176.792 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 44.4 m-20 -78.49 -32.76 48.36 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 118.075 -1.45 . . . . 105.32 112.389 178.018 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' MET . . . . . . . . . . . . . 47.4 mtt -46.71 131.23 11.62 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 119.767 -0.773 . . . . 72.62 110.772 178.601 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' SER . . . . . . . . . . . . . 6.2 p -69.19 -22.68 63.88 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 112.94 0.719 . . . . 84.98 112.94 -177.631 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 99' ' ' THR . . . . . . . . . . . . . 18.0 p -86.89 1.6 51.99 Favored 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 112.969 0.729 . . . . 66.65 112.969 176.92 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 100' ' ' VAL . . . . . . . . . . . . . 43.2 t -100.82 138.35 25.36 Favored 'Isoleucine or valine' 0 C--O 1.239 0.511 0 CA-C-N 119.556 1.071 . . . . 65.18 109.363 -178.742 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 78.5 tttt -104.61 -39.79 6.25 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 124.11 0.964 . . . . 98.42 113.143 -179.709 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 54.8 p -152.0 154.34 35.81 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 118.759 0.709 . . . . 55.47 110.37 174.928 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 21.8 t -137.62 109.21 6.19 Favored 'Isoleucine or valine' 0 C--O 1.239 0.502 0 N-CA-C 107.334 -1.358 . . . . 43.41 107.334 -178.597 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' THR . . . . . . . . . . . . . 69.8 m -114.58 132.38 56.36 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 110.082 -0.34 . . . . 46.94 110.082 -171.614 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -79.06 136.62 37.22 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 109.548 -0.538 . . . . 69.63 109.548 -179.12 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 18.2 t -130.12 102.72 6.36 Favored 'General case' 0 C--O 1.237 0.43 0 N-CA-C 107.214 -1.402 . . . . 62.57 107.214 175.442 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 24.6 p -77.2 145.22 37.75 Favored 'General case' 0 CA--C 1.515 -0.391 0 O-C-N 123.615 0.572 . . . . 65.73 110.783 -173.363 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 17.2 pttm -58.11 -32.12 67.8 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.976 -0.556 . . . . 74.46 111.15 -174.034 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' GLU . . . . . . . . . . . . . 27.0 mp0 -66.13 -36.47 83.22 Favored 'General case' 0 C--O 1.239 0.505 0 C-N-CA 120.262 -0.575 . . . . 77.16 111.228 175.833 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -61.77 -49.32 76.83 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-O 120.819 0.343 . . . . 113.69 111.247 174.378 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -68.32 -23.21 64.7 Favored 'General case' 0 C--O 1.24 0.578 0 C-N-CA 119.321 -0.952 . . . . 74.6 111.714 -178.046 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 112' ' ' TYR . . . . . . . . . . . . . 27.7 t80 -72.35 -38.33 68.6 Favored 'General case' 0 C--O 1.241 0.625 0 C-N-CA 119.908 -0.717 . . . . 93.35 110.167 -177.386 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 80.5 mt-10 -72.41 -34.52 67.92 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.884 -0.326 . . . . 126.52 111.089 172.938 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 15.7 tptm -70.32 -38.45 74.92 Favored 'General case' 0 C--O 1.24 0.596 0 C-N-CA 120.599 -0.44 . . . . 120.98 110.804 175.607 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 34.1 tp -60.42 -44.12 96.07 Favored 'General case' 0 C--O 1.24 0.585 0 C-N-CA 120.252 -0.579 . . . . 75.65 111.298 173.887 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 98.4 m -63.68 -39.41 94.26 Favored 'General case' 0 C--O 1.237 0.44 0 C-N-CA 120.399 -0.52 . . . . 102.11 110.77 177.102 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -55.9 -51.78 66.39 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 120.701 -0.4 . . . . 94.33 111.325 175.508 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 118' ' ' ILE . . . . . . . . . . . . . 6.8 mt -66.27 132.39 31.78 Favored 'Isoleucine or valine' 0 C--O 1.239 0.512 0 N-CA-C 107.851 -1.166 . . . . 74.09 107.851 171.734 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 119' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -34.28 134.59 0.19 Allowed 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 113.726 1.01 . . . . 102.09 113.726 -158.616 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 140.23 116.99 1.37 Allowed Glycine 0 N--CA 1.445 -0.756 0 C-N-CA 125.078 1.323 . . . . 100.86 111.305 -179.102 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 4.6 p30 -136.03 -31.52 0.91 Allowed 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 112.581 0.586 . . . . 132.72 112.581 170.762 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 122' ' ' ASN . . . . . 0.465 ' O ' ' CG ' ' B' ' 122' ' ' ASN . 1.7 t30 -78.37 19.53 0.46 Allowed 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 129.428 3.091 . . . . 144.98 111.307 174.775 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 123' ' ' TRP . . . . . . . . . . . . . 11.1 m0 -77.59 24.48 0.21 Allowed 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 108.169 -1.049 . . . . 130.9 108.169 -179.877 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 12.0 mttp -34.74 -49.21 0.41 Allowed 'General case' 0 C--O 1.237 0.433 0 C-N-CA 122.991 0.516 . . . . 125.85 111.157 -178.417 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 125' ' ' ILE . . . . . . . . . . . . . 1.8 pt -61.28 -11.69 5.07 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.132 0 N-CA-C 112.475 0.546 . . . . 118.65 112.475 -173.707 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 126' ' ' PHE . . . . . . . . . . . . . 12.2 m-85 -108.46 -36.3 6.26 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 114.095 1.146 . . . . 166.52 114.095 174.647 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 127' ' ' GLU . . . . . . . . . . . . . 87.8 mt-10 -81.93 161.41 23.09 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.45 0.643 . . . . 132.29 110.267 -172.232 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 128' ' ' GLY . . . . . . . . . . . . . . . 72.38 -18.41 1.27 Allowed Glycine 0 C--N 1.336 0.558 0 CA-C-O 122.864 1.258 . . . . 120.79 111.366 179.409 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -100.29 56.44 0.92 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 113.638 -1.281 . . . . 114.69 109.849 -178.422 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . 65.71 84.4 0.15 Allowed 'General case' 0 C--O 1.234 0.285 0 N-CA-C 114.679 1.363 . . . . 88.9 114.679 171.34 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 131' ' ' ASN . . . . . . . . . . . . . 30.6 t-20 -33.64 117.67 0.47 Allowed Pre-proline 0 C--O 1.236 0.361 0 C-N-CA 123.918 0.887 . . . . 86.48 112.305 177.709 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 132' ' ' PRO . . . . . 0.437 ' CB ' ' O ' ' B' ' 203' ' ' HOH . 90.3 Cg_endo -96.67 7.5 1.56 Allowed 'Trans proline' 0 C--N 1.33 -0.415 0 C-N-CA 122.103 1.869 . . . . 74.35 115.356 -174.48 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 63.6 mt -81.36 172.12 13.95 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-O 121.992 0.901 . . . . 73.29 111.57 -177.533 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 134' ' ' TYR . . . . . . . . . . . . . 31.2 m-85 -120.45 136.52 54.72 Favored 'General case' 0 C--O 1.236 0.385 0 O-C-N 121.652 -0.655 . . . . 69.77 111.522 -174.555 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 81.1 m-20 -54.12 138.54 37.7 Favored 'General case' 0 C--N 1.34 0.164 0 O-C-N 123.71 0.631 . . . . 51.31 110.363 164.263 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 136' ' ' ALA . . . . . . . . . . . . . . . -137.61 156.72 47.75 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 109.329 -0.619 . . . . 44.38 109.329 -175.711 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 137' ' ' TYR . . . . . 0.44 ' OH ' ' OD2' ' B' ' 70' ' ' ASP . 32.0 m-85 -109.28 122.49 47.44 Favored 'General case' 0 C--O 1.238 0.487 0 N-CA-C 107.86 -1.163 . . . . 45.13 107.86 163.027 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 138' ' ' ILE . . . . . . . . . . . . . 3.5 mp -92.47 114.63 29.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 N-CA-C 106.84 -1.541 . . . . 57.01 106.84 172.746 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 139' ' ' VAL . . . . . . . . . . . . . 39.7 t -111.78 137.22 45.32 Favored 'Isoleucine or valine' 0 C--O 1.239 0.537 0 C-N-CA 124.44 1.096 . . . . 52.66 108.4 -170.122 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -108.95 126.9 53.58 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 109.339 -0.615 . . . . 77.16 109.339 177.425 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -85.18 156.76 20.87 Favored 'General case' 0 C--N 1.342 0.245 0 CA-C-O 121.429 0.633 . . . . 46.6 110.692 175.61 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 142' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -71.75 -32.05 67.3 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 119.789 -0.765 . . . . 68.73 111.073 177.357 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -143.14 148.61 45.57 Favored Pre-proline 0 C--O 1.238 0.484 0 N-CA-C 107.697 -1.223 . . . . 72.77 107.697 179.679 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 144' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_exo -60.48 -27.9 85.71 Favored 'Trans proline' 0 CA--C 1.513 -0.561 0 C-N-CA 118.156 -0.763 . . . . 73.73 111.48 176.882 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 145' ' ' ASN . . . . . . . . . . . . . 76.1 m-20 -54.38 -28.22 41.76 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 120.702 -0.399 . . . . 91.8 111.838 177.976 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 146' ' ' ASP . . . . . 0.501 ' O ' ' CG2' ' B' ' 149' ' ' THR . 27.3 m-20 -83.04 -17.02 44.75 Favored 'General case' 0 CA--C 1.514 -0.434 0 N-CA-C 112.935 0.717 . . . . 83.08 112.935 -176.522 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 147' ' ' VAL . . . . . . . . . . . . . 38.5 t -52.84 -52.56 27.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 C-N-CA 119.293 -0.963 . . . . 85.25 110.341 -167.278 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 4.2 mmpt? -66.51 -34.67 78.44 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 118.646 -1.222 . . . . 103.23 112.326 -179.371 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 149' ' ' THR . . . . . 0.501 ' CG2' ' O ' ' B' ' 146' ' ' ASP . 4.4 t -64.43 -17.81 64.15 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 112.76 0.652 . . . . 102.2 112.76 173.394 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 150' ' ' ILE . . . . . . . . . . . . . 11.5 mt -95.86 -38.92 9.01 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 N-CA-C 108.567 -0.901 . . . . 79.53 108.567 -176.788 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 151' ' ' ALA . . . . . . . . . . . . . . . -68.72 -39.33 80.47 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 120.612 -0.435 . . . . 73.16 111.185 -174.298 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 152' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -61.14 -51.8 67.55 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 118.545 -1.262 . . . . 121.36 109.642 178.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 31.1 m-20 -54.17 -47.41 72.01 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 120.651 0.262 . . . . 89.69 111.539 179.018 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -54.95 -37.78 66.91 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.168 -0.613 . . . . 68.66 111.101 -178.639 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 155' ' ' LYS . . . . . . . . . . . . . 28.5 ttpt -73.77 -5.05 38.38 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 119.676 -0.81 . . . . 103.15 112.399 -177.215 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 156' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -87.18 -30.76 20.77 Favored 'General case' 0 CA--C 1.519 -0.232 0 N-CA-C 112.776 0.658 . . . . 104.25 112.776 172.404 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 53.5 mt -65.68 117.29 6.12 Favored 'Isoleucine or valine' 0 C--O 1.238 0.491 0 N-CA-C 109.41 -0.589 . . . . 84.16 109.41 -172.901 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 158' ' ' GLU . . . . . 0.613 ' N ' ' O ' ' B' ' 202' ' ' HOH . 0.0 OUTLIER -59.34 139.75 56.73 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 120.162 -0.615 . . . . 129.94 110.526 -177.58 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 159' ' ' GLY . . . . . . . . . . . . . . . 102.07 -21.21 42.55 Favored Glycine 0 N--CA 1.445 -0.714 0 CA-C-O 119.39 -0.672 . . . . 78.71 114.494 -167.12 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 72.5 t -81.92 130.66 35.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 118.052 0.926 . . . . 62.06 109.569 176.519 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 28.7 t -89.84 -53.44 4.5 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 123.128 0.571 . . . . 72.4 110.894 177.299 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 67.4 mm-40 -150.01 170.25 19.3 Favored 'General case' 0 C--O 1.239 0.511 0 CA-C-O 120.952 0.406 . . . . 98.44 110.022 178.4 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 163' ' ' VAL . . . . . 0.4 ' O ' ' CG2' ' B' ' 163' ' ' VAL . 4.3 m -147.95 115.63 1.02 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.485 0 C-N-CA 123.092 0.557 . . . . 70.74 111.39 -175.62 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 49.8 tt0 -86.64 116.37 24.71 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 123.979 0.912 . . . . 69.11 109.293 176.504 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 165' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 . . . . . 0 C--N 1.328 -0.362 0 CA-C-O 121.432 0.634 . . . . 88.56 111.47 -175.814 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 18.9 p . . . . . 0 C--O 1.231 0.1 0 N-CA-C 111.88 0.326 . . . . 147.35 111.88 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ASP . . . . . 0.486 ' N ' ' OD1' ' A' ' 53' ' ' ASP . 0.4 OUTLIER -85.26 96.99 9.68 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 107.959 -1.126 . . . . 134.68 107.959 177.465 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 29.6 mt -118.94 143.57 29.69 Favored 'Isoleucine or valine' 0 C--O 1.237 0.429 0 N-CA-C 108.372 -0.973 . . . . 86.0 108.372 -179.958 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -103.14 147.73 26.64 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 120.327 -0.549 . . . . 110.73 110.974 -174.551 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -47.0 -41.64 16.7 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 115.075 -0.966 . . . . 121.31 111.159 -169.589 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 9.9 p-10 -76.62 -4.43 42.96 Favored 'General case' 0 C--O 1.238 0.486 0 N-CA-C 114.725 1.38 . . . . 91.61 114.725 -166.682 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 3.1 m -129.47 10.35 2.5 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.071 0 CA-C-N 119.018 0.826 . . . . 64.75 109.015 -179.841 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.1 tmm_? -105.39 120.77 42.43 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 122.857 0.463 . . . . 125.71 110.059 -171.969 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 59.6 t -110.32 136.15 47.2 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.29 0 N-CA-C 106.173 -1.788 . . . . 63.78 106.173 171.806 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 31.0 t -107.57 122.06 61.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 N-CA-C 107.025 -1.472 . . . . 61.54 107.025 175.53 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 63.8 t -111.43 112.55 41.04 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 N-CA-C 108.455 -0.943 . . . . 60.23 108.455 -177.267 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 57.5 m-85 -88.73 137.69 32.09 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.992 -0.549 . . . . 63.27 110.445 -174.753 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 46.9 mt -102.26 128.0 55.32 Favored 'Isoleucine or valine' 0 C--O 1.239 0.54 0 C-N-CA 123.964 0.905 . . . . 59.96 108.709 -171.261 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 11.7 mtm-85 -48.05 142.79 4.84 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 121.214 0.53 . . . . 117.11 110.581 175.334 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 86.0 mttt -71.29 -17.37 62.47 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-N 115.759 -0.655 . . . . 160.19 112.425 -170.158 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -93.7 8.17 41.97 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 112.754 0.65 . . . . 94.84 112.754 -178.256 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -126.05 128.56 71.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 N-CA-C 107.865 -1.161 . . . . 81.15 107.865 -177.049 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 -107.48 74.77 0.98 Allowed 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 108.214 -1.032 . . . . 106.17 108.214 -173.515 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' ASP . . . . . 0.455 ' OD2' ' OH ' ' A' ' 137' ' ' TYR . 11.3 t70 -70.88 -21.03 62.45 Favored 'General case' 0 N--CA 1.492 1.648 0 CA-C-O 117.068 -1.444 . . . . 56.59 114.6 -173.625 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 46.8 t30 -101.74 -8.4 21.75 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 119.518 1.054 . . . . 66.56 113.332 -176.81 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 13.3 m -91.43 124.77 35.86 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 120.01 1.277 . . . . 71.44 109.941 -177.039 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -65.33 -38.24 89.55 Favored 'General case' 0 CA--C 1.516 -0.338 0 C-N-CA 120.236 -0.586 . . . . 88.9 111.244 175.613 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 76.4 p -118.92 150.24 40.22 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 123.286 0.635 . . . . 61.96 109.818 -172.052 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 24.0 pt -129.67 173.26 14.35 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 N-CA-C 107.888 -1.153 . . . . 48.05 107.888 169.617 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 5.0 tm-20 -97.82 129.23 44.82 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 108.748 -0.834 . . . . 53.38 108.748 178.666 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 22.4 tptm -144.23 129.37 18.66 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 107.931 -1.137 . . . . 131.39 107.931 173.19 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 58.1 mm-40 59.76 22.61 11.47 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.494 0.553 . . . . 81.62 112.494 176.771 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 89.91 -7.27 82.04 Favored Glycine 0 N--CA 1.437 -1.275 0 CA-C-O 118.622 -1.099 . . . . 53.2 115.528 -176.191 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 1.9 mm100 -109.65 153.01 24.84 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 119.4 1.6 . . . . 88.22 110.589 -178.701 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' THR . . . . . 0.453 ' N ' ' O ' ' A' ' 304' ' ' HOH . 69.4 m -78.75 114.15 17.43 Favored 'General case' 0 CA--C 1.514 -0.414 0 N-CA-C 108.177 -1.046 . . . . 73.82 108.177 171.427 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 4.2 m -124.95 170.87 14.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 N-CA-C 108.725 -0.842 . . . . 59.82 108.725 -178.141 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 1.2 p -63.93 144.02 57.4 Favored 'General case' 0 CA--C 1.514 -0.406 0 CA-C-N 114.614 -1.175 . . . . 90.04 109.68 -179.884 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ASN . . . . . 0.414 ' OD1' ' C ' ' A' ' 84' ' ' ASN . 10.2 t-20 -96.1 102.72 14.55 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 108.562 -0.903 . . . . 69.92 108.562 173.321 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 33.3 m-20 -52.35 -29.17 22.47 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 112.901 0.704 . . . . 110.14 112.901 178.964 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 67.7 m-20 -86.02 5.65 32.44 Favored 'General case' 0 C--O 1.239 0.537 0 N-CA-C 113.754 1.02 . . . . 89.68 113.754 -176.488 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 64.4 t80 -59.88 127.52 32.33 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 118.545 0.612 . . . . 71.84 110.976 -171.494 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 61.16 20.58 11.09 Favored 'General case' 0 C--O 1.236 0.342 0 N-CA-C 113.643 0.979 . . . . 52.84 113.643 172.183 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 17.6 mmtm -61.11 -53.46 56.72 Favored 'General case' 0 C--O 1.24 0.573 0 O-C-N 119.941 -1.724 . . . . 93.84 110.965 168.088 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 99.6 t -63.14 -48.08 89.44 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.343 0 C-N-CA 119.67 -0.812 . . . . 46.14 109.986 178.143 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 77.4 t80 -50.98 -50.37 58.44 Favored 'General case' 0 C--O 1.233 0.21 0 C-N-CA 120.531 -0.468 . . . . 48.12 110.607 178.708 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 99.9 m-20 -54.78 -50.37 68.64 Favored 'General case' 0 C--O 1.241 0.625 0 CA-C-O 121.104 0.478 . . . . 60.22 111.551 179.078 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 16.9 m -55.94 -48.39 75.84 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 119.376 -0.93 . . . . 59.81 110.781 -178.814 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 86.3 mt -60.45 -45.52 93.38 Favored 'General case' 0 C--O 1.242 0.664 0 CA-C-O 121.617 0.722 . . . . 53.0 110.722 179.643 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 2.7 tptp -72.98 -23.31 60.64 Favored 'General case' 0 C--N 1.321 -0.657 0 C-N-CA 120.107 -0.637 . . . . 60.15 111.73 -169.533 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 54.4 m-20 -78.93 -15.35 58.42 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 118.993 -1.083 . . . . 102.47 113.071 -178.479 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 62.0 mtp -63.64 137.34 58.06 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 119.73 -0.788 . . . . 77.3 109.624 -178.285 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 29.1 t -63.91 -26.22 68.5 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.453 -0.794 . . . . 77.79 112.284 -173.523 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 18.0 p -96.69 2.3 51.93 Favored 'General case' 0 C--O 1.239 0.53 0 N-CA-C 113.244 0.831 . . . . 71.17 113.244 -171.143 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 42.7 t -101.48 140.12 20.94 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.161 0 C-N-CA 124.753 1.221 . . . . 47.74 108.597 -176.48 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 38.8 tttm -112.11 -35.11 5.74 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 115.324 1.601 . . . . 88.11 115.324 -177.678 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' SER . . . . . 0.406 ' OG ' ' O ' ' A' ' 301' ' ' HOH . 83.7 p -150.39 148.24 28.54 Favored 'General case' 0 C--O 1.239 0.544 0 N-CA-C 107.394 -1.335 . . . . 44.69 107.394 175.271 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 43.7 t -134.15 110.37 13.67 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 N-CA-C 105.303 -2.11 . . . . 42.1 105.303 -179.466 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 17.9 m -116.12 127.66 55.02 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 122.599 0.36 . . . . 41.17 111.576 -173.107 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 35.7 t80 -66.61 139.42 57.89 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 119.618 -0.833 . . . . 49.09 111.347 175.765 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 10.9 t -136.15 95.67 3.24 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 106.714 -1.588 . . . . 52.13 106.714 175.395 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 1.5 p -50.93 161.66 0.35 Allowed 'General case' 0 C--O 1.236 0.392 0 C-N-CA 123.399 0.68 . . . . 55.86 112.761 179.568 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 23.8 pttm -69.85 -34.29 73.42 Favored 'General case' 0 C--O 1.246 0.892 0 C-N-CA 118.574 -1.25 . . . . 68.96 111.455 173.015 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 12.7 mp0 -52.08 -54.0 35.54 Favored 'General case' 0 C--O 1.247 0.95 0 CA-C-O 121.938 0.875 . . . . 68.51 110.684 173.835 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -59.44 -45.49 91.43 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 115.33 -0.85 . . . . 102.69 111.255 -177.945 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 -57.53 -39.45 76.62 Favored 'General case' 0 C--O 1.245 0.833 0 C-N-CA 119.208 -0.997 . . . . 89.41 109.697 -177.212 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 62.6 t80 -70.97 -41.63 70.77 Favored 'General case' 0 C--O 1.241 0.647 0 CA-C-N 115.761 -0.654 . . . . 65.9 112.018 -179.181 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 74.1 mt-10 -62.57 -41.07 98.7 Favored 'General case' 0 CA--C 1.516 -0.328 0 C-N-CA 117.345 -1.742 . . . . 96.47 110.026 179.73 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.72 -38.53 91.47 Favored 'General case' 0 C--O 1.238 0.473 0 C-N-CA 120.84 -0.344 . . . . 101.36 111.698 178.85 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 20.3 tp -64.8 -42.31 95.13 Favored 'General case' 0 C--O 1.246 0.906 0 N-CA-C 112.448 0.536 . . . . 75.26 112.448 177.845 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 72.2 p -65.04 -39.9 94.01 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 119.983 -0.687 . . . . 53.05 111.474 173.277 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -62.61 -31.87 72.78 Favored 'General case' 0 C--O 1.236 0.361 0 O-C-N 122.07 -0.394 . . . . 85.48 111.034 179.132 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 64.5 mt -85.51 -32.71 7.26 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.991 0 N-CA-C 113.325 0.861 . . . . 61.93 113.325 -178.919 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 11.3 mtp -110.66 2.91 18.85 Favored 'General case' 0 C--N 1.348 0.53 0 N-CA-C 114.674 1.361 . . . . 86.36 114.674 -166.813 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 120.93 -21.03 8.46 Favored Glycine 0 N--CA 1.449 -0.475 0 N-CA-C 116.138 1.215 . . . . 93.19 116.138 153.377 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -172.14 172.03 4.73 Favored 'General case' 0 CA--C 1.51 -0.58 0 N-CA-C 107.413 -1.328 . . . . 123.61 107.413 -178.849 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -77.32 143.28 38.91 Favored 'General case' 0 C--O 1.24 0.575 0 CA-C-N 115.041 -0.982 . . . . 114.73 110.98 -179.403 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' TRP . . . . . 0.411 ' O ' ' C ' ' A' ' 124' ' ' LYS . 0.1 OUTLIER -77.67 69.02 3.85 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-N 115.78 -0.646 . . . . 81.74 110.158 172.195 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' LYS . . . . . 0.411 ' C ' ' O ' ' A' ' 123' ' ' TRP . 3.9 mppt? -35.25 -51.97 0.59 Allowed 'General case' 0 CA--C 1.511 -0.553 0 C-N-CA 123.76 0.824 . . . . 85.34 110.488 -171.164 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 8.7 pt -73.24 -18.26 18.02 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.699 0 C-N-CA 118.659 -1.216 . . . . 57.4 111.617 -157.895 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -89.44 -15.55 32.92 Favored 'General case' 0 C--O 1.242 0.681 0 N-CA-C 113.516 0.932 . . . . 62.29 113.516 177.689 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' GLU . . . . . 0.412 ' O ' ' O49' ' A' ' 201' ' ' DMU . 74.5 mt-10 -71.9 -10.9 60.44 Favored 'General case' 0 C--O 1.234 0.263 0 N-CA-C 113.831 1.048 . . . . 89.93 113.831 -163.736 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -77.21 -20.83 74.7 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 118.997 -1.573 . . . . 74.14 115.021 171.328 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 42.0 m-20 -109.79 -176.16 2.93 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 118.771 1.286 . . . . 66.49 111.719 -171.016 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -73.98 143.64 45.53 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.552 -0.749 . . . . 65.01 109.863 -170.368 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 40.5 t-20 -74.72 118.88 73.69 Favored Pre-proline 0 C--O 1.237 0.406 0 N-CA-C 108.117 -1.068 . . . . 66.61 108.117 -179.329 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -92.57 4.05 3.57 Favored 'Trans proline' 0 C--O 1.238 0.493 0 N-CA-C 114.759 1.023 . . . . 62.21 114.759 -174.558 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 49.6 mt -65.12 164.13 13.65 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 122.229 1.014 . . . . 78.6 111.027 166.299 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 88.0 m-85 -103.27 134.24 47.01 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.563 -0.744 . . . . 120.3 110.153 174.674 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 91.2 m-20 -42.15 138.16 1.71 Allowed 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 107.215 -1.402 . . . . 67.32 107.215 154.306 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -133.67 162.42 31.99 Favored 'General case' 0 C--N 1.345 0.402 0 CA-C-O 121.671 0.748 . . . . 55.06 111.129 178.074 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' TYR . . . . . 0.455 ' OH ' ' OD2' ' A' ' 70' ' ' ASP . 45.9 m-85 -110.6 127.38 55.21 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 107.043 -1.465 . . . . 48.85 107.043 164.851 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' ILE . . . . . . . . . . . . . 18.2 mm -89.32 109.0 19.79 Favored 'Isoleucine or valine' 0 C--O 1.235 0.341 0 N-CA-C 107.398 -1.334 . . . . 44.09 107.398 172.805 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' VAL . . . . . . . . . . . . . 1.4 m -105.83 138.61 30.26 Favored 'Isoleucine or valine' 0 C--O 1.24 0.585 0 CA-C-O 121.547 0.689 . . . . 55.08 109.936 -178.81 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 60.2 tt0 -101.67 125.94 48.42 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 108.592 -0.892 . . . . 62.78 108.592 175.179 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -84.23 154.5 22.99 Favored 'General case' 0 CA--C 1.531 0.239 0 O-C-N 123.312 0.383 . . . . 52.83 110.175 173.356 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 88.8 m-20 -66.4 -36.93 84.08 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 119.948 -0.701 . . . . 76.81 111.928 178.416 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -150.42 159.84 34.05 Favored Pre-proline 0 C--N 1.327 -0.373 0 N-CA-C 108.553 -0.906 . . . . 66.71 108.553 174.539 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_exo -56.14 -38.46 94.85 Favored 'Trans proline' 0 C--O 1.236 0.394 0 N-CA-C 113.565 0.564 . . . . 76.66 113.565 -173.718 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 97.3 m-20 -67.42 -1.17 4.4 Favored 'General case' 0 C--N 1.334 -0.089 0 N-CA-C 113.309 0.855 . . . . 82.26 113.309 179.886 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 75.9 m-20 -89.93 -26.36 20.46 Favored 'General case' 0 C--O 1.243 0.742 0 CA-C-N 119.209 0.913 . . . . 75.7 112.386 168.18 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 43.0 t -46.28 -56.92 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.318 0 CA-C-O 121.323 0.582 . . . . 70.76 110.75 -168.136 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 9.3 mmpt? -62.62 -41.63 99.11 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 118.959 -1.096 . . . . 119.74 111.65 -171.968 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 13.5 t -61.3 -34.13 74.72 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 118.529 -1.268 . . . . 88.92 110.622 177.026 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 7.0 mt -67.6 -45.64 84.58 Favored 'Isoleucine or valine' 0 C--O 1.241 0.62 0 C-N-CA 120.216 -0.594 . . . . 63.42 109.746 175.181 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -61.23 -42.61 98.91 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 117.86 -1.536 . . . . 70.1 110.245 -175.016 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 80.4 mt-10 -54.78 -58.14 8.75 Favored 'General case' 0 C--O 1.241 0.644 0 CA-C-O 121.293 0.568 . . . . 116.03 110.325 176.149 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 72.9 m-20 -58.03 -45.31 87.16 Favored 'General case' 0 C--O 1.238 0.477 0 C-N-CA 119.67 -0.812 . . . . 81.33 110.488 -173.639 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -56.99 -35.42 69.17 Favored 'General case' 0 C--O 1.232 0.181 0 C-N-CA 120.474 -0.49 . . . . 68.42 112.154 -177.571 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 37.9 tttt -74.31 -6.66 49.32 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 116.032 -2.267 . . . . 110.65 111.94 -173.437 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 28.4 mtpt -93.2 -15.15 26.24 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 113.751 1.019 . . . . 112.51 113.751 179.372 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' ILE . . . . . . . . . . . . . 41.1 mt -67.49 120.76 15.39 Favored 'Isoleucine or valine' 0 C--O 1.239 0.501 0 N-CA-C 109.127 -0.694 . . . . 72.86 109.127 177.105 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 23.4 tp10 -61.08 142.15 56.88 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 118.03 -1.468 . . . . 102.88 109.832 179.284 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . 89.41 -9.24 77.76 Favored Glycine 0 N--CA 1.438 -1.198 0 C-N-CA 119.406 -1.378 . . . . 61.71 114.804 -170.984 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 160' ' ' VAL . . . . . . . . . . . . . 12.8 t -86.62 122.87 39.29 Favored 'Isoleucine or valine' 0 C--O 1.239 0.549 0 N-CA-C 107.163 -1.421 . . . . 67.79 107.163 169.821 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 16.2 t -85.83 -55.02 4.16 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.167 -0.47 . . . . 86.1 111.259 178.15 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 23.1 mm-40 -135.63 172.4 13.07 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.725 0.774 . . . . 115.85 110.082 -173.774 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 163' ' ' VAL . . . . . . . . . . . . . 54.3 t -143.73 115.07 2.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 N-CA-C 108.451 -0.944 . . . . 81.23 108.451 175.585 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 40.7 tt0 -95.26 95.85 8.78 Favored 'General case' 0 C--O 1.238 0.469 0 N-CA-C 109.157 -0.682 . . . . 89.75 109.157 179.527 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.327 -0.408 0 CA-C-N 115.768 -0.651 . . . . 110.31 112.695 -178.378 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' DMU . . . . . 0.412 ' O49' ' O ' ' A' ' 127' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 201' ' ' HOH . . . . . 0.468 ' O ' ' CA ' ' B' ' 74' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 202' ' ' HOH . . . . . 0.613 ' O ' ' N ' ' B' ' 158' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 203' ' ' HOH . . . . . 0.437 ' O ' ' CB ' ' B' ' 132' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 301' ' ' HOH . . . . . 0.406 ' O ' ' OG ' ' A' ' 102' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 304' ' ' HOH . . . . . 0.453 ' O ' ' N ' ' A' ' 81' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 24.0 p . . . . . 0 C--O 1.234 0.254 0 CA-C-O 121.077 0.465 . . . . 139.83 110.971 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -91.4 123.52 34.89 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 108.8 -0.815 . . . . 140.31 108.8 174.445 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 54' ' ' ILE . . . . . . . . . . . . . 23.9 mt -118.88 143.05 31.07 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 C-N-CA 123.269 0.628 . . . . 81.23 109.688 -173.01 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 55' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -77.2 141.56 40.03 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 108.711 -0.848 . . . . 89.13 108.711 178.033 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 56' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -47.64 -40.49 19.85 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.625 -0.716 . . . . 115.7 112.895 -176.583 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 57' ' ' ASN . . . . . . . . . . . . . 19.1 p30 -76.55 -2.47 32.56 Favored 'General case' 0 C--O 1.239 0.545 0 C-N-CA 119.322 -0.951 . . . . 68.42 112.814 -166.973 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 58' ' ' VAL . . . . . 0.415 ' O ' HG23 ' B' ' 58' ' ' VAL . 2.3 m -130.39 13.22 2.19 Favored 'Isoleucine or valine' 0 C--O 1.242 0.661 0 C-N-CA 119.895 -0.722 . . . . 63.8 110.046 177.286 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 3.2 ptt180 -94.19 127.6 40.12 Favored 'General case' 0 C--O 1.238 0.461 0 N-CA-C 110.07 -0.344 . . . . 106.23 110.07 178.593 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 60' ' ' VAL . . . . . 0.48 HG22 HG13 ' B' ' 147' ' ' VAL . 22.0 t -115.75 138.51 45.94 Favored 'Isoleucine or valine' 0 C--O 1.237 0.396 0 N-CA-C 107.967 -1.123 . . . . 56.6 107.967 165.355 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 61' ' ' VAL . . . . . . . . . . . . . 20.9 t -111.06 122.11 64.94 Favored 'Isoleucine or valine' 0 C--O 1.242 0.699 0 N-CA-C 107.891 -1.152 . . . . 52.42 107.891 175.212 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 62' ' ' VAL . . . . . . . . . . . . . 70.8 t -108.49 103.68 15.87 Favored 'Isoleucine or valine' 0 C--O 1.236 0.372 0 N-CA-C 107.635 -1.246 . . . . 56.26 107.635 -178.495 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 87.9 m-85 -83.72 142.23 30.87 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.881 0.372 . . . . 56.31 110.399 179.68 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 38.0 mt -104.22 143.31 16.09 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 CA-C-N 115.618 -0.719 . . . . 68.0 109.645 -170.713 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 65' ' ' ARG . . . . . 0.748 ' HB3' HG12 ' B' ' 68' ' ' VAL . 0.5 OUTLIER -54.77 136.9 45.8 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.93 -0.577 . . . . 76.85 110.047 176.455 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 66' ' ' LYS . . . . . 0.459 ' HE3' ' CE2' ' B' ' 134' ' ' TYR . 90.2 mttt -60.88 -17.97 53.51 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 112.955 0.724 . . . . 67.6 112.955 -178.527 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 67' ' ' ASP . . . . . 0.731 ' OD1' ' HG3' ' B' ' 65' ' ' ARG . 0.3 OUTLIER -94.14 -2.66 52.34 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 113.406 0.891 . . . . 110.14 113.406 -175.267 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 68' ' ' VAL . . . . . 0.748 HG12 ' HB3' ' B' ' 65' ' ' ARG . 0.2 OUTLIER -119.74 130.86 73.62 Favored 'Isoleucine or valine' 0 C--O 1.235 0.339 0 N-CA-C 108.944 -0.762 . . . . 72.91 108.944 -175.679 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 69' ' ' GLU . . . . . 0.434 ' HG3' ' HB2' ' B' ' 72' ' ' SER . 15.6 tp10 -109.65 86.5 2.31 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.563 0.697 . . . . 98.82 109.187 -173.476 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -78.26 -24.36 46.89 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 113.254 0.835 . . . . 51.65 113.254 -170.585 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 31.3 t30 -98.09 -8.09 28.4 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 114.511 1.3 . . . . 66.9 114.511 -171.926 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 72' ' ' SER . . . . . 0.434 ' HB2' ' HG3' ' B' ' 69' ' ' GLU . 62.3 m -95.23 123.39 38.71 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 119.234 0.925 . . . . 78.38 109.934 -175.762 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 73' ' ' GLN . . . . . 0.633 ' NE2' HG22 ' A' ' 83' ' ' THR . 0.0 OUTLIER -70.27 -31.94 69.53 Favored 'General case' 0 C--O 1.24 0.602 0 C-N-CA 119.002 -1.079 . . . . 104.5 111.18 176.902 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 74' ' ' THR . . . . . 0.734 ' HA ' ' O ' ' B' ' 201' ' ' HOH . 29.6 p -113.8 152.7 30.25 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 124.45 1.1 . . . . 71.62 111.238 -176.644 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 75' ' ' ILE . . . . . . . . . . . . . 15.9 pt -137.87 179.86 3.16 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.751 0 N-CA-C 107.38 -1.341 . . . . 62.55 107.38 171.327 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -107.25 131.6 54.01 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 109.708 -0.479 . . . . 54.1 109.708 -177.036 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 17.8 tptm -145.12 122.71 11.77 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 107.421 -1.325 . . . . 120.92 107.421 177.887 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 73.4 mm-40 54.98 32.04 17.25 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 120.926 0.394 . . . . 95.85 111.548 179.311 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . 83.47 -9.12 62.55 Favored Glycine 0 N--CA 1.44 -1.043 0 O-C-N 121.328 -0.858 . . . . 53.13 115.211 176.967 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 80' ' ' GLN . . . . . . . . . . . . . 27.8 mm-40 -99.75 150.21 22.55 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 108.003 -1.11 . . . . 73.39 108.003 176.178 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -85.67 113.8 22.16 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 107.883 -1.155 . . . . 64.36 107.883 170.843 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 82' ' ' VAL . . . . . . . . . . . . . 27.0 m -123.36 178.62 3.2 Favored 'Isoleucine or valine' 0 C--O 1.235 0.3 0 CA-C-N 116.619 -0.264 . . . . 69.98 110.48 -178.856 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 83' ' ' THR . . . . . 0.759 ' HA ' ' O ' ' B' ' 201' ' ' HOH . 15.4 p -74.56 144.46 44.0 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 121.49 0.662 . . . . 77.64 111.539 -170.585 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 40.7 t-20 -89.87 112.07 23.3 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.13 -0.941 . . . . 73.23 109.211 178.581 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 13.5 m-20 -55.49 -50.77 69.05 Favored 'General case' 0 C--O 1.239 0.531 0 CA-C-O 120.945 0.402 . . . . 120.49 111.19 178.562 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 42.6 m-20 -70.96 5.37 2.05 Favored 'General case' 0 CA--C 1.512 -0.493 0 C-N-CA 124.42 1.088 . . . . 87.41 113.299 -171.472 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 87' ' ' TYR . . . . . 0.693 ' OH ' HG21 ' A' ' 83' ' ' THR . 56.9 t80 -62.16 127.44 31.36 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 118.959 0.8 . . . . 64.83 110.312 -169.208 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 88' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 60.29 27.03 16.55 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 113.295 0.85 . . . . 58.69 113.295 173.003 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 42.0 mmtt -69.84 -53.52 17.73 Favored 'General case' 0 C--O 1.238 0.481 0 C-N-CA 118.113 -1.435 . . . . 77.9 110.483 172.111 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 72.0 t -62.73 -44.18 99.27 Favored 'Isoleucine or valine' 0 C--O 1.24 0.603 0 C-N-CA 119.679 -0.808 . . . . 58.87 110.318 178.146 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 91' ' ' TYR . . . . . . . . . . . . . 67.7 t80 -52.16 -50.68 61.32 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 120.342 -0.543 . . . . 49.7 111.445 173.818 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 94.6 m-20 -57.05 -52.7 64.21 Favored 'General case' 0 C--O 1.238 0.489 0 C-N-CA 120.183 -0.607 . . . . 71.92 111.271 -178.637 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 93' ' ' SER . . . . . . . . . . . . . 24.6 m -53.31 -47.12 69.52 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 120.131 -0.628 . . . . 66.83 110.693 -179.065 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 86.6 mt -64.74 -50.31 67.38 Favored 'General case' 0 C--O 1.239 0.515 0 C-N-CA 120.233 -0.587 . . . . 60.39 111.477 -176.9 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 95' ' ' LYS . . . . . . . . . . . . . 15.9 tptm -64.54 -17.66 64.14 Favored 'General case' 0 C--O 1.238 0.49 0 O-C-N 122.202 -0.311 . . . . 71.74 111.72 -176.792 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 44.4 m-20 -78.49 -32.76 48.36 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 118.075 -1.45 . . . . 105.32 112.389 178.018 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 97' ' ' MET . . . . . 0.631 ' HB2' HG23 ' B' ' 100' ' ' VAL . 47.4 mtt -46.71 131.23 11.62 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 119.767 -0.773 . . . . 72.62 110.772 178.601 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 98' ' ' SER . . . . . . . . . . . . . 6.2 p -69.19 -22.68 63.88 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 112.94 0.719 . . . . 84.98 112.94 -177.631 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 99' ' ' THR . . . . . . . . . . . . . 18.0 p -86.89 1.6 51.99 Favored 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 112.969 0.729 . . . . 66.65 112.969 176.92 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 100' ' ' VAL . . . . . 0.631 HG23 ' HB2' ' B' ' 97' ' ' MET . 43.2 t -100.82 138.35 25.36 Favored 'Isoleucine or valine' 0 C--O 1.239 0.511 0 CA-C-N 119.556 1.071 . . . . 65.18 109.363 -178.742 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 78.5 tttt -104.61 -39.79 6.25 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 124.11 0.964 . . . . 98.42 113.143 -179.709 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 54.8 p -152.0 154.34 35.81 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 118.759 0.709 . . . . 55.47 110.37 174.928 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 21.8 t -137.62 109.21 6.19 Favored 'Isoleucine or valine' 0 C--O 1.239 0.502 0 N-CA-C 107.334 -1.358 . . . . 43.41 107.334 -178.597 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 104' ' ' THR . . . . . . . . . . . . . 69.8 m -114.58 132.38 56.36 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 110.082 -0.34 . . . . 46.94 110.082 -171.614 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 105' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -79.06 136.62 37.22 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 109.548 -0.538 . . . . 69.63 109.548 -179.12 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 18.2 t -130.12 102.72 6.36 Favored 'General case' 0 C--O 1.237 0.43 0 N-CA-C 107.214 -1.402 . . . . 62.57 107.214 175.442 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 24.6 p -77.2 145.22 37.75 Favored 'General case' 0 CA--C 1.515 -0.391 0 O-C-N 123.615 0.572 . . . . 65.73 110.783 -173.363 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 17.2 pttm -58.11 -32.12 67.8 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.976 -0.556 . . . . 74.46 111.15 -174.034 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 109' ' ' GLU . . . . . . . . . . . . . 27.0 mp0 -66.13 -36.47 83.22 Favored 'General case' 0 C--O 1.239 0.505 0 C-N-CA 120.262 -0.575 . . . . 77.16 111.228 175.833 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -61.77 -49.32 76.83 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-O 120.819 0.343 . . . . 113.69 111.247 174.378 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 111' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -68.32 -23.21 64.7 Favored 'General case' 0 C--O 1.24 0.578 0 C-N-CA 119.321 -0.952 . . . . 74.6 111.714 -178.046 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 112' ' ' TYR . . . . . 0.7 ' OH ' ' HA ' ' B' ' 127' ' ' GLU . 27.7 t80 -72.35 -38.33 68.6 Favored 'General case' 0 C--O 1.241 0.625 0 C-N-CA 119.908 -0.717 . . . . 93.35 110.167 -177.386 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 80.5 mt-10 -72.41 -34.52 67.92 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.884 -0.326 . . . . 126.52 111.089 172.938 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 114' ' ' LYS . . . . . 0.796 ' HE3' ' OE1' ' B' ' 117' ' ' GLU . 15.7 tptm -70.32 -38.45 74.92 Favored 'General case' 0 C--O 1.24 0.596 0 C-N-CA 120.599 -0.44 . . . . 120.98 110.804 175.607 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 115' ' ' LEU . . . . . 0.448 HD12 ' HA ' ' B' ' 115' ' ' LEU . 34.1 tp -60.42 -44.12 96.07 Favored 'General case' 0 C--O 1.24 0.585 0 C-N-CA 120.252 -0.579 . . . . 75.65 111.298 173.887 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 98.4 m -63.68 -39.41 94.26 Favored 'General case' 0 C--O 1.237 0.44 0 C-N-CA 120.399 -0.52 . . . . 102.11 110.77 177.102 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 117' ' ' GLU . . . . . 0.796 ' OE1' ' HE3' ' B' ' 114' ' ' LYS . 29.2 tt0 -55.9 -51.78 66.39 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 120.701 -0.4 . . . . 94.33 111.325 175.508 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 118' ' ' ILE . . . . . . . . . . . . . 6.8 mt -66.27 132.39 31.78 Favored 'Isoleucine or valine' 0 C--O 1.239 0.512 0 N-CA-C 107.851 -1.166 . . . . 74.09 107.851 171.734 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 119' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -34.28 134.59 0.19 Allowed 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 113.726 1.01 . . . . 102.09 113.726 -158.616 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 140.23 116.99 1.37 Allowed Glycine 0 N--CA 1.445 -0.756 0 C-N-CA 125.078 1.323 . . . . 100.86 111.305 -179.102 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 4.6 p30 -136.03 -31.52 0.91 Allowed 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 112.581 0.586 . . . . 132.72 112.581 170.762 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 122' ' ' ASN . . . . . 0.484 ' C ' ' H ' ' B' ' 124' ' ' LYS . 1.7 t30 -78.37 19.53 0.46 Allowed 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 129.428 3.091 . . . . 144.98 111.307 174.775 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 123' ' ' TRP . . . . . . . . . . . . . 11.1 m0 -77.59 24.48 0.21 Allowed 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 108.169 -1.049 . . . . 130.9 108.169 -179.877 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 124' ' ' LYS . . . . . 0.484 ' H ' ' C ' ' B' ' 122' ' ' ASN . 12.0 mttp -34.74 -49.21 0.41 Allowed 'General case' 0 C--O 1.237 0.433 0 C-N-CA 122.991 0.516 . . . . 125.85 111.157 -178.417 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 125' ' ' ILE . . . . . . . . . . . . . 1.8 pt -61.28 -11.69 5.07 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.132 0 N-CA-C 112.475 0.546 . . . . 118.65 112.475 -173.707 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 126' ' ' PHE . . . . . . . . . . . . . 12.2 m-85 -108.46 -36.3 6.26 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 114.095 1.146 . . . . 166.52 114.095 174.647 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 127' ' ' GLU . . . . . 0.7 ' HA ' ' OH ' ' B' ' 112' ' ' TYR . 87.8 mt-10 -81.93 161.41 23.09 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.45 0.643 . . . . 132.29 110.267 -172.232 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 128' ' ' GLY . . . . . . . . . . . . . . . 72.38 -18.41 1.27 Allowed Glycine 0 C--N 1.336 0.558 0 CA-C-O 122.864 1.258 . . . . 120.79 111.366 179.409 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 129' ' ' ASP . . . . . 0.531 ' H ' ' C ' ' B' ' 127' ' ' GLU . 5.5 t70 -100.29 56.44 0.92 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 113.638 -1.281 . . . . 114.69 109.849 -178.422 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . 65.71 84.4 0.15 Allowed 'General case' 0 C--O 1.234 0.285 0 N-CA-C 114.679 1.363 . . . . 88.9 114.679 171.34 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 131' ' ' ASN . . . . . . . . . . . . . 30.6 t-20 -33.64 117.67 0.47 Allowed Pre-proline 0 C--O 1.236 0.361 0 C-N-CA 123.918 0.887 . . . . 86.48 112.305 177.709 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 132' ' ' PRO . . . . . 0.54 ' HB2' ' O ' ' B' ' 203' ' ' HOH . 90.3 Cg_endo -96.67 7.5 1.56 Allowed 'Trans proline' 0 C--N 1.33 -0.415 0 C-N-CA 122.103 1.869 . . . . 74.35 115.356 -174.48 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 63.6 mt -81.36 172.12 13.95 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-O 121.992 0.901 . . . . 73.29 111.57 -177.533 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 134' ' ' TYR . . . . . 0.459 ' CE2' ' HE3' ' B' ' 66' ' ' LYS . 31.2 m-85 -120.45 136.52 54.72 Favored 'General case' 0 C--O 1.236 0.385 0 O-C-N 121.652 -0.655 . . . . 69.77 111.522 -174.555 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 81.1 m-20 -54.12 138.54 37.7 Favored 'General case' 0 C--N 1.34 0.164 0 O-C-N 123.71 0.631 . . . . 51.31 110.363 164.263 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 136' ' ' ALA . . . . . . . . . . . . . . . -137.61 156.72 47.75 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 109.329 -0.619 . . . . 44.38 109.329 -175.711 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 32.0 m-85 -109.28 122.49 47.44 Favored 'General case' 0 C--O 1.238 0.487 0 N-CA-C 107.86 -1.163 . . . . 45.13 107.86 163.027 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 138' ' ' ILE . . . . . . . . . . . . . 3.5 mp -92.47 114.63 29.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 N-CA-C 106.84 -1.541 . . . . 57.01 106.84 172.746 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 139' ' ' VAL . . . . . . . . . . . . . 39.7 t -111.78 137.22 45.32 Favored 'Isoleucine or valine' 0 C--O 1.239 0.537 0 C-N-CA 124.44 1.096 . . . . 52.66 108.4 -170.122 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -108.95 126.9 53.58 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 109.339 -0.615 . . . . 77.16 109.339 177.425 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -85.18 156.76 20.87 Favored 'General case' 0 C--N 1.342 0.245 0 CA-C-O 121.429 0.633 . . . . 46.6 110.692 175.61 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 142' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -71.75 -32.05 67.3 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 119.789 -0.765 . . . . 68.73 111.073 177.357 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -143.14 148.61 45.57 Favored Pre-proline 0 C--O 1.238 0.484 0 N-CA-C 107.697 -1.223 . . . . 72.77 107.697 179.679 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 144' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_exo -60.48 -27.9 85.71 Favored 'Trans proline' 0 CA--C 1.513 -0.561 0 C-N-CA 118.156 -0.763 . . . . 73.73 111.48 176.882 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 145' ' ' ASN . . . . . . . . . . . . . 76.1 m-20 -54.38 -28.22 41.76 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 120.702 -0.399 . . . . 91.8 111.838 177.976 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 146' ' ' ASP . . . . . 0.877 ' O ' HG22 ' B' ' 149' ' ' THR . 27.3 m-20 -83.04 -17.02 44.75 Favored 'General case' 0 CA--C 1.514 -0.434 0 N-CA-C 112.935 0.717 . . . . 83.08 112.935 -176.522 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 147' ' ' VAL . . . . . 0.48 HG13 HG22 ' B' ' 60' ' ' VAL . 38.5 t -52.84 -52.56 27.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 C-N-CA 119.293 -0.963 . . . . 85.25 110.341 -167.278 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 148' ' ' LYS . . . . . 0.805 ' HA ' ' HE2' ' B' ' 148' ' ' LYS . 4.2 mmpt? -66.51 -34.67 78.44 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 118.646 -1.222 . . . . 103.23 112.326 -179.371 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 149' ' ' THR . . . . . 0.877 HG22 ' O ' ' B' ' 146' ' ' ASP . 4.4 t -64.43 -17.81 64.15 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 112.76 0.652 . . . . 102.2 112.76 173.394 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 150' ' ' ILE . . . . . . . . . . . . . 11.5 mt -95.86 -38.92 9.01 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 N-CA-C 108.567 -0.901 . . . . 79.53 108.567 -176.788 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 151' ' ' ALA . . . . . . . . . . . . . . . -68.72 -39.33 80.47 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 120.612 -0.435 . . . . 73.16 111.185 -174.298 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 152' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -61.14 -51.8 67.55 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 118.545 -1.262 . . . . 121.36 109.642 178.921 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 31.1 m-20 -54.17 -47.41 72.01 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 120.651 0.262 . . . . 89.69 111.539 179.018 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -54.95 -37.78 66.91 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.168 -0.613 . . . . 68.66 111.101 -178.639 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 155' ' ' LYS . . . . . . . . . . . . . 28.5 ttpt -73.77 -5.05 38.38 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 119.676 -0.81 . . . . 103.15 112.399 -177.215 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 156' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -87.18 -30.76 20.77 Favored 'General case' 0 CA--C 1.519 -0.232 0 N-CA-C 112.776 0.658 . . . . 104.25 112.776 172.404 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 53.5 mt -65.68 117.29 6.12 Favored 'Isoleucine or valine' 0 C--O 1.238 0.491 0 N-CA-C 109.41 -0.589 . . . . 84.16 109.41 -172.901 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 158' ' ' GLU . . . . . 0.715 ' HA ' ' OE1' ' B' ' 158' ' ' GLU . 0.0 OUTLIER -59.34 139.75 56.73 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 120.162 -0.615 . . . . 129.94 110.526 -177.58 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 159' ' ' GLY . . . . . . . . . . . . . . . 102.07 -21.21 42.55 Favored Glycine 0 N--CA 1.445 -0.714 0 CA-C-O 119.39 -0.672 . . . . 78.71 114.494 -167.12 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 72.5 t -81.92 130.66 35.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 118.052 0.926 . . . . 62.06 109.569 176.519 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 28.7 t -89.84 -53.44 4.5 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 123.128 0.571 . . . . 72.4 110.894 177.299 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 67.4 mm-40 -150.01 170.25 19.3 Favored 'General case' 0 C--O 1.239 0.511 0 CA-C-O 120.952 0.406 . . . . 98.44 110.022 178.4 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 163' ' ' VAL . . . . . 0.51 ' O ' HG23 ' B' ' 163' ' ' VAL . 4.3 m -147.95 115.63 1.02 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.485 0 C-N-CA 123.092 0.557 . . . . 70.74 111.39 -175.62 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 49.8 tt0 -86.64 116.37 24.71 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 123.979 0.912 . . . . 69.11 109.293 176.504 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 165' ' ' ASP . . . . . 0.524 ' CB ' ' HE3' ' B' ' 148' ' ' LYS . 9.9 p-10 . . . . . 0 C--N 1.328 -0.362 0 CA-C-O 121.432 0.634 . . . . 88.56 111.47 -175.814 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 18.9 p . . . . . 0 C--O 1.231 0.1 0 N-CA-C 111.88 0.326 . . . . 147.35 111.88 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ASP . . . . . 0.486 ' N ' ' OD1' ' A' ' 53' ' ' ASP . 0.4 OUTLIER -85.26 96.99 9.68 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 107.959 -1.126 . . . . 134.68 107.959 177.465 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 29.6 mt -118.94 143.57 29.69 Favored 'Isoleucine or valine' 0 C--O 1.237 0.429 0 N-CA-C 108.372 -0.973 . . . . 86.0 108.372 -179.958 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -103.14 147.73 26.64 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 120.327 -0.549 . . . . 110.73 110.974 -174.551 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ASN . . . . . 0.459 ' HA ' ' CZ ' ' A' ' 59' ' ' ARG . 6.3 t30 -47.0 -41.64 16.7 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 115.075 -0.966 . . . . 121.31 111.159 -169.589 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ASN . . . . . 0.524 ' H ' ' ND2' ' A' ' 57' ' ' ASN . 2.2 p30 -76.62 -4.43 42.96 Favored 'General case' 0 C--O 1.238 0.486 0 N-CA-C 114.725 1.38 . . . . 91.61 114.725 -166.682 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 58' ' ' VAL . . . . . 0.408 HG13 ' OD1' ' A' ' 57' ' ' ASN . 3.1 m -129.47 10.35 2.5 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.071 0 CA-C-N 119.018 0.826 . . . . 64.75 109.015 -179.841 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 59' ' ' ARG . . . . . 0.459 ' CZ ' ' HA ' ' A' ' 56' ' ' ASN . 5.1 tmm_? -105.39 120.77 42.43 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 122.857 0.463 . . . . 125.71 110.059 -171.969 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 60' ' ' VAL . . . . . 0.655 ' HB ' HG22 ' A' ' 139' ' ' VAL . 59.6 t -110.32 136.15 47.2 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.29 0 N-CA-C 106.173 -1.788 . . . . 63.78 106.173 171.806 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 61' ' ' VAL . . . . . 0.447 ' HB ' ' HB3' ' A' ' 164' ' ' GLN . 31.0 t -107.57 122.06 61.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 N-CA-C 107.025 -1.472 . . . . 61.54 107.025 175.53 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 63.8 t -111.43 112.55 41.04 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 N-CA-C 108.455 -0.943 . . . . 60.23 108.455 -177.267 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 57.5 m-85 -88.73 137.69 32.09 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.992 -0.549 . . . . 63.27 110.445 -174.753 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ILE . . . . . 0.573 HD11 ' CE2' ' A' ' 137' ' ' TYR . 46.9 mt -102.26 128.0 55.32 Favored 'Isoleucine or valine' 0 C--O 1.239 0.54 0 C-N-CA 123.964 0.905 . . . . 59.96 108.709 -171.261 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ARG . . . . . 0.48 ' O ' HG13 ' A' ' 68' ' ' VAL . 11.7 mtm-85 -48.05 142.79 4.84 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 121.214 0.53 . . . . 117.11 110.581 175.334 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 86.0 mttt -71.29 -17.37 62.47 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-N 115.759 -0.655 . . . . 160.19 112.425 -170.158 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -93.7 8.17 41.97 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 112.754 0.65 . . . . 94.84 112.754 -178.256 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' VAL . . . . . 0.48 HG13 ' O ' ' A' ' 65' ' ' ARG . 0.2 OUTLIER -126.05 128.56 71.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 N-CA-C 107.865 -1.161 . . . . 81.15 107.865 -177.049 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 69' ' ' GLU . . . . . 0.439 ' HG3' ' HB2' ' A' ' 72' ' ' SER . 12.5 tp10 -107.48 74.77 0.98 Allowed 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 108.214 -1.032 . . . . 106.17 108.214 -173.515 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -70.88 -21.03 62.45 Favored 'General case' 0 N--CA 1.492 1.648 0 CA-C-O 117.068 -1.444 . . . . 56.59 114.6 -173.625 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 46.8 t30 -101.74 -8.4 21.75 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 119.518 1.054 . . . . 66.56 113.332 -176.81 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' SER . . . . . 0.439 ' HB2' ' HG3' ' A' ' 69' ' ' GLU . 13.3 m -91.43 124.77 35.86 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 120.01 1.277 . . . . 71.44 109.941 -177.039 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 73' ' ' GLN . . . . . 0.667 HE22 HG22 ' B' ' 83' ' ' THR . 0.8 OUTLIER -65.33 -38.24 89.55 Favored 'General case' 0 CA--C 1.516 -0.338 0 C-N-CA 120.236 -0.586 . . . . 88.9 111.244 175.613 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 76.4 p -118.92 150.24 40.22 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 123.286 0.635 . . . . 61.96 109.818 -172.052 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 24.0 pt -129.67 173.26 14.35 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 N-CA-C 107.888 -1.153 . . . . 48.05 107.888 169.617 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 5.0 tm-20 -97.82 129.23 44.82 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 108.748 -0.834 . . . . 53.38 108.748 178.666 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 22.4 tptm -144.23 129.37 18.66 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 107.931 -1.137 . . . . 131.39 107.931 173.19 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 58.1 mm-40 59.76 22.61 11.47 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.494 0.553 . . . . 81.62 112.494 176.771 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 89.91 -7.27 82.04 Favored Glycine 0 N--CA 1.437 -1.275 0 CA-C-O 118.622 -1.099 . . . . 53.2 115.528 -176.191 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 1.9 mm100 -109.65 153.01 24.84 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 119.4 1.6 . . . . 88.22 110.589 -178.701 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 69.4 m -78.75 114.15 17.43 Favored 'General case' 0 CA--C 1.514 -0.414 0 N-CA-C 108.177 -1.046 . . . . 73.82 108.177 171.427 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 4.2 m -124.95 170.87 14.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 N-CA-C 108.725 -0.842 . . . . 59.82 108.725 -178.141 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' THR . . . . . 0.693 HG21 ' OH ' ' B' ' 87' ' ' TYR . 1.2 p -63.93 144.02 57.4 Favored 'General case' 0 CA--C 1.514 -0.406 0 CA-C-N 114.614 -1.175 . . . . 90.04 109.68 -179.884 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ASN . . . . . 0.414 ' OD1' ' C ' ' A' ' 84' ' ' ASN . 10.2 t-20 -96.1 102.72 14.55 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 108.562 -0.903 . . . . 69.92 108.562 173.321 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 33.3 m-20 -52.35 -29.17 22.47 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 112.901 0.704 . . . . 110.14 112.901 178.964 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 67.7 m-20 -86.02 5.65 32.44 Favored 'General case' 0 C--O 1.239 0.537 0 N-CA-C 113.754 1.02 . . . . 89.68 113.754 -176.488 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 64.4 t80 -59.88 127.52 32.33 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 118.545 0.612 . . . . 71.84 110.976 -171.494 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 61.16 20.58 11.09 Favored 'General case' 0 C--O 1.236 0.342 0 N-CA-C 113.643 0.979 . . . . 52.84 113.643 172.183 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 17.6 mmtm -61.11 -53.46 56.72 Favored 'General case' 0 C--O 1.24 0.573 0 O-C-N 119.941 -1.724 . . . . 93.84 110.965 168.088 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 99.6 t -63.14 -48.08 89.44 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.343 0 C-N-CA 119.67 -0.812 . . . . 46.14 109.986 178.143 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 77.4 t80 -50.98 -50.37 58.44 Favored 'General case' 0 C--O 1.233 0.21 0 C-N-CA 120.531 -0.468 . . . . 48.12 110.607 178.708 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 99.9 m-20 -54.78 -50.37 68.64 Favored 'General case' 0 C--O 1.241 0.625 0 CA-C-O 121.104 0.478 . . . . 60.22 111.551 179.078 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 16.9 m -55.94 -48.39 75.84 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 119.376 -0.93 . . . . 59.81 110.781 -178.814 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 86.3 mt -60.45 -45.52 93.38 Favored 'General case' 0 C--O 1.242 0.664 0 CA-C-O 121.617 0.722 . . . . 53.0 110.722 179.643 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 2.7 tptp -72.98 -23.31 60.64 Favored 'General case' 0 C--N 1.321 -0.657 0 C-N-CA 120.107 -0.637 . . . . 60.15 111.73 -169.533 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 54.4 m-20 -78.93 -15.35 58.42 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 118.993 -1.083 . . . . 102.47 113.071 -178.479 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' MET . . . . . 0.558 ' HE1' ' HA ' ' A' ' 150' ' ' ILE . 62.0 mtp -63.64 137.34 58.06 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 119.73 -0.788 . . . . 77.3 109.624 -178.285 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 29.1 t -63.91 -26.22 68.5 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.453 -0.794 . . . . 77.79 112.284 -173.523 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 18.0 p -96.69 2.3 51.93 Favored 'General case' 0 C--O 1.239 0.53 0 N-CA-C 113.244 0.831 . . . . 71.17 113.244 -171.143 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 42.7 t -101.48 140.12 20.94 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.161 0 C-N-CA 124.753 1.221 . . . . 47.74 108.597 -176.48 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' LYS . . . . . 0.622 ' HD3' ' OE1' ' A' ' 140' ' ' GLU . 38.8 tttm -112.11 -35.11 5.74 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 115.324 1.601 . . . . 88.11 115.324 -177.678 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 102' ' ' SER . . . . . 0.406 ' OG ' ' O ' ' A' ' 301' ' ' HOH . 83.7 p -150.39 148.24 28.54 Favored 'General case' 0 C--O 1.239 0.544 0 N-CA-C 107.394 -1.335 . . . . 44.69 107.394 175.271 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 43.7 t -134.15 110.37 13.67 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 N-CA-C 105.303 -2.11 . . . . 42.1 105.303 -179.466 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 17.9 m -116.12 127.66 55.02 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 122.599 0.36 . . . . 41.17 111.576 -173.107 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 35.7 t80 -66.61 139.42 57.89 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 119.618 -0.833 . . . . 49.09 111.347 175.765 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 10.9 t -136.15 95.67 3.24 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 106.714 -1.588 . . . . 52.13 106.714 175.395 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 1.5 p -50.93 161.66 0.35 Allowed 'General case' 0 C--O 1.236 0.392 0 C-N-CA 123.399 0.68 . . . . 55.86 112.761 179.568 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' LYS . . . . . 0.434 ' HB2' ' HB2' ' A' ' 133' ' ' LEU . 23.8 pttm -69.85 -34.29 73.42 Favored 'General case' 0 C--O 1.246 0.892 0 C-N-CA 118.574 -1.25 . . . . 68.96 111.455 173.015 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 109' ' ' GLU . . . . . 0.539 ' CD ' ' H ' ' A' ' 109' ' ' GLU . 12.7 mp0 -52.08 -54.0 35.54 Favored 'General case' 0 C--O 1.247 0.95 0 CA-C-O 121.938 0.875 . . . . 68.51 110.684 173.835 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -59.44 -45.49 91.43 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 115.33 -0.85 . . . . 102.69 111.255 -177.945 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 -57.53 -39.45 76.62 Favored 'General case' 0 C--O 1.245 0.833 0 C-N-CA 119.208 -0.997 . . . . 89.41 109.697 -177.212 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 62.6 t80 -70.97 -41.63 70.77 Favored 'General case' 0 C--O 1.241 0.647 0 CA-C-N 115.761 -0.654 . . . . 65.9 112.018 -179.181 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 74.1 mt-10 -62.57 -41.07 98.7 Favored 'General case' 0 CA--C 1.516 -0.328 0 C-N-CA 117.345 -1.742 . . . . 96.47 110.026 179.73 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' LYS . . . . . 0.678 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 0.0 OUTLIER -63.72 -38.53 91.47 Favored 'General case' 0 C--O 1.238 0.473 0 C-N-CA 120.84 -0.344 . . . . 101.36 111.698 178.85 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 20.3 tp -64.8 -42.31 95.13 Favored 'General case' 0 C--O 1.246 0.906 0 N-CA-C 112.448 0.536 . . . . 75.26 112.448 177.845 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 72.2 p -65.04 -39.9 94.01 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 119.983 -0.687 . . . . 53.05 111.474 173.277 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -62.61 -31.87 72.78 Favored 'General case' 0 C--O 1.236 0.361 0 O-C-N 122.07 -0.394 . . . . 85.48 111.034 179.132 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 64.5 mt -85.51 -32.71 7.26 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.991 0 N-CA-C 113.325 0.861 . . . . 61.93 113.325 -178.919 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 11.3 mtp -110.66 2.91 18.85 Favored 'General case' 0 C--N 1.348 0.53 0 N-CA-C 114.674 1.361 . . . . 86.36 114.674 -166.813 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 120.93 -21.03 8.46 Favored Glycine 0 N--CA 1.449 -0.475 0 N-CA-C 116.138 1.215 . . . . 93.19 116.138 153.377 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -172.14 172.03 4.73 Favored 'General case' 0 CA--C 1.51 -0.58 0 N-CA-C 107.413 -1.328 . . . . 123.61 107.413 -178.849 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -77.32 143.28 38.91 Favored 'General case' 0 C--O 1.24 0.575 0 CA-C-N 115.041 -0.982 . . . . 114.73 110.98 -179.403 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 123' ' ' TRP . . . . . 0.415 ' HE3' ' N ' ' A' ' 123' ' ' TRP . 0.1 OUTLIER -77.67 69.02 3.85 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-N 115.78 -0.646 . . . . 81.74 110.158 172.195 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 124' ' ' LYS . . . . . 0.781 ' HD3' ' O ' ' A' ' 305' ' ' HOH . 3.9 mppt? -35.25 -51.97 0.59 Allowed 'General case' 0 CA--C 1.511 -0.553 0 C-N-CA 123.76 0.824 . . . . 85.34 110.488 -171.164 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 8.7 pt -73.24 -18.26 18.02 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.699 0 C-N-CA 118.659 -1.216 . . . . 57.4 111.617 -157.895 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -89.44 -15.55 32.92 Favored 'General case' 0 C--O 1.242 0.681 0 N-CA-C 113.516 0.932 . . . . 62.29 113.516 177.689 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' GLU . . . . . 0.412 ' O ' ' O49' ' A' ' 201' ' ' DMU . 74.5 mt-10 -71.9 -10.9 60.44 Favored 'General case' 0 C--O 1.234 0.263 0 N-CA-C 113.831 1.048 . . . . 89.93 113.831 -163.736 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -77.21 -20.83 74.7 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 118.997 -1.573 . . . . 74.14 115.021 171.328 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 42.0 m-20 -109.79 -176.16 2.93 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 118.771 1.286 . . . . 66.49 111.719 -171.016 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -73.98 143.64 45.53 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.552 -0.749 . . . . 65.01 109.863 -170.368 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 40.5 t-20 -74.72 118.88 73.69 Favored Pre-proline 0 C--O 1.237 0.406 0 N-CA-C 108.117 -1.068 . . . . 66.61 108.117 -179.329 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -92.57 4.05 3.57 Favored 'Trans proline' 0 C--O 1.238 0.493 0 N-CA-C 114.759 1.023 . . . . 62.21 114.759 -174.558 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' LEU . . . . . 0.434 ' HB2' ' HB2' ' A' ' 108' ' ' LYS . 49.6 mt -65.12 164.13 13.65 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 122.229 1.014 . . . . 78.6 111.027 166.299 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 134' ' ' TYR . . . . . 0.45 ' HD2' ' O ' ' A' ' 64' ' ' ILE . 88.0 m-85 -103.27 134.24 47.01 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.563 -0.744 . . . . 120.3 110.153 174.674 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 91.2 m-20 -42.15 138.16 1.71 Allowed 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 107.215 -1.402 . . . . 67.32 107.215 154.306 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -133.67 162.42 31.99 Favored 'General case' 0 C--N 1.345 0.402 0 CA-C-O 121.671 0.748 . . . . 55.06 111.129 178.074 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' TYR . . . . . 0.573 ' CE2' HD11 ' A' ' 64' ' ' ILE . 45.9 m-85 -110.6 127.38 55.21 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 107.043 -1.465 . . . . 48.85 107.043 164.851 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 138' ' ' ILE . . . . . . . . . . . . . 18.2 mm -89.32 109.0 19.79 Favored 'Isoleucine or valine' 0 C--O 1.235 0.341 0 N-CA-C 107.398 -1.334 . . . . 44.09 107.398 172.805 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 139' ' ' VAL . . . . . 0.655 HG22 ' HB ' ' A' ' 60' ' ' VAL . 1.4 m -105.83 138.61 30.26 Favored 'Isoleucine or valine' 0 C--O 1.24 0.585 0 CA-C-O 121.547 0.689 . . . . 55.08 109.936 -178.81 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 140' ' ' GLU . . . . . 0.622 ' OE1' ' HD3' ' A' ' 101' ' ' LYS . 60.2 tt0 -101.67 125.94 48.42 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 108.592 -0.892 . . . . 62.78 108.592 175.179 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -84.23 154.5 22.99 Favored 'General case' 0 CA--C 1.531 0.239 0 O-C-N 123.312 0.383 . . . . 52.83 110.175 173.356 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 88.8 m-20 -66.4 -36.93 84.08 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 119.948 -0.701 . . . . 76.81 111.928 178.416 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -150.42 159.84 34.05 Favored Pre-proline 0 C--N 1.327 -0.373 0 N-CA-C 108.553 -0.906 . . . . 66.71 108.553 174.539 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_exo -56.14 -38.46 94.85 Favored 'Trans proline' 0 C--O 1.236 0.394 0 N-CA-C 113.565 0.564 . . . . 76.66 113.565 -173.718 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 145' ' ' ASN . . . . . 0.401 ' HA ' ' O ' ' A' ' 302' ' ' HOH . 97.3 m-20 -67.42 -1.17 4.4 Favored 'General case' 0 C--N 1.334 -0.089 0 N-CA-C 113.309 0.855 . . . . 82.26 113.309 179.886 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 146' ' ' ASP . . . . . 0.801 ' O ' HG22 ' A' ' 149' ' ' THR . 75.9 m-20 -89.93 -26.36 20.46 Favored 'General case' 0 C--O 1.243 0.742 0 CA-C-N 119.209 0.913 . . . . 75.7 112.386 168.18 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 43.0 t -46.28 -56.92 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.318 0 CA-C-O 121.323 0.582 . . . . 70.76 110.75 -168.136 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 148' ' ' LYS . . . . . 0.77 ' HE2' ' HA ' ' A' ' 148' ' ' LYS . 9.3 mmpt? -62.62 -41.63 99.11 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 118.959 -1.096 . . . . 119.74 111.65 -171.968 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 149' ' ' THR . . . . . 0.801 HG22 ' O ' ' A' ' 146' ' ' ASP . 13.5 t -61.3 -34.13 74.72 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 118.529 -1.268 . . . . 88.92 110.622 177.026 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 150' ' ' ILE . . . . . 0.558 ' HA ' ' HE1' ' A' ' 97' ' ' MET . 7.0 mt -67.6 -45.64 84.58 Favored 'Isoleucine or valine' 0 C--O 1.241 0.62 0 C-N-CA 120.216 -0.594 . . . . 63.42 109.746 175.181 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -61.23 -42.61 98.91 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 117.86 -1.536 . . . . 70.1 110.245 -175.016 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 80.4 mt-10 -54.78 -58.14 8.75 Favored 'General case' 0 C--O 1.241 0.644 0 CA-C-O 121.293 0.568 . . . . 116.03 110.325 176.149 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 72.9 m-20 -58.03 -45.31 87.16 Favored 'General case' 0 C--O 1.238 0.477 0 C-N-CA 119.67 -0.812 . . . . 81.33 110.488 -173.639 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -56.99 -35.42 69.17 Favored 'General case' 0 C--O 1.232 0.181 0 C-N-CA 120.474 -0.49 . . . . 68.42 112.154 -177.571 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 37.9 tttt -74.31 -6.66 49.32 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 116.032 -2.267 . . . . 110.65 111.94 -173.437 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 28.4 mtpt -93.2 -15.15 26.24 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 113.751 1.019 . . . . 112.51 113.751 179.372 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 157' ' ' ILE . . . . . . . . . . . . . 41.1 mt -67.49 120.76 15.39 Favored 'Isoleucine or valine' 0 C--O 1.239 0.501 0 N-CA-C 109.127 -0.694 . . . . 72.86 109.127 177.105 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 158' ' ' GLU . . . . . 0.437 ' HA ' ' OE1' ' A' ' 158' ' ' GLU . 23.4 tp10 -61.08 142.15 56.88 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 118.03 -1.468 . . . . 102.88 109.832 179.284 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . 89.41 -9.24 77.76 Favored Glycine 0 N--CA 1.438 -1.198 0 C-N-CA 119.406 -1.378 . . . . 61.71 114.804 -170.984 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 160' ' ' VAL . . . . . . . . . . . . . 12.8 t -86.62 122.87 39.29 Favored 'Isoleucine or valine' 0 C--O 1.239 0.549 0 N-CA-C 107.163 -1.421 . . . . 67.79 107.163 169.821 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 16.2 t -85.83 -55.02 4.16 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.167 -0.47 . . . . 86.1 111.259 178.15 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 23.1 mm-40 -135.63 172.4 13.07 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.725 0.774 . . . . 115.85 110.082 -173.774 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 163' ' ' VAL . . . . . . . . . . . . . 54.3 t -143.73 115.07 2.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 N-CA-C 108.451 -0.944 . . . . 81.23 108.451 175.585 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 164' ' ' GLN . . . . . 0.447 ' HB3' ' HB ' ' A' ' 61' ' ' VAL . 40.7 tt0 -95.26 95.85 8.78 Favored 'General case' 0 C--O 1.238 0.469 0 N-CA-C 109.157 -0.682 . . . . 89.75 109.157 179.527 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 165' ' ' ASP . . . . . 0.448 ' HB3' ' NZ ' ' A' ' 148' ' ' LYS . 0.3 OUTLIER . . . . . 0 C--N 1.327 -0.408 0 CA-C-N 115.768 -0.651 . . . . 110.31 112.695 -178.378 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 201' ' ' DMU . . . . . 0.412 ' O49' ' O ' ' A' ' 127' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 201' ' ' HOH . . . . . 0.759 ' O ' ' HA ' ' B' ' 83' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 203' ' ' HOH . . . . . 0.54 ' O ' ' HB2' ' B' ' 132' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 301' ' ' HOH . . . . . 0.406 ' O ' ' OG ' ' A' ' 102' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 302' ' ' HOH . . . . . 0.401 ' O ' ' HA ' ' A' ' 145' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 305' ' ' HOH . . . . . 0.781 ' O ' ' HD3' ' A' ' 124' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 24.0 p . . . . . 0 C--O 1.234 0.254 0 CA-C-O 121.077 0.465 . . . . 139.83 110.971 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -91.4 123.52 34.89 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 108.8 -0.815 . . . . 140.31 108.8 174.445 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' ILE . . . . . . . . . . . . . 23.9 mt -118.88 143.05 31.07 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 C-N-CA 123.269 0.628 . . . . 81.23 109.688 -173.01 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -77.2 141.56 40.03 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 108.711 -0.848 . . . . 89.13 108.711 178.033 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -47.64 -40.49 19.85 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.625 -0.716 . . . . 115.7 112.895 -176.583 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' ASN . . . . . . . . . . . . . 19.1 p30 -76.55 -2.47 32.56 Favored 'General case' 0 C--O 1.239 0.545 0 C-N-CA 119.322 -0.951 . . . . 68.42 112.814 -166.973 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' VAL . . . . . 0.415 ' O ' HG23 ' B' ' 58' ' ' VAL . 2.3 m -130.39 13.22 2.19 Favored 'Isoleucine or valine' 0 C--O 1.242 0.661 0 C-N-CA 119.895 -0.722 . . . . 63.8 110.046 177.286 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 3.2 ptt180 -94.19 127.6 40.12 Favored 'General case' 0 C--O 1.238 0.461 0 N-CA-C 110.07 -0.344 . . . . 106.23 110.07 178.593 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' VAL . . . . . 0.48 HG22 HG13 ' B' ' 147' ' ' VAL . 22.0 t -115.75 138.51 45.94 Favored 'Isoleucine or valine' 0 C--O 1.237 0.396 0 N-CA-C 107.967 -1.123 . . . . 56.6 107.967 165.355 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' VAL . . . . . . . . . . . . . 20.9 t -111.06 122.11 64.94 Favored 'Isoleucine or valine' 0 C--O 1.242 0.699 0 N-CA-C 107.891 -1.152 . . . . 52.42 107.891 175.212 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' VAL . . . . . . . . . . . . . 70.8 t -108.49 103.68 15.87 Favored 'Isoleucine or valine' 0 C--O 1.236 0.372 0 N-CA-C 107.635 -1.246 . . . . 56.26 107.635 -178.495 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 87.9 m-85 -83.72 142.23 30.87 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.881 0.372 . . . . 56.31 110.399 179.68 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 38.0 mt -104.22 143.31 16.09 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 CA-C-N 115.618 -0.719 . . . . 68.0 109.645 -170.713 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' ARG . . . . . 0.748 ' HB3' HG12 ' B' ' 68' ' ' VAL . 0.5 OUTLIER -54.77 136.9 45.8 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.93 -0.577 . . . . 76.85 110.047 176.455 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' LYS . . . . . 0.459 ' HE3' ' CE2' ' B' ' 134' ' ' TYR . 90.2 mttt -60.88 -17.97 53.51 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 112.955 0.724 . . . . 67.6 112.955 -178.527 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' ASP . . . . . 0.731 ' OD1' ' HG3' ' B' ' 65' ' ' ARG . 0.3 OUTLIER -94.14 -2.66 52.34 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 113.406 0.891 . . . . 110.14 113.406 -175.267 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' VAL . . . . . 0.748 HG12 ' HB3' ' B' ' 65' ' ' ARG . 0.2 OUTLIER -119.74 130.86 73.62 Favored 'Isoleucine or valine' 0 C--O 1.235 0.339 0 N-CA-C 108.944 -0.762 . . . . 72.91 108.944 -175.679 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' GLU . . . . . 0.434 ' HG3' ' HB2' ' B' ' 72' ' ' SER . 15.6 tp10 -109.65 86.5 2.31 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.563 0.697 . . . . 98.82 109.187 -173.476 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -78.26 -24.36 46.89 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 113.254 0.835 . . . . 51.65 113.254 -170.585 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' ASN . . . . . . . . . . . . . 31.3 t30 -98.09 -8.09 28.4 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 114.511 1.3 . . . . 66.9 114.511 -171.926 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' SER . . . . . 0.434 ' HB2' ' HG3' ' B' ' 69' ' ' GLU . 62.3 m -95.23 123.39 38.71 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 119.234 0.925 . . . . 78.38 109.934 -175.762 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' GLN . . . . . 0.633 ' NE2' HG22 ' A' ' 83' ' ' THR . 0.0 OUTLIER -70.27 -31.94 69.53 Favored 'General case' 0 C--O 1.24 0.602 0 C-N-CA 119.002 -1.079 . . . . 104.5 111.18 176.902 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' THR . . . . . 0.734 ' HA ' ' O ' ' B' ' 201' ' ' HOH . 29.6 p -113.8 152.7 30.25 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 124.45 1.1 . . . . 71.62 111.238 -176.644 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' ILE . . . . . . . . . . . . . 15.9 pt -137.87 179.86 3.16 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.751 0 N-CA-C 107.38 -1.341 . . . . 62.55 107.38 171.327 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -107.25 131.6 54.01 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 109.708 -0.479 . . . . 54.1 109.708 -177.036 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 17.8 tptm -145.12 122.71 11.77 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 107.421 -1.325 . . . . 120.92 107.421 177.887 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 73.4 mm-40 54.98 32.04 17.25 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 120.926 0.394 . . . . 95.85 111.548 179.311 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . 83.47 -9.12 62.55 Favored Glycine 0 N--CA 1.44 -1.043 0 O-C-N 121.328 -0.858 . . . . 53.13 115.211 176.967 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' GLN . . . . . . . . . . . . . 27.8 mm-40 -99.75 150.21 22.55 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 108.003 -1.11 . . . . 73.39 108.003 176.178 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -85.67 113.8 22.16 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 107.883 -1.155 . . . . 64.36 107.883 170.843 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' VAL . . . . . . . . . . . . . 27.0 m -123.36 178.62 3.2 Favored 'Isoleucine or valine' 0 C--O 1.235 0.3 0 CA-C-N 116.619 -0.264 . . . . 69.98 110.48 -178.856 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' THR . . . . . 0.759 ' HA ' ' O ' ' B' ' 201' ' ' HOH . 15.4 p -74.56 144.46 44.0 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 121.49 0.662 . . . . 77.64 111.539 -170.585 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 40.7 t-20 -89.87 112.07 23.3 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.13 -0.941 . . . . 73.23 109.211 178.581 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 13.5 m-20 -55.49 -50.77 69.05 Favored 'General case' 0 C--O 1.239 0.531 0 CA-C-O 120.945 0.402 . . . . 120.49 111.19 178.562 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 42.6 m-20 -70.96 5.37 2.05 Favored 'General case' 0 CA--C 1.512 -0.493 0 C-N-CA 124.42 1.088 . . . . 87.41 113.299 -171.472 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' TYR . . . . . 0.693 ' OH ' HG21 ' A' ' 83' ' ' THR . 56.9 t80 -62.16 127.44 31.36 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 118.959 0.8 . . . . 64.83 110.312 -169.208 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 60.29 27.03 16.55 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 113.295 0.85 . . . . 58.69 113.295 173.003 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 42.0 mmtt -69.84 -53.52 17.73 Favored 'General case' 0 C--O 1.238 0.481 0 C-N-CA 118.113 -1.435 . . . . 77.9 110.483 172.111 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 72.0 t -62.73 -44.18 99.27 Favored 'Isoleucine or valine' 0 C--O 1.24 0.603 0 C-N-CA 119.679 -0.808 . . . . 58.87 110.318 178.146 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' TYR . . . . . . . . . . . . . 67.7 t80 -52.16 -50.68 61.32 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 120.342 -0.543 . . . . 49.7 111.445 173.818 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 94.6 m-20 -57.05 -52.7 64.21 Favored 'General case' 0 C--O 1.238 0.489 0 C-N-CA 120.183 -0.607 . . . . 71.92 111.271 -178.637 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' SER . . . . . . . . . . . . . 24.6 m -53.31 -47.12 69.52 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 120.131 -0.628 . . . . 66.83 110.693 -179.065 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 86.6 mt -64.74 -50.31 67.38 Favored 'General case' 0 C--O 1.239 0.515 0 C-N-CA 120.233 -0.587 . . . . 60.39 111.477 -176.9 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' LYS . . . . . . . . . . . . . 15.9 tptm -64.54 -17.66 64.14 Favored 'General case' 0 C--O 1.238 0.49 0 O-C-N 122.202 -0.311 . . . . 71.74 111.72 -176.792 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 44.4 m-20 -78.49 -32.76 48.36 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 118.075 -1.45 . . . . 105.32 112.389 178.018 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' MET . . . . . 0.631 ' HB2' HG23 ' B' ' 100' ' ' VAL . 47.4 mtt -46.71 131.23 11.62 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 119.767 -0.773 . . . . 72.62 110.772 178.601 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' SER . . . . . . . . . . . . . 6.2 p -69.19 -22.68 63.88 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 112.94 0.719 . . . . 84.98 112.94 -177.631 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 99' ' ' THR . . . . . . . . . . . . . 18.0 p -86.89 1.6 51.99 Favored 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 112.969 0.729 . . . . 66.65 112.969 176.92 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 100' ' ' VAL . . . . . 0.631 HG23 ' HB2' ' B' ' 97' ' ' MET . 43.2 t -100.82 138.35 25.36 Favored 'Isoleucine or valine' 0 C--O 1.239 0.511 0 CA-C-N 119.556 1.071 . . . . 65.18 109.363 -178.742 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 78.5 tttt -104.61 -39.79 6.25 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 124.11 0.964 . . . . 98.42 113.143 -179.709 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 54.8 p -152.0 154.34 35.81 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 118.759 0.709 . . . . 55.47 110.37 174.928 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 21.8 t -137.62 109.21 6.19 Favored 'Isoleucine or valine' 0 C--O 1.239 0.502 0 N-CA-C 107.334 -1.358 . . . . 43.41 107.334 -178.597 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' THR . . . . . . . . . . . . . 69.8 m -114.58 132.38 56.36 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 110.082 -0.34 . . . . 46.94 110.082 -171.614 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -79.06 136.62 37.22 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 109.548 -0.538 . . . . 69.63 109.548 -179.12 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 18.2 t -130.12 102.72 6.36 Favored 'General case' 0 C--O 1.237 0.43 0 N-CA-C 107.214 -1.402 . . . . 62.57 107.214 175.442 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 24.6 p -77.2 145.22 37.75 Favored 'General case' 0 CA--C 1.515 -0.391 0 O-C-N 123.615 0.572 . . . . 65.73 110.783 -173.363 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 17.2 pttm -58.11 -32.12 67.8 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.976 -0.556 . . . . 74.46 111.15 -174.034 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' GLU . . . . . . . . . . . . . 27.0 mp0 -66.13 -36.47 83.22 Favored 'General case' 0 C--O 1.239 0.505 0 C-N-CA 120.262 -0.575 . . . . 77.16 111.228 175.833 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -61.77 -49.32 76.83 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-O 120.819 0.343 . . . . 113.69 111.247 174.378 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -68.32 -23.21 64.7 Favored 'General case' 0 C--O 1.24 0.578 0 C-N-CA 119.321 -0.952 . . . . 74.6 111.714 -178.046 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 112' ' ' TYR . . . . . 0.7 ' OH ' ' HA ' ' B' ' 127' ' ' GLU . 27.7 t80 -72.35 -38.33 68.6 Favored 'General case' 0 C--O 1.241 0.625 0 C-N-CA 119.908 -0.717 . . . . 93.35 110.167 -177.386 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 80.5 mt-10 -72.41 -34.52 67.92 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.884 -0.326 . . . . 126.52 111.089 172.938 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 114' ' ' LYS . . . . . 0.796 ' HE3' ' OE1' ' B' ' 117' ' ' GLU . 15.7 tptm -70.32 -38.45 74.92 Favored 'General case' 0 C--O 1.24 0.596 0 C-N-CA 120.599 -0.44 . . . . 120.98 110.804 175.607 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 115' ' ' LEU . . . . . 0.448 HD12 ' HA ' ' B' ' 115' ' ' LEU . 34.1 tp -60.42 -44.12 96.07 Favored 'General case' 0 C--O 1.24 0.585 0 C-N-CA 120.252 -0.579 . . . . 75.65 111.298 173.887 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 98.4 m -63.68 -39.41 94.26 Favored 'General case' 0 C--O 1.237 0.44 0 C-N-CA 120.399 -0.52 . . . . 102.11 110.77 177.102 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 117' ' ' GLU . . . . . 0.796 ' OE1' ' HE3' ' B' ' 114' ' ' LYS . 29.2 tt0 -55.9 -51.78 66.39 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 120.701 -0.4 . . . . 94.33 111.325 175.508 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 118' ' ' ILE . . . . . . . . . . . . . 6.8 mt -66.27 132.39 31.78 Favored 'Isoleucine or valine' 0 C--O 1.239 0.512 0 N-CA-C 107.851 -1.166 . . . . 74.09 107.851 171.734 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 119' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -34.28 134.59 0.19 Allowed 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 113.726 1.01 . . . . 102.09 113.726 -158.616 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 140.23 116.99 1.37 Allowed Glycine 0 N--CA 1.445 -0.756 0 C-N-CA 125.078 1.323 . . . . 100.86 111.305 -179.102 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 4.6 p30 -136.03 -31.52 0.91 Allowed 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 112.581 0.586 . . . . 132.72 112.581 170.762 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 122' ' ' ASN . . . . . 0.484 ' C ' ' H ' ' B' ' 124' ' ' LYS . 1.7 t30 -78.37 19.53 0.46 Allowed 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 129.428 3.091 . . . . 144.98 111.307 174.775 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 123' ' ' TRP . . . . . . . . . . . . . 11.1 m0 -77.59 24.48 0.21 Allowed 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 108.169 -1.049 . . . . 130.9 108.169 -179.877 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 124' ' ' LYS . . . . . 0.484 ' H ' ' C ' ' B' ' 122' ' ' ASN . 12.0 mttp -34.74 -49.21 0.41 Allowed 'General case' 0 C--O 1.237 0.433 0 C-N-CA 122.991 0.516 . . . . 125.85 111.157 -178.417 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 125' ' ' ILE . . . . . . . . . . . . . 1.8 pt -61.28 -11.69 5.07 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.132 0 N-CA-C 112.475 0.546 . . . . 118.65 112.475 -173.707 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 126' ' ' PHE . . . . . . . . . . . . . 12.2 m-85 -108.46 -36.3 6.26 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 114.095 1.146 . . . . 166.52 114.095 174.647 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 127' ' ' GLU . . . . . 0.7 ' HA ' ' OH ' ' B' ' 112' ' ' TYR . 87.8 mt-10 -81.93 161.41 23.09 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.45 0.643 . . . . 132.29 110.267 -172.232 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 128' ' ' GLY . . . . . . . . . . . . . . . 72.38 -18.41 1.27 Allowed Glycine 0 C--N 1.336 0.558 0 CA-C-O 122.864 1.258 . . . . 120.79 111.366 179.409 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 129' ' ' ASP . . . . . 0.531 ' H ' ' C ' ' B' ' 127' ' ' GLU . 5.5 t70 -100.29 56.44 0.92 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 113.638 -1.281 . . . . 114.69 109.849 -178.422 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . 65.71 84.4 0.15 Allowed 'General case' 0 C--O 1.234 0.285 0 N-CA-C 114.679 1.363 . . . . 88.9 114.679 171.34 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 131' ' ' ASN . . . . . . . . . . . . . 30.6 t-20 -33.64 117.67 0.47 Allowed Pre-proline 0 C--O 1.236 0.361 0 C-N-CA 123.918 0.887 . . . . 86.48 112.305 177.709 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 132' ' ' PRO . . . . . 0.54 ' HB2' ' O ' ' B' ' 203' ' ' HOH . 90.3 Cg_endo -96.67 7.5 1.56 Allowed 'Trans proline' 0 C--N 1.33 -0.415 0 C-N-CA 122.103 1.869 . . . . 74.35 115.356 -174.48 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 63.6 mt -81.36 172.12 13.95 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-O 121.992 0.901 . . . . 73.29 111.57 -177.533 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 134' ' ' TYR . . . . . 0.459 ' CE2' ' HE3' ' B' ' 66' ' ' LYS . 31.2 m-85 -120.45 136.52 54.72 Favored 'General case' 0 C--O 1.236 0.385 0 O-C-N 121.652 -0.655 . . . . 69.77 111.522 -174.555 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 81.1 m-20 -54.12 138.54 37.7 Favored 'General case' 0 C--N 1.34 0.164 0 O-C-N 123.71 0.631 . . . . 51.31 110.363 164.263 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 136' ' ' ALA . . . . . . . . . . . . . . . -137.61 156.72 47.75 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 109.329 -0.619 . . . . 44.38 109.329 -175.711 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 32.0 m-85 -109.28 122.49 47.44 Favored 'General case' 0 C--O 1.238 0.487 0 N-CA-C 107.86 -1.163 . . . . 45.13 107.86 163.027 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 138' ' ' ILE . . . . . . . . . . . . . 3.5 mp -92.47 114.63 29.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 N-CA-C 106.84 -1.541 . . . . 57.01 106.84 172.746 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 139' ' ' VAL . . . . . . . . . . . . . 39.7 t -111.78 137.22 45.32 Favored 'Isoleucine or valine' 0 C--O 1.239 0.537 0 C-N-CA 124.44 1.096 . . . . 52.66 108.4 -170.122 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 140' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -108.95 126.9 53.58 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 109.339 -0.615 . . . . 77.16 109.339 177.425 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 141' ' ' ALA . . . . . . . . . . . . . . . -85.18 156.76 20.87 Favored 'General case' 0 C--N 1.342 0.245 0 CA-C-O 121.429 0.633 . . . . 46.6 110.692 175.61 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 142' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -71.75 -32.05 67.3 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 119.789 -0.765 . . . . 68.73 111.073 177.357 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . -143.14 148.61 45.57 Favored Pre-proline 0 C--O 1.238 0.484 0 N-CA-C 107.697 -1.223 . . . . 72.77 107.697 179.679 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 144' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_exo -60.48 -27.9 85.71 Favored 'Trans proline' 0 CA--C 1.513 -0.561 0 C-N-CA 118.156 -0.763 . . . . 73.73 111.48 176.882 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 145' ' ' ASN . . . . . . . . . . . . . 76.1 m-20 -54.38 -28.22 41.76 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 120.702 -0.399 . . . . 91.8 111.838 177.976 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 146' ' ' ASP . . . . . 0.877 ' O ' HG22 ' B' ' 149' ' ' THR . 27.3 m-20 -83.04 -17.02 44.75 Favored 'General case' 0 CA--C 1.514 -0.434 0 N-CA-C 112.935 0.717 . . . . 83.08 112.935 -176.522 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 147' ' ' VAL . . . . . 0.48 HG13 HG22 ' B' ' 60' ' ' VAL . 38.5 t -52.84 -52.56 27.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 C-N-CA 119.293 -0.963 . . . . 85.25 110.341 -167.278 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 148' ' ' LYS . . . . . 0.805 ' HA ' ' HE2' ' B' ' 148' ' ' LYS . 4.2 mmpt? -66.51 -34.67 78.44 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 118.646 -1.222 . . . . 103.23 112.326 -179.371 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 149' ' ' THR . . . . . 0.877 HG22 ' O ' ' B' ' 146' ' ' ASP . 4.4 t -64.43 -17.81 64.15 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 112.76 0.652 . . . . 102.2 112.76 173.394 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 150' ' ' ILE . . . . . . . . . . . . . 11.5 mt -95.86 -38.92 9.01 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 N-CA-C 108.567 -0.901 . . . . 79.53 108.567 -176.788 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 151' ' ' ALA . . . . . . . . . . . . . . . -68.72 -39.33 80.47 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 120.612 -0.435 . . . . 73.16 111.185 -174.298 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 152' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -61.14 -51.8 67.55 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 118.545 -1.262 . . . . 121.36 109.642 178.921 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 31.1 m-20 -54.17 -47.41 72.01 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 120.651 0.262 . . . . 89.69 111.539 179.018 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -54.95 -37.78 66.91 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.168 -0.613 . . . . 68.66 111.101 -178.639 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 155' ' ' LYS . . . . . . . . . . . . . 28.5 ttpt -73.77 -5.05 38.38 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 119.676 -0.81 . . . . 103.15 112.399 -177.215 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 156' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -87.18 -30.76 20.77 Favored 'General case' 0 CA--C 1.519 -0.232 0 N-CA-C 112.776 0.658 . . . . 104.25 112.776 172.404 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 53.5 mt -65.68 117.29 6.12 Favored 'Isoleucine or valine' 0 C--O 1.238 0.491 0 N-CA-C 109.41 -0.589 . . . . 84.16 109.41 -172.901 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 158' ' ' GLU . . . . . 0.715 ' HA ' ' OE1' ' B' ' 158' ' ' GLU . 0.0 OUTLIER -59.34 139.75 56.73 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 120.162 -0.615 . . . . 129.94 110.526 -177.58 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 159' ' ' GLY . . . . . . . . . . . . . . . 102.07 -21.21 42.55 Favored Glycine 0 N--CA 1.445 -0.714 0 CA-C-O 119.39 -0.672 . . . . 78.71 114.494 -167.12 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 72.5 t -81.92 130.66 35.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 118.052 0.926 . . . . 62.06 109.569 176.519 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 28.7 t -89.84 -53.44 4.5 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 123.128 0.571 . . . . 72.4 110.894 177.299 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 67.4 mm-40 -150.01 170.25 19.3 Favored 'General case' 0 C--O 1.239 0.511 0 CA-C-O 120.952 0.406 . . . . 98.44 110.022 178.4 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 163' ' ' VAL . . . . . 0.51 ' O ' HG23 ' B' ' 163' ' ' VAL . 4.3 m -147.95 115.63 1.02 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.485 0 C-N-CA 123.092 0.557 . . . . 70.74 111.39 -175.62 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 49.8 tt0 -86.64 116.37 24.71 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 123.979 0.912 . . . . 69.11 109.293 176.504 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 165' ' ' ASP . . . . . 0.524 ' CB ' ' HE3' ' B' ' 148' ' ' LYS . 9.9 p-10 . . . . . 0 C--N 1.328 -0.362 0 CA-C-O 121.432 0.634 . . . . 88.56 111.47 -175.814 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 18.9 p . . . . . 0 C--O 1.231 0.1 0 N-CA-C 111.88 0.326 . . . . 147.35 111.88 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.486 ' N ' ' OD1' ' A' ' 53' ' ' ASP . 0.4 OUTLIER -85.26 96.99 9.68 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 107.959 -1.126 . . . . 134.68 107.959 177.465 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 29.6 mt -118.94 143.57 29.69 Favored 'Isoleucine or valine' 0 C--O 1.237 0.429 0 N-CA-C 108.372 -0.973 . . . . 86.0 108.372 -179.958 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -103.14 147.73 26.64 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 120.327 -0.549 . . . . 110.73 110.974 -174.551 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ASN . . . . . 0.459 ' HA ' ' CZ ' ' A' ' 59' ' ' ARG . 6.3 t30 -47.0 -41.64 16.7 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 115.075 -0.966 . . . . 121.31 111.159 -169.589 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.725 HD22 ' HG3' ' A' ' 144' ' ' PRO . 9.9 p-10 -76.62 -4.43 42.96 Favored 'General case' 0 C--O 1.238 0.486 0 N-CA-C 114.725 1.38 . . . . 91.61 114.725 -166.682 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.556 HG13 ' ND2' ' A' ' 57' ' ' ASN . 3.1 m -129.47 10.35 2.5 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.071 0 CA-C-N 119.018 0.826 . . . . 64.75 109.015 -179.841 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.459 ' CZ ' ' HA ' ' A' ' 56' ' ' ASN . 5.1 tmm_? -105.39 120.77 42.43 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 122.857 0.463 . . . . 125.71 110.059 -171.969 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.655 ' HB ' HG22 ' A' ' 139' ' ' VAL . 59.6 t -110.32 136.15 47.2 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.29 0 N-CA-C 106.173 -1.788 . . . . 63.78 106.173 171.806 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.447 ' HB ' ' HB3' ' A' ' 164' ' ' GLN . 31.0 t -107.57 122.06 61.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 N-CA-C 107.025 -1.472 . . . . 61.54 107.025 175.53 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 63.8 t -111.43 112.55 41.04 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 N-CA-C 108.455 -0.943 . . . . 60.23 108.455 -177.267 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 57.5 m-85 -88.73 137.69 32.09 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.992 -0.549 . . . . 63.27 110.445 -174.753 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.573 HD11 ' CE2' ' A' ' 137' ' ' TYR . 46.9 mt -102.26 128.0 55.32 Favored 'Isoleucine or valine' 0 C--O 1.239 0.54 0 C-N-CA 123.964 0.905 . . . . 59.96 108.709 -171.261 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.48 ' O ' HG13 ' A' ' 68' ' ' VAL . 11.7 mtm-85 -48.05 142.79 4.84 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 121.214 0.53 . . . . 117.11 110.581 175.334 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 86.0 mttt -71.29 -17.37 62.47 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-N 115.759 -0.655 . . . . 160.19 112.425 -170.158 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -93.7 8.17 41.97 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 112.754 0.65 . . . . 94.84 112.754 -178.256 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.48 HG13 ' O ' ' A' ' 65' ' ' ARG . 0.2 OUTLIER -126.05 128.56 71.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 N-CA-C 107.865 -1.161 . . . . 81.15 107.865 -177.049 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.439 ' HG3' ' HB2' ' A' ' 72' ' ' SER . 12.5 tp10 -107.48 74.77 0.98 Allowed 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 108.214 -1.032 . . . . 106.17 108.214 -173.515 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -70.88 -21.03 62.45 Favored 'General case' 0 N--CA 1.492 1.648 0 CA-C-O 117.068 -1.444 . . . . 56.59 114.6 -173.625 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 46.8 t30 -101.74 -8.4 21.75 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 119.518 1.054 . . . . 66.56 113.332 -176.81 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' SER . . . . . 0.439 ' HB2' ' HG3' ' A' ' 69' ' ' GLU . 13.3 m -91.43 124.77 35.86 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 120.01 1.277 . . . . 71.44 109.941 -177.039 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.667 HE22 HG22 ' B' ' 83' ' ' THR . 0.8 OUTLIER -65.33 -38.24 89.55 Favored 'General case' 0 CA--C 1.516 -0.338 0 C-N-CA 120.236 -0.586 . . . . 88.9 111.244 175.613 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 76.4 p -118.92 150.24 40.22 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 123.286 0.635 . . . . 61.96 109.818 -172.052 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 24.0 pt -129.67 173.26 14.35 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 N-CA-C 107.888 -1.153 . . . . 48.05 107.888 169.617 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 5.0 tm-20 -97.82 129.23 44.82 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 108.748 -0.834 . . . . 53.38 108.748 178.666 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 22.4 tptm -144.23 129.37 18.66 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 107.931 -1.137 . . . . 131.39 107.931 173.19 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 58.1 mm-40 59.76 22.61 11.47 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.494 0.553 . . . . 81.62 112.494 176.771 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 89.91 -7.27 82.04 Favored Glycine 0 N--CA 1.437 -1.275 0 CA-C-O 118.622 -1.099 . . . . 53.2 115.528 -176.191 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 1.9 mm100 -109.65 153.01 24.84 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 119.4 1.6 . . . . 88.22 110.589 -178.701 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 69.4 m -78.75 114.15 17.43 Favored 'General case' 0 CA--C 1.514 -0.414 0 N-CA-C 108.177 -1.046 . . . . 73.82 108.177 171.427 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 4.2 m -124.95 170.87 14.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 N-CA-C 108.725 -0.842 . . . . 59.82 108.725 -178.141 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' THR . . . . . 0.693 HG21 ' OH ' ' B' ' 87' ' ' TYR . 1.2 p -63.93 144.02 57.4 Favored 'General case' 0 CA--C 1.514 -0.406 0 CA-C-N 114.614 -1.175 . . . . 90.04 109.68 -179.884 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ASN . . . . . 0.414 ' OD1' ' C ' ' A' ' 84' ' ' ASN . 10.2 t-20 -96.1 102.72 14.55 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 108.562 -0.903 . . . . 69.92 108.562 173.321 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 33.3 m-20 -52.35 -29.17 22.47 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 112.901 0.704 . . . . 110.14 112.901 178.964 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 67.7 m-20 -86.02 5.65 32.44 Favored 'General case' 0 C--O 1.239 0.537 0 N-CA-C 113.754 1.02 . . . . 89.68 113.754 -176.488 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 64.4 t80 -59.88 127.52 32.33 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 118.545 0.612 . . . . 71.84 110.976 -171.494 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 61.16 20.58 11.09 Favored 'General case' 0 C--O 1.236 0.342 0 N-CA-C 113.643 0.979 . . . . 52.84 113.643 172.183 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 17.6 mmtm -61.11 -53.46 56.72 Favored 'General case' 0 C--O 1.24 0.573 0 O-C-N 119.941 -1.724 . . . . 93.84 110.965 168.088 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 99.6 t -63.14 -48.08 89.44 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.343 0 C-N-CA 119.67 -0.812 . . . . 46.14 109.986 178.143 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 77.4 t80 -50.98 -50.37 58.44 Favored 'General case' 0 C--O 1.233 0.21 0 C-N-CA 120.531 -0.468 . . . . 48.12 110.607 178.708 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 99.9 m-20 -54.78 -50.37 68.64 Favored 'General case' 0 C--O 1.241 0.625 0 CA-C-O 121.104 0.478 . . . . 60.22 111.551 179.078 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 16.9 m -55.94 -48.39 75.84 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 119.376 -0.93 . . . . 59.81 110.781 -178.814 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 86.3 mt -60.45 -45.52 93.38 Favored 'General case' 0 C--O 1.242 0.664 0 CA-C-O 121.617 0.722 . . . . 53.0 110.722 179.643 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 2.7 tptp -72.98 -23.31 60.64 Favored 'General case' 0 C--N 1.321 -0.657 0 C-N-CA 120.107 -0.637 . . . . 60.15 111.73 -169.533 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 54.4 m-20 -78.93 -15.35 58.42 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 118.993 -1.083 . . . . 102.47 113.071 -178.479 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' MET . . . . . 0.558 ' HE1' ' HA ' ' A' ' 150' ' ' ILE . 62.0 mtp -63.64 137.34 58.06 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 119.73 -0.788 . . . . 77.3 109.624 -178.285 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 29.1 t -63.91 -26.22 68.5 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.453 -0.794 . . . . 77.79 112.284 -173.523 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 18.0 p -96.69 2.3 51.93 Favored 'General case' 0 C--O 1.239 0.53 0 N-CA-C 113.244 0.831 . . . . 71.17 113.244 -171.143 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 42.7 t -101.48 140.12 20.94 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.161 0 C-N-CA 124.753 1.221 . . . . 47.74 108.597 -176.48 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.622 ' HD3' ' OE1' ' A' ' 140' ' ' GLU . 38.8 tttm -112.11 -35.11 5.74 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 115.324 1.601 . . . . 88.11 115.324 -177.678 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' SER . . . . . 0.406 ' OG ' ' O ' ' A' ' 301' ' ' HOH . 83.7 p -150.39 148.24 28.54 Favored 'General case' 0 C--O 1.239 0.544 0 N-CA-C 107.394 -1.335 . . . . 44.69 107.394 175.271 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 43.7 t -134.15 110.37 13.67 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 N-CA-C 105.303 -2.11 . . . . 42.1 105.303 -179.466 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 17.9 m -116.12 127.66 55.02 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 122.599 0.36 . . . . 41.17 111.576 -173.107 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 35.7 t80 -66.61 139.42 57.89 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 119.618 -0.833 . . . . 49.09 111.347 175.765 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 10.9 t -136.15 95.67 3.24 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 106.714 -1.588 . . . . 52.13 106.714 175.395 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 1.5 p -50.93 161.66 0.35 Allowed 'General case' 0 C--O 1.236 0.392 0 C-N-CA 123.399 0.68 . . . . 55.86 112.761 179.568 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' LYS . . . . . 0.434 ' HB2' ' HB2' ' A' ' 133' ' ' LEU . 23.8 pttm -69.85 -34.29 73.42 Favored 'General case' 0 C--O 1.246 0.892 0 C-N-CA 118.574 -1.25 . . . . 68.96 111.455 173.015 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.539 ' CD ' ' H ' ' A' ' 109' ' ' GLU . 12.7 mp0 -52.08 -54.0 35.54 Favored 'General case' 0 C--O 1.247 0.95 0 CA-C-O 121.938 0.875 . . . . 68.51 110.684 173.835 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -59.44 -45.49 91.43 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 115.33 -0.85 . . . . 102.69 111.255 -177.945 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 -57.53 -39.45 76.62 Favored 'General case' 0 C--O 1.245 0.833 0 C-N-CA 119.208 -0.997 . . . . 89.41 109.697 -177.212 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 62.6 t80 -70.97 -41.63 70.77 Favored 'General case' 0 C--O 1.241 0.647 0 CA-C-N 115.761 -0.654 . . . . 65.9 112.018 -179.181 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 74.1 mt-10 -62.57 -41.07 98.7 Favored 'General case' 0 CA--C 1.516 -0.328 0 C-N-CA 117.345 -1.742 . . . . 96.47 110.026 179.73 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.678 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 0.0 OUTLIER -63.72 -38.53 91.47 Favored 'General case' 0 C--O 1.238 0.473 0 C-N-CA 120.84 -0.344 . . . . 101.36 111.698 178.85 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 20.3 tp -64.8 -42.31 95.13 Favored 'General case' 0 C--O 1.246 0.906 0 N-CA-C 112.448 0.536 . . . . 75.26 112.448 177.845 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 72.2 p -65.04 -39.9 94.01 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 119.983 -0.687 . . . . 53.05 111.474 173.277 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -62.61 -31.87 72.78 Favored 'General case' 0 C--O 1.236 0.361 0 O-C-N 122.07 -0.394 . . . . 85.48 111.034 179.132 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 64.5 mt -85.51 -32.71 7.26 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.991 0 N-CA-C 113.325 0.861 . . . . 61.93 113.325 -178.919 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 11.3 mtp -110.66 2.91 18.85 Favored 'General case' 0 C--N 1.348 0.53 0 N-CA-C 114.674 1.361 . . . . 86.36 114.674 -166.813 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 120.93 -21.03 8.46 Favored Glycine 0 N--CA 1.449 -0.475 0 N-CA-C 116.138 1.215 . . . . 93.19 116.138 153.377 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -172.14 172.03 4.73 Favored 'General case' 0 CA--C 1.51 -0.58 0 N-CA-C 107.413 -1.328 . . . . 123.61 107.413 -178.849 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -77.32 143.28 38.91 Favored 'General case' 0 C--O 1.24 0.575 0 CA-C-N 115.041 -0.982 . . . . 114.73 110.98 -179.403 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' TRP . . . . . 0.415 ' HE3' ' N ' ' A' ' 123' ' ' TRP . 0.1 OUTLIER -77.67 69.02 3.85 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-N 115.78 -0.646 . . . . 81.74 110.158 172.195 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' LYS . . . . . 0.781 ' HD3' ' O ' ' A' ' 305' ' ' HOH . 3.9 mppt? -35.25 -51.97 0.59 Allowed 'General case' 0 CA--C 1.511 -0.553 0 C-N-CA 123.76 0.824 . . . . 85.34 110.488 -171.164 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 8.7 pt -73.24 -18.26 18.02 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.699 0 C-N-CA 118.659 -1.216 . . . . 57.4 111.617 -157.895 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -89.44 -15.55 32.92 Favored 'General case' 0 C--O 1.242 0.681 0 N-CA-C 113.516 0.932 . . . . 62.29 113.516 177.689 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' GLU . . . . . 0.412 ' O ' ' O49' ' A' ' 201' ' ' DMU . 74.5 mt-10 -71.9 -10.9 60.44 Favored 'General case' 0 C--O 1.234 0.263 0 N-CA-C 113.831 1.048 . . . . 89.93 113.831 -163.736 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . -77.21 -20.83 74.7 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 118.997 -1.573 . . . . 74.14 115.021 171.328 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 42.0 m-20 -109.79 -176.16 2.93 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 118.771 1.286 . . . . 66.49 111.719 -171.016 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -73.98 143.64 45.53 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.552 -0.749 . . . . 65.01 109.863 -170.368 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 40.5 t-20 -74.72 118.88 73.69 Favored Pre-proline 0 C--O 1.237 0.406 0 N-CA-C 108.117 -1.068 . . . . 66.61 108.117 -179.329 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -92.57 4.05 3.57 Favored 'Trans proline' 0 C--O 1.238 0.493 0 N-CA-C 114.759 1.023 . . . . 62.21 114.759 -174.558 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.434 ' HB2' ' HB2' ' A' ' 108' ' ' LYS . 49.6 mt -65.12 164.13 13.65 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 122.229 1.014 . . . . 78.6 111.027 166.299 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' TYR . . . . . 0.45 ' HD2' ' O ' ' A' ' 64' ' ' ILE . 88.0 m-85 -103.27 134.24 47.01 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.563 -0.744 . . . . 120.3 110.153 174.674 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 91.2 m-20 -42.15 138.16 1.71 Allowed 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 107.215 -1.402 . . . . 67.32 107.215 154.306 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -133.67 162.42 31.99 Favored 'General case' 0 C--N 1.345 0.402 0 CA-C-O 121.671 0.748 . . . . 55.06 111.129 178.074 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' TYR . . . . . 0.573 ' CE2' HD11 ' A' ' 64' ' ' ILE . 45.9 m-85 -110.6 127.38 55.21 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 107.043 -1.465 . . . . 48.85 107.043 164.851 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' ILE . . . . . . . . . . . . . 18.2 mm -89.32 109.0 19.79 Favored 'Isoleucine or valine' 0 C--O 1.235 0.341 0 N-CA-C 107.398 -1.334 . . . . 44.09 107.398 172.805 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' VAL . . . . . 0.655 HG22 ' HB ' ' A' ' 60' ' ' VAL . 1.4 m -105.83 138.61 30.26 Favored 'Isoleucine or valine' 0 C--O 1.24 0.585 0 CA-C-O 121.547 0.689 . . . . 55.08 109.936 -178.81 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.622 ' OE1' ' HD3' ' A' ' 101' ' ' LYS . 60.2 tt0 -101.67 125.94 48.42 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 108.592 -0.892 . . . . 62.78 108.592 175.179 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -84.23 154.5 22.99 Favored 'General case' 0 CA--C 1.531 0.239 0 O-C-N 123.312 0.383 . . . . 52.83 110.175 173.356 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 88.8 m-20 -66.4 -36.93 84.08 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 119.948 -0.701 . . . . 76.81 111.928 178.416 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -150.42 159.84 34.05 Favored Pre-proline 0 C--N 1.327 -0.373 0 N-CA-C 108.553 -0.906 . . . . 66.71 108.553 174.539 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' PRO . . . . . 0.725 ' HG3' HD22 ' A' ' 57' ' ' ASN . 79.9 Cg_exo -56.14 -38.46 94.85 Favored 'Trans proline' 0 C--O 1.236 0.394 0 N-CA-C 113.565 0.564 . . . . 76.66 113.565 -173.718 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' ASN . . . . . 0.401 ' HA ' ' O ' ' A' ' 302' ' ' HOH . 97.3 m-20 -67.42 -1.17 4.4 Favored 'General case' 0 C--N 1.334 -0.089 0 N-CA-C 113.309 0.855 . . . . 82.26 113.309 179.886 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' ASP . . . . . 0.801 ' O ' HG22 ' A' ' 149' ' ' THR . 75.9 m-20 -89.93 -26.36 20.46 Favored 'General case' 0 C--O 1.243 0.742 0 CA-C-N 119.209 0.913 . . . . 75.7 112.386 168.18 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 43.0 t -46.28 -56.92 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.318 0 CA-C-O 121.323 0.582 . . . . 70.76 110.75 -168.136 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' LYS . . . . . 0.77 ' HE2' ' HA ' ' A' ' 148' ' ' LYS . 9.3 mmpt? -62.62 -41.63 99.11 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 118.959 -1.096 . . . . 119.74 111.65 -171.968 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' THR . . . . . 0.801 HG22 ' O ' ' A' ' 146' ' ' ASP . 13.5 t -61.3 -34.13 74.72 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 118.529 -1.268 . . . . 88.92 110.622 177.026 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' ILE . . . . . 0.558 ' HA ' ' HE1' ' A' ' 97' ' ' MET . 7.0 mt -67.6 -45.64 84.58 Favored 'Isoleucine or valine' 0 C--O 1.241 0.62 0 C-N-CA 120.216 -0.594 . . . . 63.42 109.746 175.181 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -61.23 -42.61 98.91 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 117.86 -1.536 . . . . 70.1 110.245 -175.016 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 80.4 mt-10 -54.78 -58.14 8.75 Favored 'General case' 0 C--O 1.241 0.644 0 CA-C-O 121.293 0.568 . . . . 116.03 110.325 176.149 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 72.9 m-20 -58.03 -45.31 87.16 Favored 'General case' 0 C--O 1.238 0.477 0 C-N-CA 119.67 -0.812 . . . . 81.33 110.488 -173.639 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -56.99 -35.42 69.17 Favored 'General case' 0 C--O 1.232 0.181 0 C-N-CA 120.474 -0.49 . . . . 68.42 112.154 -177.571 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 37.9 tttt -74.31 -6.66 49.32 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 116.032 -2.267 . . . . 110.65 111.94 -173.437 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 28.4 mtpt -93.2 -15.15 26.24 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 113.751 1.019 . . . . 112.51 113.751 179.372 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' ILE . . . . . . . . . . . . . 41.1 mt -67.49 120.76 15.39 Favored 'Isoleucine or valine' 0 C--O 1.239 0.501 0 N-CA-C 109.127 -0.694 . . . . 72.86 109.127 177.105 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 158' ' ' GLU . . . . . 0.437 ' HA ' ' OE1' ' A' ' 158' ' ' GLU . 23.4 tp10 -61.08 142.15 56.88 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 118.03 -1.468 . . . . 102.88 109.832 179.284 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . 89.41 -9.24 77.76 Favored Glycine 0 N--CA 1.438 -1.198 0 C-N-CA 119.406 -1.378 . . . . 61.71 114.804 -170.984 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 160' ' ' VAL . . . . . . . . . . . . . 12.8 t -86.62 122.87 39.29 Favored 'Isoleucine or valine' 0 C--O 1.239 0.549 0 N-CA-C 107.163 -1.421 . . . . 67.79 107.163 169.821 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 16.2 t -85.83 -55.02 4.16 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.167 -0.47 . . . . 86.1 111.259 178.15 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 23.1 mm-40 -135.63 172.4 13.07 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.725 0.774 . . . . 115.85 110.082 -173.774 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 163' ' ' VAL . . . . . . . . . . . . . 54.3 t -143.73 115.07 2.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 N-CA-C 108.451 -0.944 . . . . 81.23 108.451 175.585 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 164' ' ' GLN . . . . . 0.447 ' HB3' ' HB ' ' A' ' 61' ' ' VAL . 40.7 tt0 -95.26 95.85 8.78 Favored 'General case' 0 C--O 1.238 0.469 0 N-CA-C 109.157 -0.682 . . . . 89.75 109.157 179.527 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 165' ' ' ASP . . . . . 0.448 ' HB3' ' NZ ' ' A' ' 148' ' ' LYS . 0.3 OUTLIER . . . . . 0 C--N 1.327 -0.408 0 CA-C-N 115.768 -0.651 . . . . 110.31 112.695 -178.378 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' DMU . . . . . 0.412 ' O49' ' O ' ' A' ' 127' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 201' ' ' HOH . . . . . 0.759 ' O ' ' HA ' ' B' ' 83' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 203' ' ' HOH . . . . . 0.54 ' O ' ' HB2' ' B' ' 132' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 301' ' ' HOH . . . . . 0.406 ' O ' ' OG ' ' A' ' 102' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 302' ' ' HOH . . . . . 0.401 ' O ' ' HA ' ' A' ' 145' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 305' ' ' HOH . . . . . 0.781 ' O ' ' HD3' ' A' ' 124' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_