data_3h1f_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 3h1f _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 67.3 mmm . . . . . 0 N--CA 1.495 1.778 0 N-CA-C 108.229 -1.026 . . . . 18.670000000000002 108.229 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 39.2 mttt -91.16 115.77 28.28 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.103 1.361 . . . . 21.5 112.344 -177.363 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 5.4 mt -107.71 144.83 34.27 Favored 'General case' 0 C--O 1.24 0.604 0 CA-C-N 115.484 -0.78 . . . . 16.649999999999999 109.03 -173.108 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 8.6 tp -122.3 128.84 51.56 Favored 'General case' 0 C--O 1.212 -0.895 0 N-CA-C 107.282 -1.377 . . . . 10.789999999999999 107.282 169.238 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 53.1 t -115.17 123.09 70.44 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.168 0 N-CA-C 108.741 -0.837 . . . . 9.0199999999999996 108.741 -176.914 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 12.5 t -120.37 117.38 53.18 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.899 0 CA-C-N 118.098 0.408 . . . . 9.8200000000000003 110.363 -173.118 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 12.0 t0 -162.7 133.24 4.71 Favored 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 107.547 -1.279 . . . . 15.9 107.547 179.314 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 30.0 p30 -80.4 4.19 18.85 Favored 'General case' 0 N--CA 1.495 1.816 0 N-CA-C 113.665 0.987 . . . . 14.41 113.665 178.348 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 1.4 t -102.57 113.72 27.33 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 107.907 -1.146 . . . . 13.68 107.907 176.922 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 77.1 p -69.22 -34.8 75.42 Favored 'General case' 0 C--O 1.222 -0.368 0 CA-C-N 116.244 -0.434 . . . . 18.73 110.651 -173.153 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 64.9 p -71.18 -33.92 70.44 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 114.173 1.175 . . . . 20.620000000000001 114.173 175.559 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 37.5 tpp -63.94 -46.61 83.96 Favored 'General case' 0 C--O 1.218 -0.594 0 CA-C-O 118.41 -0.805 . . . . 15.390000000000001 109.558 172.199 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 60.4 mtm-85 -51.04 -41.19 59.7 Favored 'General case' 0 N--CA 1.494 1.726 0 N-CA-C 113.359 0.874 . . . . 14.76 113.359 173.407 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 27.0 ttm180 -61.3 -46.47 90.19 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 123.883 0.873 . . . . 15.869999999999999 111.174 176.396 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.5 tt -69.31 -42.64 81.38 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.876 0 C-N-CA 119.655 -0.818 . . . . 22.960000000000001 110.367 -174.682 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 79.9 mt -65.49 -43.31 94.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 107.854 -1.165 . . . . 19.93 107.854 -176.707 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 57.6 tttm -61.34 -49.0 78.73 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 124.199 0.937 . . . . 15.77 112.921 -178.886 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -58.01 -39.2 77.72 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 114.41 1.263 . . . . 26.609999999999999 114.41 171.407 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 40.6 m -71.7 -48.38 47.73 Favored 'General case' 0 C--O 1.248 1.02 0 N-CA-C 108.313 -0.995 . . . . 17.059999999999999 108.313 -178.26 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 95.6 mt -51.43 -50.49 59.62 Favored 'General case' 0 C--O 1.243 0.719 0 C-N-CA 119.548 -0.861 . . . . 15.609999999999999 108.702 171.546 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 36.4 t -50.46 -45.42 56.1 Favored 'General case' 0 CA--C 1.553 1.06 0 N-CA-C 113.624 0.972 . . . . 16.690000000000001 113.624 179.461 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' ARG . . . . . 0.671 ' NH2' ' O ' ' A' ' 169' ' ' HOH . 74.0 mtp180 -66.95 -24.79 66.11 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 126.254 1.821 . . . . 38.969999999999999 112.079 -178.052 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 31.2 mt -88.3 2.45 52.41 Favored 'General case' 0 CA--C 1.555 1.142 0 N-CA-C 113.785 1.031 . . . . 18.600000000000001 113.785 170.634 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 90.73 21.91 35.28 Favored Glycine 0 CA--C 1.5 -0.852 0 N-CA-C 111.673 -0.571 . . . . 15.93 111.673 170.94 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 62.4 m-85 -108.86 104.18 13.39 Favored 'General case' 0 N--CA 1.479 1.007 0 N-CA-C 113.742 1.016 . . . . 22.690000000000001 113.742 178.496 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' GLU . . . . . 0.503 ' O ' ' O ' ' A' ' 133' ' ' HOH . 40.2 mm-40 -105.5 -25.24 12.4 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 114.41 1.263 . . . . 23.239999999999998 114.41 -166.942 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 41.8 t0 -94.28 78.72 3.95 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 106.501 -1.666 . . . . 17.129999999999999 106.501 -172.602 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 10.7 t -113.04 118.79 58.94 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-N 115.415 -0.811 . . . . 14.85 109.156 -174.972 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 26.6 tp -96.45 142.08 28.97 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 119.31 -0.956 . . . . 12.69 109.404 169.605 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 77.4 mt-10 -108.46 156.73 19.13 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 113.571 0.952 . . . . 15.92 113.571 179.397 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -144.4 163.65 33.16 Favored 'General case' 0 C--O 1.211 -0.943 0 N-CA-C 107.581 -1.266 . . . . 14.07 107.581 174.167 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -111.36 -32.01 6.87 Favored 'General case' 0 C--O 1.247 0.946 0 O-C-N 121.623 -0.673 . . . . 26.859999999999999 110.873 -176.151 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 57.2 m80 -138.52 162.0 35.63 Favored 'General case' 0 N--CA 1.43 -1.455 0 CA-C-N 114.592 -1.186 . . . . 15.74 108.165 -174.629 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -55.76 -33.96 60.43 Favored Glycine 0 N--CA 1.44 -1.071 0 CA-C-O 119.037 -0.868 . . . . 15.92 113.127 -177.635 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 63.0 t -66.16 -45.34 90.51 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.5 0 N-CA-C 114.559 1.318 . . . . 17.640000000000001 114.559 -177.329 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' GLU . . . . . 0.407 ' CG ' ' O ' ' A' ' 159' ' ' HOH . 73.2 tt0 -70.12 -35.79 74.36 Favored 'General case' 0 CA--C 1.497 -1.069 0 N-CA-C 107.764 -1.199 . . . . 19.239999999999998 107.764 179.717 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -62.91 -49.2 75.72 Favored 'General case' 0 C--O 1.253 1.274 0 N-CA-C 108.529 -0.915 . . . . 15.68 108.529 176.196 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 70.5 t-105 -60.16 -43.28 95.92 Favored 'General case' 0 CA--C 1.557 1.229 0 C-N-CA 119.284 -0.966 . . . . 18.73 113.36 177.261 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 11.4 tm-20 -62.14 -36.47 81.89 Favored 'General case' 0 C--O 1.238 0.488 0 C-N-CA 118.247 -1.381 . . . . 28.579999999999998 109.676 179.505 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 70.8 mttt -68.91 -47.67 65.22 Favored 'General case' 0 N--CA 1.445 -0.71 0 C-N-CA 119.661 -0.815 . . . . 16.510000000000002 111.172 -179.069 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 67.5 mt -54.25 -48.6 70.97 Favored 'General case' 0 N--CA 1.434 -1.231 0 N-CA-C 109.695 -0.483 . . . . 16.039999999999999 109.695 172.777 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -62.37 -38.92 91.43 Favored 'General case' 0 CA--C 1.566 1.57 0 N-CA-C 113.509 0.929 . . . . 21.809999999999999 113.509 -174.051 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -85.04 -19.71 31.55 Favored 'General case' 0 C--O 1.18 -2.558 0 C-N-CA 124.187 0.995 . . . . 13.9 113.212 -178.615 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 28.5 m-80 -133.66 75.22 1.59 Allowed 'General case' 0 C--N 1.314 -0.97 0 O-C-N 120.965 -1.084 . . . . 18.920000000000002 108.465 -177.605 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -77.3 -14.22 59.78 Favored 'General case' 0 N--CA 1.44 -0.945 0 C-N-CA 124.59 1.156 . . . . 14.85 112.707 -171.313 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 18.9 p-10 -69.34 -5.3 22.4 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 125.16 1.384 . . . . 18.399999999999999 110.231 172.51 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 61.4 m -56.82 140.75 46.99 Favored 'General case' 0 C--O 1.209 -1.035 0 C-N-CA 119.825 -0.75 . . . . 15.539999999999999 109.108 175.408 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 52.3 mmtt -106.02 -34.26 7.63 Favored 'General case' 0 CA--C 1.498 -1.048 0 N-CA-C 112.355 0.502 . . . . 25.239999999999998 112.355 -169.439 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 98.9 t -139.83 124.52 19.87 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 O-C-N 123.961 0.788 . . . . 13.99 109.753 -173.523 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 18.9 tp -99.31 129.14 45.5 Favored 'General case' 0 C--O 1.214 -0.783 0 N-CA-C 105.124 -2.176 . . . . 11.85 105.124 174.785 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 39.8 mt -117.92 120.46 64.64 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 N-CA-C 108.255 -1.017 . . . . 15.17 108.255 170.264 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 14.2 t -135.95 143.63 44.99 Favored 'General case' 0 C--O 1.205 -1.24 0 O-C-N 121.05 -1.031 . . . . 11.32 113.588 -172.063 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -76.13 -173.17 2.28 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 108.828 -0.805 . . . . 9.6099999999999994 108.828 162.331 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 2.1 t90 -115.35 -60.92 1.82 Allowed 'General case' 0 N--CA 1.432 -1.335 0 N-CA-C 106.68 -1.6 . . . . 14.24 106.68 -174.76 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ASN . . . . . 0.421 ' ND2' ' OE2' ' A' ' 85' ' ' GLU . 74.9 m-80 -75.7 113.44 13.16 Favored 'General case' 0 CA--C 1.516 -0.328 0 O-C-N 124.535 1.147 . . . . 17.210000000000001 112.301 -174.845 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 12.2 ptt? -167.67 145.01 3.71 Favored Pre-proline 0 CA--C 1.506 -0.745 0 N-CA-C 112.028 0.381 . . . . 23.27 112.028 176.602 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -66.35 166.94 19.85 Favored 'Trans proline' 0 C--O 1.205 -1.127 0 O-C-N 123.812 1.428 . . . . 18.039999999999999 108.664 175.619 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 78.1 mt-10 58.27 43.51 20.1 Favored 'General case' 0 N--CA 1.438 -1.068 0 CA-C-O 121.343 0.592 . . . . 15.33 111.867 176.288 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 52.6 ttp 96.81 114.36 0.02 OUTLIER 'General case' 0 C--O 1.219 -0.522 0 C-N-CA 126.868 2.067 . . . . 18.359999999999999 110.477 173.52 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 20.0 p30 -68.02 168.28 12.23 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.817 0.673 . . . . 15.199999999999999 112.817 176.081 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -73.01 -28.37 66.77 Favored Glycine 0 C--O 1.19 -2.627 0 C-N-CA 120.501 -0.856 . . . . 12.630000000000001 113.891 -177.43 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 15.9 tp -55.3 -53.47 55.76 Favored 'General case' 0 N--CA 1.478 0.965 0 O-C-N 122.364 -0.492 . . . . 11.75 111.852 169.966 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 -67.43 -39.01 85.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.863 0.363 . . . . 11.630000000000001 110.217 177.116 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 52.9 tp -51.95 -48.7 64.17 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 118.544 -1.262 . . . . 12.880000000000001 111.941 169.509 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 54.2 t -64.62 -50.36 76.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 C-N-CA 119.251 -0.979 . . . . 14.91 111.274 -177.029 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 62.1 mttt -54.16 -40.76 67.78 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 119.177 -1.009 . . . . 20.550000000000001 113.242 175.933 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -66.15 -40.07 90.3 Favored 'General case' 0 N--CA 1.437 -1.125 0 O-C-N 121.688 -0.632 . . . . 19.559999999999999 110.864 -179.716 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 54.4 t -62.08 -52.26 62.56 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.865 0 N-CA-C 113.071 0.767 . . . . 15.99 113.071 175.14 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 51.1 mmt-85 -55.53 -32.73 63.19 Favored 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 115.922 1.823 . . . . 18.050000000000001 115.922 175.521 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 11.9 m -77.05 -17.83 58.49 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 125.464 1.506 . . . . 22.920000000000002 113.481 176.545 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -83.15 130.65 35.12 Favored 'General case' 0 N--CA 1.408 -2.538 0 N-CA-C 105.714 -1.958 . . . . 17.43 105.714 -176.914 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -54.83 -21.94 12.89 Favored 'General case' 0 CA--C 1.547 0.848 0 N-CA-C 118.112 2.634 . . . . 23.77 118.112 174.397 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.89 4.68 47.49 Favored 'General case' 0 N--CA 1.431 -1.398 0 C-N-CA 115.286 -2.566 . . . . 20.809999999999999 117.128 174.797 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 24.4 m-85 -129.83 25.96 5.28 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 124.918 1.287 . . . . 18.050000000000001 113.11 -173.369 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 5.8 mmmt -70.01 -35.41 74.33 Favored 'General case' 0 CA--C 1.556 1.198 0 N-CA-C 113.991 1.108 . . . . 31.949999999999999 113.991 -178.561 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 58.7 mm-40 -100.24 -3.09 32.2 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 115.529 1.677 . . . . 19.41 115.529 176.743 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 9.2 tt -54.79 123.16 44.56 Favored Pre-proline 0 C--O 1.241 0.64 0 C-N-CA 119.001 -1.079 . . . . 14.5 111.015 177.504 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -58.96 129.75 33.42 Favored 'Trans proline' 0 CA--C 1.537 0.648 0 O-C-N 122.59 0.784 . . . . 12.27 112.129 173.389 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 84.1 mt -121.78 117.33 52.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 122.198 0.999 . . . . 10.029999999999999 113.096 179.347 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 14.1 mt -107.18 118.65 55.36 Favored 'Isoleucine or valine' 0 N--CA 1.408 -2.544 0 CA-C-N 113.957 -1.474 . . . . 10.65 109.412 175.027 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 35.7 ttm -94.08 127.08 39.69 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 119.111 -1.036 . . . . 18.719999999999999 113.72 168.512 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 54.4 mt -118.36 109.8 28.28 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.183 0 N-CA-C 107.051 -1.463 . . . . 13.779999999999999 107.051 176.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 9.2 t -146.59 152.99 39.82 Favored 'General case' 0 C--O 1.249 1.029 0 N-CA-C 113.909 1.078 . . . . 12.25 113.909 -165.555 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 43.4 p -73.6 -13.62 61.04 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.727 -1.124 . . . . 13.74 112.669 168.398 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' GLU . . . . . 0.421 ' OE2' ' ND2' ' A' ' 55' ' ' ASN . 78.6 mm-40 -65.07 80.12 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.747 0.784 . . . . 21.25 110.857 175.263 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -78.97 -13.19 83.34 Favored Glycine 0 C--O 1.21 -1.368 0 N-CA-C 116.265 1.266 . . . . 13.81 116.265 178.463 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -70.43 147.12 43.45 Favored Glycine 0 C--O 1.219 -0.825 0 CA-C-N 119.579 1.689 . . . . 12.199999999999999 110.956 -175.742 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 15.0 mmtm -69.65 -31.62 69.8 Favored 'General case' 0 C--O 1.251 1.152 0 CA-C-N 117.769 0.785 . . . . 15.779999999999999 112.027 -174.171 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -51.63 -41.35 61.22 Favored 'General case' 0 C--O 1.247 0.969 0 CA-C-N 115.79 -0.641 . . . . 11.369999999999999 109.593 175.677 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 8.9 mp0 -76.91 -37.75 54.79 Favored 'General case' 0 CA--C 1.492 -1.287 0 N-CA-C 105.562 -2.014 . . . . 12.99 105.562 -175.07 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 71.2 t -59.86 -53.32 50.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 N-CA-C 108.242 -1.022 . . . . 12.75 108.242 176.526 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 5.6 mt -53.55 -49.15 57.12 Favored 'Isoleucine or valine' 0 C--O 1.259 1.585 0 N-CA-C 113.429 0.899 . . . . 17.260000000000002 113.429 176.21 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 47.5 m -50.87 -44.61 59.68 Favored 'General case' 0 CA--C 1.505 -0.752 0 CA-C-N 115.865 -0.607 . . . . 15.359999999999999 110.787 -178.405 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -74.81 -38.39 62.08 Favored 'General case' 0 CA--C 1.562 1.408 0 N-CA-C 117.361 2.356 . . . . 14.25 117.361 -177.577 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 54.3 mt -64.85 -39.02 92.89 Favored 'General case' 0 C--O 1.189 -2.097 0 N-CA-C 108.126 -1.064 . . . . 11.69 108.126 174.58 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 50.4 mtpt -57.38 -36.84 71.77 Favored 'General case' 0 N--CA 1.501 2.091 0 C-N-CA 124.358 1.063 . . . . 13.699999999999999 111.223 175.867 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -79.47 -18.26 52.46 Favored 'General case' 0 N--CA 1.434 -1.232 0 CA-C-O 118.687 -0.673 . . . . 11.08 110.532 -177.09 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 123.49 5.07 7.97 Favored Glycine 0 C--O 1.218 -0.857 0 N-CA-C 116.814 1.486 . . . . 10.02 116.814 -178.0 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 84.8 t -66.43 130.62 31.94 Favored 'Isoleucine or valine' 0 C--O 1.265 1.875 0 N-CA-C 109.65 -0.5 . . . . 13.33 109.65 173.321 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 23.7 m-80 -99.93 -29.4 12.59 Favored 'General case' 0 C--O 1.202 -1.446 0 C-N-CA 119.256 -0.978 . . . . 13.9 113.261 -178.219 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 60.0 m-80 -139.09 140.2 37.93 Favored 'General case' 0 C--N 1.317 -0.828 0 C-N-CA 119.183 -1.007 . . . . 16.75 111.819 175.13 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 8.5 t80 -125.16 122.5 37.26 Favored 'General case' 0 C--N 1.32 -0.688 0 C-N-CA 119.391 -0.924 . . . . 13.31 109.361 -172.928 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 88.3 mt -115.43 130.55 69.83 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.029 0 N-CA-C 106.307 -1.738 . . . . 12.35 106.307 179.13 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 48.9 t -101.6 126.15 55.55 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.645 0 N-CA-C 108.511 -0.922 . . . . 12.529999999999999 108.511 -174.398 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 71.9 mttt -75.42 151.43 85.34 Favored Pre-proline 0 CA--C 1.544 0.747 0 O-C-N 124.538 1.149 . . . . 13.73 109.082 169.067 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -94.15 171.04 17.76 Favored 'Cis proline' 0 CA--C 1.546 1.108 0 C-N-CA 121.891 -2.129 . . . . 13.94 113.209 3.39 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -146.32 148.43 32.39 Favored 'General case' 0 N--CA 1.432 -1.336 0 O-C-N 123.894 0.746 . . . . 15.619999999999999 111.684 178.304 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 22.3 p -64.54 156.67 76.61 Favored Pre-proline 0 C--O 1.263 1.797 0 C-N-CA 119.627 -0.829 . . . . 16.940000000000001 112.715 159.708 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_exo -52.59 -39.08 76.39 Favored 'Trans proline' 0 C--N 1.36 1.161 0 O-C-N 122.677 0.83 . . . . 19.23 111.844 174.893 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' GLN . . . . . 0.426 ' OE1' ' O ' ' A' ' 146' ' ' HOH . 40.0 tp60 -73.58 -32.79 64.31 Favored 'General case' 0 N--CA 1.453 -0.295 0 O-C-N 124.117 0.885 . . . . 18.710000000000001 113.356 -177.913 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 51.5 t -68.72 -39.97 80.94 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.847 0 N-CA-C 108.99 -0.744 . . . . 15.609999999999999 108.99 174.748 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 15.2 tp -62.63 -38.57 90.76 Favored 'General case' 0 N--CA 1.482 1.127 0 N-CA-C 113.54 0.941 . . . . 16.850000000000001 113.54 177.798 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 52.5 tttm -60.71 -52.19 66.16 Favored 'General case' 0 C--O 1.204 -1.312 0 C-N-CA 124.004 0.922 . . . . 28.780000000000001 113.481 174.885 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -52.78 -53.42 48.49 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.005 0.922 . . . . 26.550000000000001 113.439 170.163 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 84.3 mttt -62.46 -36.03 81.15 Favored 'General case' 0 CA--C 1.563 1.457 0 N-CA-C 116.65 2.093 . . . . 19.739999999999998 116.65 178.601 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 31.4 mt -76.39 -36.1 58.26 Favored 'General case' 0 N--CA 1.484 1.256 0 CA-C-N 118.521 0.601 . . . . 16.140000000000001 110.562 178.391 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -54.62 -47.91 72.86 Favored 'General case' 0 C--O 1.202 -1.433 0 CA-C-N 114.069 -1.423 . . . . 31.059999999999999 113.406 168.997 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 61.5 t -49.1 -46.53 17.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 N-CA-C 113.137 0.791 . . . . 20.960000000000001 113.137 171.2 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 60.3 t -80.37 -38.39 17.96 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.211 0 N-CA-C 115.151 1.538 . . . . 21.300000000000001 115.151 -176.123 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 83.6 mt -119.2 -14.63 9.26 Favored 'General case' 0 CA--C 1.509 -0.634 0 CA-C-N 115.953 -0.567 . . . . 23.649999999999999 111.152 -165.301 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 54.24 -150.05 16.34 Favored Glycine 0 N--CA 1.484 1.841 0 N-CA-C 110.494 -1.042 . . . . 25.329999999999998 110.494 -170.778 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 70.5 p -108.34 162.92 13.65 Favored 'General case' 0 N--CA 1.488 1.431 0 CA-C-N 117.901 0.85 . . . . 26.859999999999999 113.103 173.708 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 47.2 t30 . . . . . 0 C--O 1.22 -0.484 0 C-N-CA 123.263 0.625 . . . . 26.289999999999999 110.668 -177.098 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' HOH . . . . . 0.503 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' HOH . . . . . 0.426 ' O ' ' OE1' ' A' ' 110' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 158' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 159' ' ' HOH . . . . . 0.407 ' O ' ' CG ' ' A' ' 36' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 160' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 161' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 162' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 163' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 164' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 165' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 166' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 167' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 168' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 169' ' ' HOH . . . . . 0.671 ' O ' ' NH2' ' A' ' 22' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 170' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 171' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 172' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 173' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 174' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 175' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 176' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 177' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 178' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 179' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 180' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 181' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 182' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 183' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 184' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 185' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 186' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 187' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 188' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 189' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 190' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 67.3 mmm . . . . . 0 N--CA 1.495 1.778 0 N-CA-C 108.229 -1.026 . . . . 18.67 108.229 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 39.2 mttt -91.16 115.77 28.28 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.103 1.361 . . . . 21.5 112.344 -177.363 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' LEU . . . . . 0.825 HD12 HD13 ' A' ' 20' ' ' LEU . 5.4 mt -107.71 144.83 34.27 Favored 'General case' 0 C--O 1.24 0.604 0 CA-C-N 115.484 -0.78 . . . . 16.65 109.03 -173.108 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 8.6 tp -122.3 128.84 51.56 Favored 'General case' 0 C--O 1.212 -0.895 0 N-CA-C 107.282 -1.377 . . . . 10.79 107.282 169.238 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 53.1 t -115.17 123.09 70.44 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.168 0 N-CA-C 108.741 -0.837 . . . . 9.02 108.741 -176.914 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 12.5 t -120.37 117.38 53.18 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.899 0 CA-C-N 118.098 0.408 . . . . 9.82 110.363 -173.118 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 12.0 t0 -162.7 133.24 4.71 Favored 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 107.547 -1.279 . . . . 15.9 107.547 179.314 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 30.0 p30 -80.4 4.19 18.85 Favored 'General case' 0 N--CA 1.495 1.816 0 N-CA-C 113.665 0.987 . . . . 14.41 113.665 178.348 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 1.4 t -102.57 113.72 27.33 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 107.907 -1.146 . . . . 13.68 107.907 176.922 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 77.1 p -69.22 -34.8 75.42 Favored 'General case' 0 C--O 1.222 -0.368 0 CA-C-N 116.244 -0.434 . . . . 18.73 110.651 -173.153 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 64.9 p -71.18 -33.92 70.44 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 114.173 1.175 . . . . 20.62 114.173 175.559 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' MET . . . . . 0.671 ' O ' HG22 ' A' ' 15' ' ' ILE . 37.5 tpp -63.94 -46.61 83.96 Favored 'General case' 0 C--O 1.218 -0.594 0 CA-C-O 118.41 -0.805 . . . . 15.39 109.558 172.199 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 60.4 mtm-85 -51.04 -41.19 59.7 Favored 'General case' 0 N--CA 1.494 1.726 0 N-CA-C 113.359 0.874 . . . . 14.76 113.359 173.407 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 27.0 ttm180 -61.3 -46.47 90.19 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 123.883 0.873 . . . . 15.87 111.174 176.396 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' ILE . . . . . 0.671 HG22 ' O ' ' A' ' 12' ' ' MET . 1.5 tt -69.31 -42.64 81.38 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.876 0 C-N-CA 119.655 -0.818 . . . . 22.96 110.367 -174.682 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ILE . . . . . 0.429 ' N ' HG23 ' A' ' 15' ' ' ILE . 79.9 mt -65.49 -43.31 94.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 107.854 -1.165 . . . . 19.93 107.854 -176.707 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 57.6 tttm -61.34 -49.0 78.73 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 124.199 0.937 . . . . 15.77 112.921 -178.886 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -58.01 -39.2 77.72 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 114.41 1.263 . . . . 26.61 114.41 171.407 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 40.6 m -71.7 -48.38 47.73 Favored 'General case' 0 C--O 1.248 1.02 0 N-CA-C 108.313 -0.995 . . . . 17.06 108.313 -178.26 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' LEU . . . . . 0.825 HD13 HD12 ' A' ' 3' ' ' LEU . 95.6 mt -51.43 -50.49 59.62 Favored 'General case' 0 C--O 1.243 0.719 0 C-N-CA 119.548 -0.861 . . . . 15.61 108.702 171.546 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 36.4 t -50.46 -45.42 56.1 Favored 'General case' 0 CA--C 1.553 1.06 0 N-CA-C 113.624 0.972 . . . . 16.69 113.624 179.461 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' ARG . . . . . 0.413 ' NH2' ' O ' ' A' ' 169' ' ' HOH . 74.0 mtp180 -66.95 -24.79 66.11 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 126.254 1.821 . . . . 38.97 112.079 -178.052 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 31.2 mt -88.3 2.45 52.41 Favored 'General case' 0 CA--C 1.555 1.142 0 N-CA-C 113.785 1.031 . . . . 18.6 113.785 170.634 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 90.73 21.91 35.28 Favored Glycine 0 CA--C 1.5 -0.852 0 N-CA-C 111.673 -0.571 . . . . 15.93 111.673 170.94 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 62.4 m-85 -108.86 104.18 13.39 Favored 'General case' 0 N--CA 1.479 1.007 0 N-CA-C 113.742 1.016 . . . . 22.69 113.742 178.496 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' GLU . . . . . 0.503 ' O ' ' O ' ' A' ' 133' ' ' HOH . 40.2 mm-40 -105.5 -25.24 12.4 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 114.41 1.263 . . . . 23.24 114.41 -166.942 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 41.8 t0 -94.28 78.72 3.95 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 106.501 -1.666 . . . . 17.13 106.501 -172.602 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 10.7 t -113.04 118.79 58.94 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-N 115.415 -0.811 . . . . 14.85 109.156 -174.972 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' LEU . . . . . 0.537 HD21 ' HD3' ' A' ' 40' ' ' LYS . 26.6 tp -96.45 142.08 28.97 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 119.31 -0.956 . . . . 12.69 109.404 169.605 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 77.4 mt-10 -108.46 156.73 19.13 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 113.571 0.952 . . . . 15.92 113.571 179.397 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -144.4 163.65 33.16 Favored 'General case' 0 C--O 1.211 -0.943 0 N-CA-C 107.581 -1.266 . . . . 14.07 107.581 174.167 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -111.36 -32.01 6.87 Favored 'General case' 0 C--O 1.247 0.946 0 O-C-N 121.623 -0.673 . . . . 26.86 110.873 -176.151 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 57.2 m80 -138.52 162.0 35.63 Favored 'General case' 0 N--CA 1.43 -1.455 0 CA-C-N 114.592 -1.186 . . . . 15.74 108.165 -174.629 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -55.76 -33.96 60.43 Favored Glycine 0 N--CA 1.44 -1.071 0 CA-C-O 119.037 -0.868 . . . . 15.92 113.127 -177.635 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' VAL . . . . . 0.702 HG23 ' O ' ' A' ' 58' ' ' GLU . 63.0 t -66.16 -45.34 90.51 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.5 0 N-CA-C 114.559 1.318 . . . . 17.64 114.559 -177.329 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 36' ' ' GLU . . . . . 0.662 ' HG3' ' O ' ' A' ' 159' ' ' HOH . 73.2 tt0 -70.12 -35.79 74.36 Favored 'General case' 0 CA--C 1.497 -1.069 0 N-CA-C 107.764 -1.199 . . . . 19.24 107.764 179.717 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -62.91 -49.2 75.72 Favored 'General case' 0 C--O 1.253 1.274 0 N-CA-C 108.529 -0.915 . . . . 15.68 108.529 176.196 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 70.5 t-105 -60.16 -43.28 95.92 Favored 'General case' 0 CA--C 1.557 1.229 0 C-N-CA 119.284 -0.966 . . . . 18.73 113.36 177.261 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 11.4 tm-20 -62.14 -36.47 81.89 Favored 'General case' 0 C--O 1.238 0.488 0 C-N-CA 118.247 -1.381 . . . . 28.58 109.676 179.505 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' LYS . . . . . 0.537 ' HD3' HD21 ' A' ' 29' ' ' LEU . 70.8 mttt -68.91 -47.67 65.22 Favored 'General case' 0 N--CA 1.445 -0.71 0 C-N-CA 119.661 -0.815 . . . . 16.51 111.172 -179.069 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 67.5 mt -54.25 -48.6 70.97 Favored 'General case' 0 N--CA 1.434 -1.231 0 N-CA-C 109.695 -0.483 . . . . 16.04 109.695 172.777 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -62.37 -38.92 91.43 Favored 'General case' 0 CA--C 1.566 1.57 0 N-CA-C 113.509 0.929 . . . . 21.81 113.509 -174.051 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -85.04 -19.71 31.55 Favored 'General case' 0 C--O 1.18 -2.558 0 C-N-CA 124.187 0.995 . . . . 13.9 113.212 -178.615 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 28.5 m-80 -133.66 75.22 1.59 Allowed 'General case' 0 C--N 1.314 -0.97 0 O-C-N 120.965 -1.084 . . . . 18.92 108.465 -177.605 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -77.3 -14.22 59.78 Favored 'General case' 0 N--CA 1.44 -0.945 0 C-N-CA 124.59 1.156 . . . . 14.85 112.707 -171.313 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 18.9 p-10 -69.34 -5.3 22.4 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 125.16 1.384 . . . . 18.4 110.231 172.51 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 61.4 m -56.82 140.75 46.99 Favored 'General case' 0 C--O 1.209 -1.035 0 C-N-CA 119.825 -0.75 . . . . 15.54 109.108 175.408 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' LYS . . . . . 0.527 ' O ' ' HD2' ' A' ' 78' ' ' PRO . 52.3 mmtt -106.02 -34.26 7.63 Favored 'General case' 0 CA--C 1.498 -1.048 0 N-CA-C 112.355 0.502 . . . . 25.24 112.355 -169.439 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 49' ' ' VAL . . . . . 0.623 ' HB ' HD22 ' A' ' 3' ' ' LEU . 98.9 t -139.83 124.52 19.87 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 O-C-N 123.961 0.788 . . . . 13.99 109.753 -173.523 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 18.9 tp -99.31 129.14 45.5 Favored 'General case' 0 C--O 1.214 -0.783 0 N-CA-C 105.124 -2.176 . . . . 11.85 105.124 174.785 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 39.8 mt -117.92 120.46 64.64 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 N-CA-C 108.255 -1.017 . . . . 15.17 108.255 170.264 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 14.2 t -135.95 143.63 44.99 Favored 'General case' 0 C--O 1.205 -1.24 0 O-C-N 121.05 -1.031 . . . . 11.32 113.588 -172.063 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -76.13 -173.17 2.28 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 108.828 -0.805 . . . . 9.61 108.828 162.331 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 2.1 t90 -115.35 -60.92 1.82 Allowed 'General case' 0 N--CA 1.432 -1.335 0 N-CA-C 106.68 -1.6 . . . . 14.24 106.68 -174.76 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 74.9 m-80 -75.7 113.44 13.16 Favored 'General case' 0 CA--C 1.516 -0.328 0 O-C-N 124.535 1.147 . . . . 17.21 112.301 -174.845 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 12.2 ptt? -167.67 145.01 3.71 Favored Pre-proline 0 CA--C 1.506 -0.745 0 N-CA-C 112.028 0.381 . . . . 23.27 112.028 176.602 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -66.35 166.94 19.85 Favored 'Trans proline' 0 C--O 1.205 -1.127 0 O-C-N 123.812 1.428 . . . . 18.04 108.664 175.619 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' GLU . . . . . 0.702 ' O ' HG23 ' A' ' 35' ' ' VAL . 78.1 mt-10 58.27 43.51 20.1 Favored 'General case' 0 N--CA 1.438 -1.068 0 CA-C-O 121.343 0.592 . . . . 15.33 111.867 176.288 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 59' ' ' MET . . . . . 0.403 ' HB3' ' O ' ' A' ' 58' ' ' GLU . 52.6 ttp 96.81 114.36 0.02 OUTLIER 'General case' 0 C--O 1.219 -0.522 0 C-N-CA 126.868 2.067 . . . . 18.36 110.477 173.52 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 20.0 p30 -68.02 168.28 12.23 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.817 0.673 . . . . 15.2 112.817 176.081 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -73.01 -28.37 66.77 Favored Glycine 0 C--O 1.19 -2.627 0 C-N-CA 120.501 -0.856 . . . . 12.63 113.891 -177.43 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 15.9 tp -55.3 -53.47 55.76 Favored 'General case' 0 N--CA 1.478 0.965 0 O-C-N 122.364 -0.492 . . . . 11.75 111.852 169.966 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 -67.43 -39.01 85.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.863 0.363 . . . . 11.63 110.217 177.116 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 52.9 tp -51.95 -48.7 64.17 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 118.544 -1.262 . . . . 12.88 111.941 169.509 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 54.2 t -64.62 -50.36 76.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 C-N-CA 119.251 -0.979 . . . . 14.91 111.274 -177.029 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 62.1 mttt -54.16 -40.76 67.78 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 119.177 -1.009 . . . . 20.55 113.242 175.933 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -66.15 -40.07 90.3 Favored 'General case' 0 N--CA 1.437 -1.125 0 O-C-N 121.688 -0.632 . . . . 19.56 110.864 -179.716 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 54.4 t -62.08 -52.26 62.56 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.865 0 N-CA-C 113.071 0.767 . . . . 15.99 113.071 175.14 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 51.1 mmt-85 -55.53 -32.73 63.19 Favored 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 115.922 1.823 . . . . 18.05 115.922 175.521 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 11.9 m -77.05 -17.83 58.49 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 125.464 1.506 . . . . 22.92 113.481 176.545 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -83.15 130.65 35.12 Favored 'General case' 0 N--CA 1.408 -2.538 0 N-CA-C 105.714 -1.958 . . . . 17.43 105.714 -176.914 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -54.83 -21.94 12.89 Favored 'General case' 0 CA--C 1.547 0.848 0 N-CA-C 118.112 2.634 . . . . 23.77 118.112 174.397 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.89 4.68 47.49 Favored 'General case' 0 N--CA 1.431 -1.398 0 C-N-CA 115.286 -2.566 . . . . 20.81 117.128 174.797 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 24.4 m-85 -129.83 25.96 5.28 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 124.918 1.287 . . . . 18.05 113.11 -173.369 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 5.8 mmmt -70.01 -35.41 74.33 Favored 'General case' 0 CA--C 1.556 1.198 0 N-CA-C 113.991 1.108 . . . . 31.95 113.991 -178.561 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 58.7 mm-40 -100.24 -3.09 32.2 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 115.529 1.677 . . . . 19.41 115.529 176.743 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 9.2 tt -54.79 123.16 44.56 Favored Pre-proline 0 C--O 1.241 0.64 0 C-N-CA 119.001 -1.079 . . . . 14.5 111.015 177.504 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' PRO . . . . . 0.527 ' HD2' ' O ' ' A' ' 48' ' ' LYS . 51.8 Cg_exo -58.96 129.75 33.42 Favored 'Trans proline' 0 CA--C 1.537 0.648 0 O-C-N 122.59 0.784 . . . . 12.27 112.129 173.389 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 84.1 mt -121.78 117.33 52.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 122.198 0.999 . . . . 10.03 113.096 179.347 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 14.1 mt -107.18 118.65 55.36 Favored 'Isoleucine or valine' 0 N--CA 1.408 -2.544 0 CA-C-N 113.957 -1.474 . . . . 10.65 109.412 175.027 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 35.7 ttm -94.08 127.08 39.69 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 119.111 -1.036 . . . . 18.72 113.72 168.512 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 54.4 mt -118.36 109.8 28.28 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.183 0 N-CA-C 107.051 -1.463 . . . . 13.78 107.051 176.995 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 9.2 t -146.59 152.99 39.82 Favored 'General case' 0 C--O 1.249 1.029 0 N-CA-C 113.909 1.078 . . . . 12.25 113.909 -165.555 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 43.4 p -73.6 -13.62 61.04 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.727 -1.124 . . . . 13.74 112.669 168.398 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -65.07 80.12 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.747 0.784 . . . . 21.25 110.857 175.263 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -78.97 -13.19 83.34 Favored Glycine 0 C--O 1.21 -1.368 0 N-CA-C 116.265 1.266 . . . . 13.81 116.265 178.463 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -70.43 147.12 43.45 Favored Glycine 0 C--O 1.219 -0.825 0 CA-C-N 119.579 1.689 . . . . 12.2 110.956 -175.742 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 15.0 mmtm -69.65 -31.62 69.8 Favored 'General case' 0 C--O 1.251 1.152 0 CA-C-N 117.769 0.785 . . . . 15.78 112.027 -174.171 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -51.63 -41.35 61.22 Favored 'General case' 0 C--O 1.247 0.969 0 CA-C-N 115.79 -0.641 . . . . 11.37 109.593 175.677 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 8.9 mp0 -76.91 -37.75 54.79 Favored 'General case' 0 CA--C 1.492 -1.287 0 N-CA-C 105.562 -2.014 . . . . 12.99 105.562 -175.07 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' VAL . . . . . 0.405 HG22 ' CE2' ' A' ' 102' ' ' TYR . 71.2 t -59.86 -53.32 50.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 N-CA-C 108.242 -1.022 . . . . 12.75 108.242 176.526 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 5.6 mt -53.55 -49.15 57.12 Favored 'Isoleucine or valine' 0 C--O 1.259 1.585 0 N-CA-C 113.429 0.899 . . . . 17.26 113.429 176.21 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 47.5 m -50.87 -44.61 59.68 Favored 'General case' 0 CA--C 1.505 -0.752 0 CA-C-N 115.865 -0.607 . . . . 15.36 110.787 -178.405 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' ALA . . . . . 0.516 ' HB1' HG21 ' A' ' 99' ' ' VAL . . . -74.81 -38.39 62.08 Favored 'General case' 0 CA--C 1.562 1.408 0 N-CA-C 117.361 2.356 . . . . 14.25 117.361 -177.577 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 54.3 mt -64.85 -39.02 92.89 Favored 'General case' 0 C--O 1.189 -2.097 0 N-CA-C 108.126 -1.064 . . . . 11.69 108.126 174.58 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 50.4 mtpt -57.38 -36.84 71.77 Favored 'General case' 0 N--CA 1.501 2.091 0 C-N-CA 124.358 1.063 . . . . 13.7 111.223 175.867 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -79.47 -18.26 52.46 Favored 'General case' 0 N--CA 1.434 -1.232 0 CA-C-O 118.687 -0.673 . . . . 11.08 110.532 -177.09 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 123.49 5.07 7.97 Favored Glycine 0 C--O 1.218 -0.857 0 N-CA-C 116.814 1.486 . . . . 10.02 116.814 -178.0 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' VAL . . . . . 0.516 HG21 ' HB1' ' A' ' 94' ' ' ALA . 84.8 t -66.43 130.62 31.94 Favored 'Isoleucine or valine' 0 C--O 1.265 1.875 0 N-CA-C 109.65 -0.5 . . . . 13.33 109.65 173.321 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -99.93 -29.4 12.59 Favored 'General case' 0 C--O 1.202 -1.446 0 C-N-CA 119.256 -0.978 . . . . 13.9 113.261 -178.219 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 60.0 m-80 -139.09 140.2 37.93 Favored 'General case' 0 C--N 1.317 -0.828 0 C-N-CA 119.183 -1.007 . . . . 16.75 111.819 175.13 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' TYR . . . . . 0.405 ' CE2' HG22 ' A' ' 91' ' ' VAL . 8.5 t80 -125.16 122.5 37.26 Favored 'General case' 0 C--N 1.32 -0.688 0 C-N-CA 119.391 -0.924 . . . . 13.31 109.361 -172.928 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 88.3 mt -115.43 130.55 69.83 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.029 0 N-CA-C 106.307 -1.738 . . . . 12.35 106.307 179.13 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 48.9 t -101.6 126.15 55.55 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.645 0 N-CA-C 108.511 -0.922 . . . . 12.53 108.511 -174.398 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 71.9 mttt -75.42 151.43 85.34 Favored Pre-proline 0 CA--C 1.544 0.747 0 O-C-N 124.538 1.149 . . . . 13.73 109.082 169.067 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -94.15 171.04 17.76 Favored 'Cis proline' 0 CA--C 1.546 1.108 0 C-N-CA 121.891 -2.129 . . . . 13.94 113.209 3.39 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' PHE . . . . . 0.593 ' CE1' HD22 ' A' ' 112' ' ' LEU . 1.6 p90 -146.32 148.43 32.39 Favored 'General case' 0 N--CA 1.432 -1.336 0 O-C-N 123.894 0.746 . . . . 15.62 111.684 178.304 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 22.3 p -64.54 156.67 76.61 Favored Pre-proline 0 C--O 1.263 1.797 0 C-N-CA 119.627 -0.829 . . . . 16.94 112.715 159.708 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_exo -52.59 -39.08 76.39 Favored 'Trans proline' 0 C--N 1.36 1.161 0 O-C-N 122.677 0.83 . . . . 19.23 111.844 174.893 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 4.4 tp-100 -73.58 -32.79 64.31 Favored 'General case' 0 N--CA 1.453 -0.295 0 O-C-N 124.117 0.885 . . . . 18.71 113.356 -177.913 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 51.5 t -68.72 -39.97 80.94 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.847 0 N-CA-C 108.99 -0.744 . . . . 15.61 108.99 174.748 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' LEU . . . . . 0.593 HD22 ' CE1' ' A' ' 107' ' ' PHE . 15.2 tp -62.63 -38.57 90.76 Favored 'General case' 0 N--CA 1.482 1.127 0 N-CA-C 113.54 0.941 . . . . 16.85 113.54 177.798 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 52.5 tttm -60.71 -52.19 66.16 Favored 'General case' 0 C--O 1.204 -1.312 0 C-N-CA 124.004 0.922 . . . . 28.78 113.481 174.885 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -52.78 -53.42 48.49 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.005 0.922 . . . . 26.55 113.439 170.163 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 84.3 mttt -62.46 -36.03 81.15 Favored 'General case' 0 CA--C 1.563 1.457 0 N-CA-C 116.65 2.093 . . . . 19.74 116.65 178.601 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' LEU . . . . . 0.403 ' HA ' HD23 ' A' ' 116' ' ' LEU . 31.4 mt -76.39 -36.1 58.26 Favored 'General case' 0 N--CA 1.484 1.256 0 CA-C-N 118.521 0.601 . . . . 16.14 110.562 178.391 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -54.62 -47.91 72.86 Favored 'General case' 0 C--O 1.202 -1.433 0 CA-C-N 114.069 -1.423 . . . . 31.06 113.406 168.997 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 61.5 t -49.1 -46.53 17.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 N-CA-C 113.137 0.791 . . . . 20.96 113.137 171.2 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 60.3 t -80.37 -38.39 17.96 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.211 0 N-CA-C 115.151 1.538 . . . . 21.3 115.151 -176.123 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 83.6 mt -119.2 -14.63 9.26 Favored 'General case' 0 CA--C 1.509 -0.634 0 CA-C-N 115.953 -0.567 . . . . 23.65 111.152 -165.301 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 54.24 -150.05 16.34 Favored Glycine 0 N--CA 1.484 1.841 0 N-CA-C 110.494 -1.042 . . . . 25.33 110.494 -170.778 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 70.5 p -108.34 162.92 13.65 Favored 'General case' 0 N--CA 1.488 1.431 0 CA-C-N 117.901 0.85 . . . . 26.86 113.103 173.708 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 47.2 t30 . . . . . 0 C--O 1.22 -0.484 0 C-N-CA 123.263 0.625 . . . . 26.29 110.668 -177.098 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 125' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 126' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 127' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 133' ' ' HOH . . . . . 0.503 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 149' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 151' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 152' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 153' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 154' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 155' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 156' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 157' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 158' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 159' ' ' HOH . . . . . 0.662 ' O ' ' HG3' ' A' ' 36' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 160' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 161' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 162' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 163' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 164' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 165' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 166' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 167' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 168' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 169' ' ' HOH . . . . . 0.413 ' O ' ' NH2' ' A' ' 22' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 170' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 171' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 172' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 173' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 174' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 175' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 176' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 177' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 178' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 179' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 180' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 181' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 182' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 183' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 184' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 185' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 186' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 187' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 188' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 189' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 190' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 67.3 mmm . . . . . 0 N--CA 1.495 1.778 0 N-CA-C 108.229 -1.026 . . . . 18.670000000000002 108.229 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 39.2 mttt -91.16 115.77 28.28 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.103 1.361 . . . . 21.5 112.344 -177.363 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.825 HD12 HD13 ' A' ' 20' ' ' LEU . 5.4 mt -107.71 144.83 34.27 Favored 'General case' 0 C--O 1.24 0.604 0 CA-C-N 115.484 -0.78 . . . . 16.649999999999999 109.03 -173.108 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 8.6 tp -122.3 128.84 51.56 Favored 'General case' 0 C--O 1.212 -0.895 0 N-CA-C 107.282 -1.377 . . . . 10.789999999999999 107.282 169.238 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 53.1 t -115.17 123.09 70.44 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.168 0 N-CA-C 108.741 -0.837 . . . . 9.0199999999999996 108.741 -176.914 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 12.5 t -120.37 117.38 53.18 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.899 0 CA-C-N 118.098 0.408 . . . . 9.8200000000000003 110.363 -173.118 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 12.0 t0 -162.7 133.24 4.71 Favored 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 107.547 -1.279 . . . . 15.9 107.547 179.314 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 30.0 p30 -80.4 4.19 18.85 Favored 'General case' 0 N--CA 1.495 1.816 0 N-CA-C 113.665 0.987 . . . . 14.41 113.665 178.348 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 1.4 t -102.57 113.72 27.33 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 107.907 -1.146 . . . . 13.68 107.907 176.922 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 77.1 p -69.22 -34.8 75.42 Favored 'General case' 0 C--O 1.222 -0.368 0 CA-C-N 116.244 -0.434 . . . . 18.73 110.651 -173.153 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 64.9 p -71.18 -33.92 70.44 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 114.173 1.175 . . . . 20.620000000000001 114.173 175.559 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' MET . . . . . 0.671 ' O ' HG22 ' A' ' 15' ' ' ILE . 37.5 tpp -63.94 -46.61 83.96 Favored 'General case' 0 C--O 1.218 -0.594 0 CA-C-O 118.41 -0.805 . . . . 15.390000000000001 109.558 172.199 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 60.4 mtm-85 -51.04 -41.19 59.7 Favored 'General case' 0 N--CA 1.494 1.726 0 N-CA-C 113.359 0.874 . . . . 14.76 113.359 173.407 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 27.0 ttm180 -61.3 -46.47 90.19 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 123.883 0.873 . . . . 15.869999999999999 111.174 176.396 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.671 HG22 ' O ' ' A' ' 12' ' ' MET . 1.5 tt -69.31 -42.64 81.38 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.876 0 C-N-CA 119.655 -0.818 . . . . 22.960000000000001 110.367 -174.682 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.429 ' N ' HG23 ' A' ' 15' ' ' ILE . 79.9 mt -65.49 -43.31 94.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 107.854 -1.165 . . . . 19.93 107.854 -176.707 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 57.6 tttm -61.34 -49.0 78.73 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 124.199 0.937 . . . . 15.77 112.921 -178.886 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -58.01 -39.2 77.72 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 114.41 1.263 . . . . 26.609999999999999 114.41 171.407 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 40.6 m -71.7 -48.38 47.73 Favored 'General case' 0 C--O 1.248 1.02 0 N-CA-C 108.313 -0.995 . . . . 17.059999999999999 108.313 -178.26 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.825 HD13 HD12 ' A' ' 3' ' ' LEU . 95.6 mt -51.43 -50.49 59.62 Favored 'General case' 0 C--O 1.243 0.719 0 C-N-CA 119.548 -0.861 . . . . 15.609999999999999 108.702 171.546 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 36.4 t -50.46 -45.42 56.1 Favored 'General case' 0 CA--C 1.553 1.06 0 N-CA-C 113.624 0.972 . . . . 16.690000000000001 113.624 179.461 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.413 ' NH2' ' O ' ' A' ' 169' ' ' HOH . 74.0 mtp180 -66.95 -24.79 66.11 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 126.254 1.821 . . . . 38.969999999999999 112.079 -178.052 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 31.2 mt -88.3 2.45 52.41 Favored 'General case' 0 CA--C 1.555 1.142 0 N-CA-C 113.785 1.031 . . . . 18.600000000000001 113.785 170.634 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 90.73 21.91 35.28 Favored Glycine 0 CA--C 1.5 -0.852 0 N-CA-C 111.673 -0.571 . . . . 15.93 111.673 170.94 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 62.4 m-85 -108.86 104.18 13.39 Favored 'General case' 0 N--CA 1.479 1.007 0 N-CA-C 113.742 1.016 . . . . 22.690000000000001 113.742 178.496 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.503 ' O ' ' O ' ' A' ' 133' ' ' HOH . 40.2 mm-40 -105.5 -25.24 12.4 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 114.41 1.263 . . . . 23.239999999999998 114.41 -166.942 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 41.8 t0 -94.28 78.72 3.95 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 106.501 -1.666 . . . . 17.129999999999999 106.501 -172.602 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 10.7 t -113.04 118.79 58.94 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-N 115.415 -0.811 . . . . 14.85 109.156 -174.972 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.537 HD21 ' HD3' ' A' ' 40' ' ' LYS . 26.6 tp -96.45 142.08 28.97 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 119.31 -0.956 . . . . 12.69 109.404 169.605 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 77.4 mt-10 -108.46 156.73 19.13 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 113.571 0.952 . . . . 15.92 113.571 179.397 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -144.4 163.65 33.16 Favored 'General case' 0 C--O 1.211 -0.943 0 N-CA-C 107.581 -1.266 . . . . 14.07 107.581 174.167 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -111.36 -32.01 6.87 Favored 'General case' 0 C--O 1.247 0.946 0 O-C-N 121.623 -0.673 . . . . 26.859999999999999 110.873 -176.151 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 57.2 m80 -138.52 162.0 35.63 Favored 'General case' 0 N--CA 1.43 -1.455 0 CA-C-N 114.592 -1.186 . . . . 15.74 108.165 -174.629 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -55.76 -33.96 60.43 Favored Glycine 0 N--CA 1.44 -1.071 0 CA-C-O 119.037 -0.868 . . . . 15.92 113.127 -177.635 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.702 HG23 ' O ' ' A' ' 58' ' ' GLU . 63.0 t -66.16 -45.34 90.51 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.5 0 N-CA-C 114.559 1.318 . . . . 17.640000000000001 114.559 -177.329 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.662 ' HG3' ' O ' ' A' ' 159' ' ' HOH . 73.2 tt0 -70.12 -35.79 74.36 Favored 'General case' 0 CA--C 1.497 -1.069 0 N-CA-C 107.764 -1.199 . . . . 19.239999999999998 107.764 179.717 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -62.91 -49.2 75.72 Favored 'General case' 0 C--O 1.253 1.274 0 N-CA-C 108.529 -0.915 . . . . 15.68 108.529 176.196 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 70.5 t-105 -60.16 -43.28 95.92 Favored 'General case' 0 CA--C 1.557 1.229 0 C-N-CA 119.284 -0.966 . . . . 18.73 113.36 177.261 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 11.4 tm-20 -62.14 -36.47 81.89 Favored 'General case' 0 C--O 1.238 0.488 0 C-N-CA 118.247 -1.381 . . . . 28.579999999999998 109.676 179.505 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.537 ' HD3' HD21 ' A' ' 29' ' ' LEU . 70.8 mttt -68.91 -47.67 65.22 Favored 'General case' 0 N--CA 1.445 -0.71 0 C-N-CA 119.661 -0.815 . . . . 16.510000000000002 111.172 -179.069 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 67.5 mt -54.25 -48.6 70.97 Favored 'General case' 0 N--CA 1.434 -1.231 0 N-CA-C 109.695 -0.483 . . . . 16.039999999999999 109.695 172.777 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -62.37 -38.92 91.43 Favored 'General case' 0 CA--C 1.566 1.57 0 N-CA-C 113.509 0.929 . . . . 21.809999999999999 113.509 -174.051 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -85.04 -19.71 31.55 Favored 'General case' 0 C--O 1.18 -2.558 0 C-N-CA 124.187 0.995 . . . . 13.9 113.212 -178.615 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 28.5 m-80 -133.66 75.22 1.59 Allowed 'General case' 0 C--N 1.314 -0.97 0 O-C-N 120.965 -1.084 . . . . 18.920000000000002 108.465 -177.605 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -77.3 -14.22 59.78 Favored 'General case' 0 N--CA 1.44 -0.945 0 C-N-CA 124.59 1.156 . . . . 14.85 112.707 -171.313 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 18.9 p-10 -69.34 -5.3 22.4 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 125.16 1.384 . . . . 18.399999999999999 110.231 172.51 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 61.4 m -56.82 140.75 46.99 Favored 'General case' 0 C--O 1.209 -1.035 0 C-N-CA 119.825 -0.75 . . . . 15.539999999999999 109.108 175.408 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.527 ' O ' ' HD2' ' A' ' 78' ' ' PRO . 52.3 mmtt -106.02 -34.26 7.63 Favored 'General case' 0 CA--C 1.498 -1.048 0 N-CA-C 112.355 0.502 . . . . 25.239999999999998 112.355 -169.439 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.623 ' HB ' HD22 ' A' ' 3' ' ' LEU . 98.9 t -139.83 124.52 19.87 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 O-C-N 123.961 0.788 . . . . 13.99 109.753 -173.523 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 18.9 tp -99.31 129.14 45.5 Favored 'General case' 0 C--O 1.214 -0.783 0 N-CA-C 105.124 -2.176 . . . . 11.85 105.124 174.785 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 39.8 mt -117.92 120.46 64.64 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 N-CA-C 108.255 -1.017 . . . . 15.17 108.255 170.264 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 14.2 t -135.95 143.63 44.99 Favored 'General case' 0 C--O 1.205 -1.24 0 O-C-N 121.05 -1.031 . . . . 11.32 113.588 -172.063 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -76.13 -173.17 2.28 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 108.828 -0.805 . . . . 9.6099999999999994 108.828 162.331 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 2.1 t90 -115.35 -60.92 1.82 Allowed 'General case' 0 N--CA 1.432 -1.335 0 N-CA-C 106.68 -1.6 . . . . 14.24 106.68 -174.76 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 74.9 m-80 -75.7 113.44 13.16 Favored 'General case' 0 CA--C 1.516 -0.328 0 O-C-N 124.535 1.147 . . . . 17.210000000000001 112.301 -174.845 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 12.2 ptt? -167.67 145.01 3.71 Favored Pre-proline 0 CA--C 1.506 -0.745 0 N-CA-C 112.028 0.381 . . . . 23.27 112.028 176.602 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -66.35 166.94 19.85 Favored 'Trans proline' 0 C--O 1.205 -1.127 0 O-C-N 123.812 1.428 . . . . 18.039999999999999 108.664 175.619 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.702 ' O ' HG23 ' A' ' 35' ' ' VAL . 78.1 mt-10 58.27 43.51 20.1 Favored 'General case' 0 N--CA 1.438 -1.068 0 CA-C-O 121.343 0.592 . . . . 15.33 111.867 176.288 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' MET . . . . . 0.403 ' HB3' ' O ' ' A' ' 58' ' ' GLU . 52.6 ttp 96.81 114.36 0.02 OUTLIER 'General case' 0 C--O 1.219 -0.522 0 C-N-CA 126.868 2.067 . . . . 18.359999999999999 110.477 173.52 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 20.0 p30 -68.02 168.28 12.23 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.817 0.673 . . . . 15.199999999999999 112.817 176.081 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -73.01 -28.37 66.77 Favored Glycine 0 C--O 1.19 -2.627 0 C-N-CA 120.501 -0.856 . . . . 12.630000000000001 113.891 -177.43 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 15.9 tp -55.3 -53.47 55.76 Favored 'General case' 0 N--CA 1.478 0.965 0 O-C-N 122.364 -0.492 . . . . 11.75 111.852 169.966 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 -67.43 -39.01 85.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.863 0.363 . . . . 11.630000000000001 110.217 177.116 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 52.9 tp -51.95 -48.7 64.17 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 118.544 -1.262 . . . . 12.880000000000001 111.941 169.509 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 54.2 t -64.62 -50.36 76.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 C-N-CA 119.251 -0.979 . . . . 14.91 111.274 -177.029 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 62.1 mttt -54.16 -40.76 67.78 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 119.177 -1.009 . . . . 20.550000000000001 113.242 175.933 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -66.15 -40.07 90.3 Favored 'General case' 0 N--CA 1.437 -1.125 0 O-C-N 121.688 -0.632 . . . . 19.559999999999999 110.864 -179.716 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 54.4 t -62.08 -52.26 62.56 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.865 0 N-CA-C 113.071 0.767 . . . . 15.99 113.071 175.14 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.643 ' NH2' HD21 ' A' ' 100' ' ' ASN . 51.1 mmt-85 -55.53 -32.73 63.19 Favored 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 115.922 1.823 . . . . 18.050000000000001 115.922 175.521 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 11.9 m -77.05 -17.83 58.49 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 125.464 1.506 . . . . 22.920000000000002 113.481 176.545 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -83.15 130.65 35.12 Favored 'General case' 0 N--CA 1.408 -2.538 0 N-CA-C 105.714 -1.958 . . . . 17.43 105.714 -176.914 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -54.83 -21.94 12.89 Favored 'General case' 0 CA--C 1.547 0.848 0 N-CA-C 118.112 2.634 . . . . 23.77 118.112 174.397 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.89 4.68 47.49 Favored 'General case' 0 N--CA 1.431 -1.398 0 C-N-CA 115.286 -2.566 . . . . 20.809999999999999 117.128 174.797 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 24.4 m-85 -129.83 25.96 5.28 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 124.918 1.287 . . . . 18.050000000000001 113.11 -173.369 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 5.8 mmmt -70.01 -35.41 74.33 Favored 'General case' 0 CA--C 1.556 1.198 0 N-CA-C 113.991 1.108 . . . . 31.949999999999999 113.991 -178.561 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 58.7 mm-40 -100.24 -3.09 32.2 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 115.529 1.677 . . . . 19.41 115.529 176.743 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 9.2 tt -54.79 123.16 44.56 Favored Pre-proline 0 C--O 1.241 0.64 0 C-N-CA 119.001 -1.079 . . . . 14.5 111.015 177.504 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.527 ' HD2' ' O ' ' A' ' 48' ' ' LYS . 51.8 Cg_exo -58.96 129.75 33.42 Favored 'Trans proline' 0 CA--C 1.537 0.648 0 O-C-N 122.59 0.784 . . . . 12.27 112.129 173.389 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.897 ' H ' HD22 ' A' ' 100' ' ' ASN . 84.1 mt -121.78 117.33 52.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 122.198 0.999 . . . . 10.029999999999999 113.096 179.347 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 14.1 mt -107.18 118.65 55.36 Favored 'Isoleucine or valine' 0 N--CA 1.408 -2.544 0 CA-C-N 113.957 -1.474 . . . . 10.65 109.412 175.027 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 35.7 ttm -94.08 127.08 39.69 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 119.111 -1.036 . . . . 18.719999999999999 113.72 168.512 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 54.4 mt -118.36 109.8 28.28 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.183 0 N-CA-C 107.051 -1.463 . . . . 13.779999999999999 107.051 176.995 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 9.2 t -146.59 152.99 39.82 Favored 'General case' 0 C--O 1.249 1.029 0 N-CA-C 113.909 1.078 . . . . 12.25 113.909 -165.555 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 43.4 p -73.6 -13.62 61.04 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.727 -1.124 . . . . 13.74 112.669 168.398 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -65.07 80.12 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.747 0.784 . . . . 21.25 110.857 175.263 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -78.97 -13.19 83.34 Favored Glycine 0 C--O 1.21 -1.368 0 N-CA-C 116.265 1.266 . . . . 13.81 116.265 178.463 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -70.43 147.12 43.45 Favored Glycine 0 C--O 1.219 -0.825 0 CA-C-N 119.579 1.689 . . . . 12.199999999999999 110.956 -175.742 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 15.0 mmtm -69.65 -31.62 69.8 Favored 'General case' 0 C--O 1.251 1.152 0 CA-C-N 117.769 0.785 . . . . 15.779999999999999 112.027 -174.171 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -51.63 -41.35 61.22 Favored 'General case' 0 C--O 1.247 0.969 0 CA-C-N 115.79 -0.641 . . . . 11.369999999999999 109.593 175.677 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 8.9 mp0 -76.91 -37.75 54.79 Favored 'General case' 0 CA--C 1.492 -1.287 0 N-CA-C 105.562 -2.014 . . . . 12.99 105.562 -175.07 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.405 HG22 ' CE2' ' A' ' 102' ' ' TYR . 71.2 t -59.86 -53.32 50.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 N-CA-C 108.242 -1.022 . . . . 12.75 108.242 176.526 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 5.6 mt -53.55 -49.15 57.12 Favored 'Isoleucine or valine' 0 C--O 1.259 1.585 0 N-CA-C 113.429 0.899 . . . . 17.260000000000002 113.429 176.21 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 47.5 m -50.87 -44.61 59.68 Favored 'General case' 0 CA--C 1.505 -0.752 0 CA-C-N 115.865 -0.607 . . . . 15.359999999999999 110.787 -178.405 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' ALA . . . . . 0.516 ' HB1' HG21 ' A' ' 99' ' ' VAL . . . -74.81 -38.39 62.08 Favored 'General case' 0 CA--C 1.562 1.408 0 N-CA-C 117.361 2.356 . . . . 14.25 117.361 -177.577 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 54.3 mt -64.85 -39.02 92.89 Favored 'General case' 0 C--O 1.189 -2.097 0 N-CA-C 108.126 -1.064 . . . . 11.69 108.126 174.58 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 50.4 mtpt -57.38 -36.84 71.77 Favored 'General case' 0 N--CA 1.501 2.091 0 C-N-CA 124.358 1.063 . . . . 13.699999999999999 111.223 175.867 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -79.47 -18.26 52.46 Favored 'General case' 0 N--CA 1.434 -1.232 0 CA-C-O 118.687 -0.673 . . . . 11.08 110.532 -177.09 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 123.49 5.07 7.97 Favored Glycine 0 C--O 1.218 -0.857 0 N-CA-C 116.814 1.486 . . . . 10.02 116.814 -178.0 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' VAL . . . . . 0.516 HG21 ' HB1' ' A' ' 94' ' ' ALA . 84.8 t -66.43 130.62 31.94 Favored 'Isoleucine or valine' 0 C--O 1.265 1.875 0 N-CA-C 109.65 -0.5 . . . . 13.33 109.65 173.321 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.897 HD22 ' H ' ' A' ' 79' ' ' ILE . 23.7 m-80 -99.93 -29.4 12.59 Favored 'General case' 0 C--O 1.202 -1.446 0 C-N-CA 119.256 -0.978 . . . . 13.9 113.261 -178.219 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 60.0 m-80 -139.09 140.2 37.93 Favored 'General case' 0 C--N 1.317 -0.828 0 C-N-CA 119.183 -1.007 . . . . 16.75 111.819 175.13 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' TYR . . . . . 0.405 ' CE2' HG22 ' A' ' 91' ' ' VAL . 8.5 t80 -125.16 122.5 37.26 Favored 'General case' 0 C--N 1.32 -0.688 0 C-N-CA 119.391 -0.924 . . . . 13.31 109.361 -172.928 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 88.3 mt -115.43 130.55 69.83 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.029 0 N-CA-C 106.307 -1.738 . . . . 12.35 106.307 179.13 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 48.9 t -101.6 126.15 55.55 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.645 0 N-CA-C 108.511 -0.922 . . . . 12.529999999999999 108.511 -174.398 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 71.9 mttt -75.42 151.43 85.34 Favored Pre-proline 0 CA--C 1.544 0.747 0 O-C-N 124.538 1.149 . . . . 13.73 109.082 169.067 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -94.15 171.04 17.76 Favored 'Cis proline' 0 CA--C 1.546 1.108 0 C-N-CA 121.891 -2.129 . . . . 13.94 113.209 3.39 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' PHE . . . . . 0.593 ' CE1' HD22 ' A' ' 112' ' ' LEU . 1.6 p90 -146.32 148.43 32.39 Favored 'General case' 0 N--CA 1.432 -1.336 0 O-C-N 123.894 0.746 . . . . 15.619999999999999 111.684 178.304 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 22.3 p -64.54 156.67 76.61 Favored Pre-proline 0 C--O 1.263 1.797 0 C-N-CA 119.627 -0.829 . . . . 16.940000000000001 112.715 159.708 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_exo -52.59 -39.08 76.39 Favored 'Trans proline' 0 C--N 1.36 1.161 0 O-C-N 122.677 0.83 . . . . 19.23 111.844 174.893 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.426 ' OE1' ' O ' ' A' ' 146' ' ' HOH . 40.0 tp60 -73.58 -32.79 64.31 Favored 'General case' 0 N--CA 1.453 -0.295 0 O-C-N 124.117 0.885 . . . . 18.710000000000001 113.356 -177.913 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 51.5 t -68.72 -39.97 80.94 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.847 0 N-CA-C 108.99 -0.744 . . . . 15.609999999999999 108.99 174.748 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.593 HD22 ' CE1' ' A' ' 107' ' ' PHE . 15.2 tp -62.63 -38.57 90.76 Favored 'General case' 0 N--CA 1.482 1.127 0 N-CA-C 113.54 0.941 . . . . 16.850000000000001 113.54 177.798 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 52.5 tttm -60.71 -52.19 66.16 Favored 'General case' 0 C--O 1.204 -1.312 0 C-N-CA 124.004 0.922 . . . . 28.780000000000001 113.481 174.885 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -52.78 -53.42 48.49 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.005 0.922 . . . . 26.550000000000001 113.439 170.163 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 84.3 mttt -62.46 -36.03 81.15 Favored 'General case' 0 CA--C 1.563 1.457 0 N-CA-C 116.65 2.093 . . . . 19.739999999999998 116.65 178.601 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.403 ' HA ' HD23 ' A' ' 116' ' ' LEU . 31.4 mt -76.39 -36.1 58.26 Favored 'General case' 0 N--CA 1.484 1.256 0 CA-C-N 118.521 0.601 . . . . 16.140000000000001 110.562 178.391 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -54.62 -47.91 72.86 Favored 'General case' 0 C--O 1.202 -1.433 0 CA-C-N 114.069 -1.423 . . . . 31.059999999999999 113.406 168.997 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 61.5 t -49.1 -46.53 17.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 N-CA-C 113.137 0.791 . . . . 20.960000000000001 113.137 171.2 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 60.3 t -80.37 -38.39 17.96 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.211 0 N-CA-C 115.151 1.538 . . . . 21.300000000000001 115.151 -176.123 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 83.6 mt -119.2 -14.63 9.26 Favored 'General case' 0 CA--C 1.509 -0.634 0 CA-C-N 115.953 -0.567 . . . . 23.649999999999999 111.152 -165.301 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 54.24 -150.05 16.34 Favored Glycine 0 N--CA 1.484 1.841 0 N-CA-C 110.494 -1.042 . . . . 25.329999999999998 110.494 -170.778 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 70.5 p -108.34 162.92 13.65 Favored 'General case' 0 N--CA 1.488 1.431 0 CA-C-N 117.901 0.85 . . . . 26.859999999999999 113.103 173.708 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' ASN . . . . . . . . . . . . . 47.2 t30 . . . . . 0 C--O 1.22 -0.484 0 C-N-CA 123.263 0.625 . . . . 26.289999999999999 110.668 -177.098 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' HOH . . . . . 0.503 ' O ' ' O ' ' A' ' 26' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' HOH . . . . . 0.426 ' O ' ' OE1' ' A' ' 110' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 158' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 159' ' ' HOH . . . . . 0.662 ' O ' ' HG3' ' A' ' 36' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 160' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 161' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 162' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 163' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 164' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 165' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 166' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 167' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 168' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 169' ' ' HOH . . . . . 0.413 ' O ' ' NH2' ' A' ' 22' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 170' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 171' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 172' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 173' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 174' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 175' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 176' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 177' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 178' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 179' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 180' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 181' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 182' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 183' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 184' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 185' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 186' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 187' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 188' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 189' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 190' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_