data_3ec2_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 3ec2 _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 ' 42' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.63 0 N-CA-C 114.39 1.256 . . . . 68.74 114.39 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' LYS . . . . . 0.725 ' CA ' ' O ' ' A' ' 24' ' ' HOH 0.343 18.1 mtmt -144.2 55.93 1.3 Allowed 'General case' 0 CA--C 1.483 -1.596 0 N-CA-C 120.667 3.58 . . . . 68.04 120.667 -161.927 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ARG . . . . . 0.435 ' NH1' ' O ' ' A' ' 5' ' ' HOH . 1.4 ttm105 -92.75 -10.68 36.14 Favored 'General case' 0 N--CA 1.402 -2.847 0 N-CA-C 102.49 -3.152 . . . . 63.53 102.49 153.393 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 91.7 m-85 -110.34 18.64 19.65 Favored 'General case' 0 C--O 1.218 -0.567 0 CA-C-N 114.887 -1.051 . . . . 56.78 111.588 -177.294 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' TRP . . . . . 0.741 ' CG ' ' N ' ' A' ' 47' ' ' ASN . 39.3 p-90 -46.22 -57.37 4.61 Favored 'General case' 0 C--O 1.199 -1.596 0 N-CA-C 108.397 -0.964 . . . . 57.16 108.397 176.183 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ASN . . . . . 0.741 ' N ' ' CG ' ' A' ' 46' ' ' TRP . 9.6 p-10 -59.07 -19.81 47.61 Favored 'General case' 0 CA--C 1.584 2.265 0 N-CA-C 119.508 3.151 . . . . 65.2 119.508 172.309 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -53.2 107.84 0.27 Allowed 'General case' 0 N--CA 1.485 1.323 0 O-C-N 120.628 -1.295 . . . . 66.72 114.246 -177.833 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' ASN . . . . . 0.648 ' C ' ' N ' ' A' ' 51' ' ' ASP . 30.9 m-80 -139.46 138.88 36.81 Favored 'General case' 0 CA--C 1.501 -0.927 0 O-C-N 121.517 -0.74 . . . . 75.47 111.718 -179.723 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.8 mt -46.84 -9.92 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 107.583 -1.266 . . . . 77.44 107.583 173.411 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' ASP . . . . . 0.796 ' C ' ' N ' ' A' ' 53' ' ' TYR . 0.4 OUTLIER -105.3 -40.0 5.98 Favored 'General case' 0 C--O 1.217 -0.633 0 N-CA-C 120.043 3.349 . . . . 88.84 120.043 -168.589 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' THR . . . . . 0.963 ' O ' ' CG2' ' A' ' 52' ' ' THR 0.438 15.4 m -51.03 0.34 0.01 OUTLIER 'General case' 0 CA--C 1.471 -2.082 0 N-CA-C 104.707 -2.331 . . . . 78.73 104.707 163.201 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' TYR . . . . . 0.796 ' N ' ' C ' ' A' ' 51' ' ' ASP 0.47 9.2 t80 -82.28 112.8 19.61 Favored 'General case' 1 CA--C 1.407 -4.524 1 C-N-CA 108.531 -5.268 . . . . 76.19 115.476 -156.076 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 48.8 m80 -119.95 106.77 40.88 Favored Pre-proline 0 N--CA 1.413 -2.312 0 C-N-CA 114.243 -2.983 . . . . 84.88 114.233 175.022 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -71.3 148.37 55.11 Favored 'Trans proline' 0 N--CA 1.45 -1.044 0 C-N-CA 123.355 2.703 . . . . 70.96 110.986 -174.352 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 2.8 mttm -123.12 -2.93 8.57 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 112.688 0.625 . . . . 87.45 112.688 -168.934 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 21.4 p-10 -153.33 176.44 11.98 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 107.984 -1.117 . . . . 76.26 107.984 172.951 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 8.1 t -64.68 -33.91 66.42 Favored 'Isoleucine or valine' 0 C--O 1.237 0.433 0 C-N-CA 119.834 -0.747 . . . . 68.43 111.319 -178.959 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 5.9 m -52.29 -51.19 59.94 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 125.727 1.611 . . . . 68.74 109.756 174.848 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 57.8 mt-30 -73.38 -27.8 61.67 Favored 'General case' 0 N--CA 1.42 -1.935 0 C-N-CA 118.484 -1.286 . . . . 67.98 112.911 -175.033 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 20.0 t30 -72.39 -45.0 61.7 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-O 121.779 0.8 . . . . 61.36 110.83 -178.263 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 11.0 mtm105 -60.9 -47.24 87.3 Favored 'General case' 0 N--CA 1.439 -1.004 0 CA-C-N 114.268 -1.333 . . . . 79.43 111.669 176.296 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -51.09 -43.12 61.02 Favored 'General case' 0 C--O 1.202 -1.415 0 N-CA-C 112.931 0.715 . . . . 54.88 112.931 171.219 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 38.0 tp -73.32 -34.13 65.52 Favored 'General case' 0 N--CA 1.482 1.14 0 CA-C-O 121.937 0.875 . . . . 52.58 111.264 -176.54 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 12.4 mt -64.83 -53.97 38.48 Favored 'General case' 0 C--O 1.247 0.958 0 CA-C-N 115.633 -0.712 . . . . 59.0 110.336 175.979 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 52.8 m -50.67 -50.15 55.45 Favored 'General case' 0 C--O 1.2 -1.524 0 CA-C-N 115.604 -0.726 . . . . 51.51 110.946 176.148 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 60.4 mt -59.69 -44.2 93.1 Favored 'Isoleucine or valine' 0 C--O 1.246 0.916 0 O-C-N 122.025 -0.422 . . . . 52.83 110.028 -175.18 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ARG . . . . . 0.822 ' NH1' ' CG ' ' A' ' 68' ' ' ARG . 0.0 OUTLIER -57.75 -53.57 56.66 Favored 'General case' 0 C--O 1.26 1.637 0 O-C-N 124.211 0.945 . . . . 64.26 113.334 178.586 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 72.7 t -54.42 -46.84 70.58 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.813 0 CA-C-O 121.512 0.672 . . . . 56.95 110.97 173.603 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 74.8 t80 -57.55 -47.09 82.97 Favored 'General case' 0 CA--C 1.496 -1.109 0 C-N-CA 123.213 0.605 . . . . 58.99 111.181 -178.841 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 57.8 t -69.2 -19.3 23.49 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.02 0 C-N-CA 120.1 -0.64 . . . . 62.76 112.46 -177.005 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 11.2 t-160 -90.64 -29.35 17.82 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 118.849 -1.14 . . . . 74.17 108.906 -166.99 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 79.6 m-20 -98.13 15.33 24.64 Favored 'General case' 0 C--O 1.222 -0.376 0 CA-C-N 112.953 -1.93 . . . . 67.05 110.904 175.841 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' PHE . . . . . . . . . . . . . 66.1 t80 -67.41 137.22 55.76 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 118.924 -1.11 . . . . 63.36 113.786 -172.783 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ASN . . . . . 0.433 ' O ' ' C ' ' A' ' 76' ' ' PRO . 58.9 t-20 -145.29 98.73 4.62 Favored Pre-proline 0 CA--C 1.496 -1.13 0 N-CA-C 108.214 -1.032 . . . . 69.67 108.214 -175.767 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' PRO . . . . . 0.433 ' C ' ' O ' ' A' ' 75' ' ' ASN . 2.1 Cg_endo -38.0 -36.78 0.51 Allowed 'Trans proline' 0 N--CA 1.439 -1.721 0 C-N-CA 123.706 2.938 . . . . 67.15 107.952 -178.991 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 78.4 mm-40 -65.35 -22.23 66.79 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 118.256 2.687 . . . . 78.2 118.256 -176.169 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 76.5 mt-10 -84.47 -12.61 53.98 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-O 121.154 0.502 . . . . 80.72 111.73 -173.397 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 52.67 37.09 50.31 Favored Glycine 0 N--CA 1.442 -0.906 0 C-N-CA 119.843 -1.17 . . . . 62.51 113.964 -173.894 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 7.2 mtmt -95.34 148.21 22.68 Favored 'General case' 0 C--O 1.242 0.702 0 C-N-CA 120.055 -0.658 . . . . 71.53 111.995 176.426 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -144.58 -172.09 14.91 Favored Glycine 0 C--O 1.247 0.927 0 C-N-CA 120.834 -0.698 . . . . 55.4 111.927 -179.26 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -132.14 151.3 51.86 Favored 'General case' 0 CA--C 1.48 -1.726 0 CA-C-O 121.558 0.694 . . . . 53.46 111.43 170.578 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 96.8 m -116.57 126.09 52.8 Favored 'General case' 0 N--CA 1.432 -1.327 0 N-CA-C 107.637 -1.246 . . . . 49.77 107.637 176.042 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -108.64 121.23 44.59 Favored 'General case' 0 C--O 1.245 0.819 0 N-CA-C 107.63 -1.248 . . . . 52.23 107.63 177.243 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' VAL . . . . . 1.36 ' O ' ' CD ' ' A' ' 92' ' ' LYS . 6.4 t -103.78 -158.11 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 N-CA-C 106.418 -1.697 . . . . 56.39 106.418 -177.882 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 107.23 148.99 15.18 Favored Glycine 0 C--O 1.22 -0.757 0 N-CA-C 119.217 2.447 . . . . 54.13 119.217 176.516 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' SER . . . . . 0.55 ' CB ' ' CD ' ' A' ' 88' ' ' PRO . 14.0 m -58.99 176.02 0.3 Allowed Pre-proline 0 CA--C 1.489 -1.385 0 N-CA-C 104.593 -2.373 . . . . 59.55 104.593 172.29 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' PRO . . . . . 0.55 ' CD ' ' CB ' ' A' ' 87' ' ' SER . 18.9 Cg_endo -95.88 168.75 1.27 Allowed 'Trans proline' 0 C--O 1.248 0.992 1 C-N-CA 125.322 4.015 . . . . 61.78 113.464 -171.271 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 61.81 18.86 57.72 Favored Glycine 0 CA--C 1.524 0.597 0 N-CA-C 109.343 -1.503 . . . . 61.95 109.343 -173.771 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' VAL . . . . . 0.479 ' CG1' ' O ' ' A' ' 90' ' ' VAL . 55.1 t -98.2 -0.62 10.34 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.29 0 N-CA-C 113.546 0.943 . . . . 60.45 113.546 -174.644 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 85.53 17.59 61.85 Favored Glycine 0 C--O 1.243 0.68 0 C-N-CA 118.107 -1.997 . . . . 55.96 114.026 178.433 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' LYS . . . . . 1.36 ' CD ' ' O ' ' A' ' 85' ' ' VAL . 8.8 mtmm -61.31 -53.04 61.83 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-N 116.692 0.246 . . . . 51.7 110.945 170.999 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 93.1 m -68.23 -42.2 80.08 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 109.98 -0.378 . . . . 50.34 109.98 -177.906 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 29.7 t60 -47.91 -50.49 26.64 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 122.33 -0.231 . . . . 55.56 110.577 172.165 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 18.9 mt -66.1 -30.23 70.69 Favored 'General case' 0 N--CA 1.439 -1.008 0 N-CA-C 114.649 1.351 . . . . 51.13 114.649 -178.977 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -75.79 -39.26 57.28 Favored 'General case' 0 C--O 1.217 -0.649 0 CA-C-O 120.467 0.175 . . . . 49.94 110.602 -178.288 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 12.8 t -63.64 -42.76 97.17 Favored 'Isoleucine or valine' 0 C--O 1.241 0.614 0 CA-C-O 121.222 0.534 . . . . 50.7 109.648 172.452 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -58.35 -55.11 39.22 Favored 'General case' 0 N--CA 1.439 -1.022 0 CA-C-N 115.574 -0.739 . . . . 52.81 109.017 178.387 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 86.0 m -49.98 -42.93 49.95 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 123.176 0.59 . . . . 53.01 112.582 176.643 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 26.0 tp -65.55 -39.78 92.11 Favored 'General case' 0 C--O 1.21 -1.026 0 N-CA-C 109.69 -0.485 . . . . 55.96 109.69 -178.166 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 18.2 mtpp -68.51 -48.92 63.14 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 112.073 0.397 . . . . 72.07 112.073 -178.997 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' ALA . . . . . 0.924 ' CA ' ' OE2' ' A' ' 105' ' ' GLU . . . -57.11 -31.75 65.61 Favored 'General case' 0 C--O 1.209 -1.076 0 CA-C-O 121.697 0.761 . . . . 64.43 109.248 178.5 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' ILE . . . . . 0.492 ' O ' ' N ' ' A' ' 107' ' ' LYS . 7.0 mt -59.91 -59.29 4.23 Favored 'Isoleucine or valine' 0 C--O 1.26 1.607 0 C-N-CA 116.22 -2.192 . . . . 71.92 110.892 179.549 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' TYR . . . . . 1.258 ' O ' ' CD2' ' A' ' 104' ' ' TYR . 0.0 OUTLIER -78.58 -0.42 29.69 Favored 'General case' 0 CA--C 1.514 -0.442 0 CA-C-N 115.004 -0.998 . . . . 94.26 113.17 -170.423 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' GLU . . . . . 0.924 ' OE2' ' CA ' ' A' ' 102' ' ' ALA . 16.6 pt-20 -96.52 -28.39 14.42 Favored 'General case' 0 C--O 1.211 -0.928 0 N-CA-C 107.674 -1.232 . . . . 96.33 107.674 175.876 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 37.7 mttt -118.64 0.06 11.43 Favored 'General case' 0 C--O 1.246 0.902 0 CA-C-O 121.011 0.434 . . . . 86.83 110.308 -177.067 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' LYS . . . . . 0.492 ' N ' ' O ' ' A' ' 103' ' ' ILE . 0.0 OUTLIER -140.13 6.38 2.16 Favored 'General case' 0 C--O 1.242 0.706 0 N-CA-C 117.752 2.501 . . . . 78.29 117.752 175.963 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . 41.17 26.53 0.18 Allowed Glycine 0 N--CA 1.48 1.582 0 C-N-CA 127.561 2.505 . . . . 76.75 117.79 -174.057 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 40.8 mt -101.39 133.48 44.61 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.821 0 CA-C-O 121.622 0.725 . . . . 75.66 111.502 -177.942 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 4.8 mtt180 -94.69 119.72 33.78 Favored 'General case' 0 C--N 1.308 -1.225 0 C-N-CA 117.638 -1.625 . . . . 99.34 110.936 -170.042 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -85.14 -150.65 13.13 Favored Glycine 0 N--CA 1.417 -2.626 0 C-N-CA 117.0 -2.524 . . . . 72.69 113.637 178.18 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' TYR . . . . . 0.444 ' CD2' ' OG ' ' A' ' 142' ' ' SER . 9.9 m-85 -157.9 143.97 17.39 Favored 'General case' 0 N--CA 1.437 -1.091 0 N-CA-C 108.32 -0.992 . . . . 80.01 108.32 170.725 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 58.6 t80 -122.12 121.54 37.16 Favored 'General case' 0 N--CA 1.426 -1.628 0 C-N-CA 118.277 -1.369 . . . . 59.73 111.13 -178.268 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 91.2 m-85 -129.32 144.6 51.3 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 114.066 1.136 . . . . 55.35 114.066 177.484 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -78.8 122.72 26.4 Favored 'General case' 0 CA--C 1.495 -1.169 0 N-CA-C 104.562 -2.384 . . . . 54.11 104.562 162.076 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 86.1 m -49.46 -44.28 45.68 Favored 'General case' 0 N--CA 1.432 -1.355 0 CA-C-N 115.183 -0.917 . . . . 59.55 111.985 -172.026 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 12.3 tttt -68.08 -34.8 77.09 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.536 0.684 . . . . 78.63 111.645 -178.168 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 55.0 t0 -67.37 -47.38 70.56 Favored 'General case' 0 N--CA 1.435 -1.207 0 CA-C-N 115.461 -0.79 . . . . 71.08 109.286 -179.126 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 62.3 tp -55.47 -55.87 26.82 Favored 'General case' 0 C--O 1.217 -0.606 0 CA-C-N 116.164 -0.471 . . . . 64.85 111.555 174.954 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 3.8 mt -56.2 -56.82 11.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 121.999 0.904 . . . . 71.3 110.56 -178.617 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 10.4 m-85 -49.76 -44.89 48.96 Favored 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 118.883 -1.127 . . . . 79.77 113.814 174.741 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 12.4 mtt180 -58.69 -51.14 71.19 Favored 'General case' 0 CA--C 1.509 -0.627 0 O-C-N 121.146 -0.971 . . . . 86.38 110.275 178.762 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 98.3 mt -63.37 -44.58 94.35 Favored 'General case' 0 CA--C 1.5 -0.969 0 CA-C-N 115.163 -0.926 . . . . 78.24 111.707 -172.328 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' LYS . . . . . 0.513 ' CD ' ' CE3' ' A' ' 158' ' ' TRP . 23.3 tttt -58.86 -35.63 73.28 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 118.871 -1.131 . . . . 90.8 108.595 -178.858 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' HIS . . . . . 0.493 ' O ' ' CD2' ' A' ' 125' ' ' HIS . 11.6 t-160 -77.79 -31.62 51.94 Favored 'General case' 0 N--CA 1.442 -0.857 0 N-CA-C 115.952 1.834 . . . . 91.32 115.952 -177.462 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' LEU . . . . . 1.344 ' CD1' ' OD2' ' A' ' 132' ' ' ASP . 0.6 OUTLIER -87.77 -6.06 58.35 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 118.002 -1.479 . . . . 91.46 111.082 172.042 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' MSE . . . . . . . . . . . . . 2.5 ttp -91.75 -32.12 15.52 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 115.006 -0.997 . . . . 94.0 110.85 178.025 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . 0.485 1.8 p30 -93.8 -16.02 24.55 Favored 'General case' 0 C--N 1.314 -0.963 0 C-N-CA 114.424 -2.91 . . . . 98.68 117.906 164.761 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 17.3 tp10 -66.39 -39.61 89.17 Favored 'General case' 0 C--O 1.207 -1.135 0 N-CA-C 104.51 -2.404 . . . . 106.42 104.51 160.358 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 93.48 16.4 46.42 Favored Glycine 0 C--O 1.22 -0.781 0 C-N-CA 116.929 -2.558 . . . . 98.6 115.697 160.948 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' LYS . . . . . 0.519 ' CE ' ' O ' ' A' ' 41' ' ' HOH . 68.5 mttt -105.59 -56.18 2.22 Favored 'General case' 0 C--N 1.309 -1.177 0 C-N-CA 117.55 -1.66 . . . . 104.31 111.971 -169.454 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' ASP . . . . . 1.344 ' OD2' ' CD1' ' A' ' 126' ' ' LEU 0.647 7.8 t0 -66.84 103.33 1.1 Allowed 'General case' 0 CA--C 1.469 -2.156 0 N-CA-C 119.63 3.196 . . . . 106.17 119.63 175.418 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -100.01 -4.21 30.48 Favored 'General case' 0 C--O 1.253 1.278 0 N-CA-C 104.463 -2.421 . . . . 96.65 104.463 172.118 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' LYS . . . . . 0.691 ' CE ' ' O ' ' A' ' 226' ' ' HOH . 7.3 mttt -77.94 -34.97 50.94 Favored 'General case' 0 C--O 1.246 0.898 0 CA-C-N 112.867 -1.969 . . . . 102.95 113.638 -171.186 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' PHE . . . . . 0.586 ' N ' ' OD1' ' A' ' 132' ' ' ASP . 71.0 t80 -69.68 -47.12 64.35 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.831 -0.622 . . . . 83.64 110.493 175.169 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 48.1 tp -55.69 -42.91 75.86 Favored 'General case' 0 C--O 1.224 -0.283 0 N-CA-C 113.54 0.941 . . . . 77.59 113.54 176.071 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 35.5 mttt -69.59 -40.57 76.6 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 113.343 0.868 . . . . 82.71 113.343 -177.822 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 19.9 p -72.06 -27.78 62.91 Favored 'General case' 0 C--O 1.241 0.635 0 C-N-CA 120.886 -0.326 . . . . 76.31 111.244 -179.593 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' VAL . . . . . . . . . . . . . 35.9 t -73.11 -45.58 53.59 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.481 0 CA-C-O 121.066 0.46 . . . . 69.79 111.614 173.963 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' LEU . . . . . 0.496 ' CB ' ' CD2' ' A' ' 169' ' ' TYR . 42.6 mt -67.99 -29.75 68.84 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 114.17 1.174 . . . . 65.76 114.17 178.794 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -100.18 5.56 44.76 Favored 'General case' 0 CA--C 1.477 -1.837 0 N-CA-C 113.631 0.975 . . . . 68.28 113.631 -172.874 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' SER . . . . . 0.444 ' OG ' ' CD2' ' A' ' 112' ' ' TYR . 0.1 OUTLIER -62.75 132.41 94.69 Favored Pre-proline 0 N--CA 1.413 -2.275 0 CA-C-N 113.953 -1.476 . . . . 64.88 111.279 179.741 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -62.76 -31.75 78.39 Favored 'Trans proline' 0 C--O 1.235 0.35 0 C-N-CA 124.787 3.658 . . . . 60.74 114.541 173.497 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 2.6 t -139.57 135.37 39.79 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.288 0 N-CA-C 107.926 -1.138 . . . . 58.78 107.926 171.494 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 29.4 tp -138.3 127.67 24.59 Favored 'General case' 0 CA--C 1.503 -0.831 0 N-CA-C 109.409 -0.589 . . . . 55.61 109.409 -178.887 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 89.3 t -101.4 110.43 28.24 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.454 0 CA-C-O 121.537 0.684 . . . . 52.7 110.605 175.84 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 55.0 mt -96.5 93.5 6.83 Favored 'General case' 0 N--CA 1.424 -1.758 0 N-CA-C 107.843 -1.169 . . . . 53.98 107.843 173.597 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' ASP . . . . . 0.501 ' O ' ' CB ' ' A' ' 149' ' ' ASP . 10.5 t70 -77.92 129.52 35.45 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.104 -0.639 . . . . 59.67 111.874 -175.9 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' ASP . . . . . 0.501 ' CB ' ' O ' ' A' ' 148' ' ' ASP . 0.2 OUTLIER 65.79 40.2 4.39 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 117.271 -1.771 . . . . 65.81 114.552 -177.331 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 25.1 tp -66.81 76.84 0.12 Allowed 'General case' 0 N--CA 1.435 -1.223 0 N-CA-C 108.836 -0.802 . . . . 68.84 108.836 -179.177 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' GLY . . . . . 0.415 ' N ' ' O ' ' A' ' 149' ' ' ASP . . . 111.65 -2.5 27.62 Favored Glycine 0 C--O 1.21 -1.396 0 C-N-CA 116.344 -2.836 . . . . 74.61 117.723 159.35 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -44.07 139.2 2.58 Favored 'General case' 0 CA--C 1.564 1.482 0 CA-C-N 118.595 1.198 . . . . 78.91 109.616 157.231 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' GLU . . . . . 0.769 ' CG ' ' O ' ' A' ' 40' ' ' HOH . 0.0 OUTLIER 73.99 170.64 0.3 Allowed 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 108.582 -0.896 . . . . 88.0 108.582 -175.505 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 17.8 mtt180 -101.41 139.38 37.15 Favored 'General case' 0 C--O 1.244 0.765 0 N-CA-C 113.34 0.867 . . . . 97.8 113.34 -174.174 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' LEU . . . . . 0.552 ' CB ' ' NE ' ' A' ' 160' ' ' ARG . 60.5 mt -109.35 115.86 30.76 Favored 'General case' 0 CA--C 1.503 -0.845 0 C-N-CA 126.875 2.07 . . . . 78.7 111.391 -169.686 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' SER . . . . . 0.692 ' O ' ' N ' ' A' ' 158' ' ' TRP . 99.7 p -58.69 119.87 7.9 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 115.45 1.648 . . . . 77.24 115.45 174.76 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' ASP . . . . . 0.457 ' C ' ' O ' ' A' ' 156' ' ' SER . 0.7 OUTLIER 5.26 -52.42 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 119.376 3.102 . . . . 83.65 119.376 169.517 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 158' ' ' TRP . . . . . 0.692 ' N ' ' O ' ' A' ' 156' ' ' SER 0.282 40.7 p-90 -73.93 -43.97 56.55 Favored 'General case' 0 N--CA 1.507 2.408 0 N-CA-C 113.786 1.032 . . . . 85.16 113.786 -178.714 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 6.0 mt-30 -63.57 -43.92 95.59 Favored 'General case' 0 C--O 1.221 -0.424 0 O-C-N 121.259 -0.901 . . . . 77.73 112.998 169.864 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 160' ' ' ARG . . . . . 0.784 ' CZ ' ' O ' ' A' ' 202' ' ' ARG . 29.0 mmt85 -45.58 -51.05 12.54 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 118.979 -0.534 . . . . 100.32 112.384 168.985 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 94.1 mt-10 -55.94 -49.71 72.74 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 115.148 1.536 . . . . 88.98 115.148 179.005 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 74.0 mt -57.84 -43.88 86.13 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 126.497 1.919 . . . . 70.81 115.112 174.519 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 163' ' ' ILE . . . . . 0.479 ' CD1' ' CD1' ' A' ' 155' ' ' LEU . 96.9 mt -62.88 -54.16 37.31 Favored 'Isoleucine or valine' 0 C--N 1.35 0.624 0 O-C-N 124.215 0.947 . . . . 62.54 111.04 175.916 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 6.7 t -52.54 -43.95 65.49 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.475 0.655 . . . . 58.89 112.03 177.221 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 24.1 t80 -57.21 -52.51 65.01 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 113.043 0.757 . . . . 60.85 113.043 174.053 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 166' ' ' ILE . . . . . . . . . . . . . 40.0 mt -69.85 -34.88 62.37 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.815 0 N-CA-C 108.888 -0.782 . . . . 53.98 108.888 -171.268 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 167' ' ' ILE . . . . . . . . . . . . . 9.2 mt -79.74 -38.82 19.53 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.822 0 CA-C-N 116.183 -0.462 . . . . 54.77 111.273 -179.193 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 91.8 m -58.07 -42.29 85.2 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 119.531 -0.867 . . . . 54.31 109.833 173.557 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 169' ' ' TYR . . . . . 1.432 ' CE1' ' ND2' ' A' ' 173' ' ' ASN . 12.3 t80 -63.53 -47.87 79.86 Favored 'General case' 0 N--CA 1.439 -1.014 0 N-CA-C 114.598 1.333 . . . . 70.83 114.598 -178.252 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 170' ' ' ARG . . . . . 0.665 ' CB ' ' O ' ' A' ' 223' ' ' HOH . 72.3 mtp85 -73.19 -26.22 61.08 Favored 'General case' 0 CA--C 1.483 -1.617 0 CA-C-N 115.973 -0.558 . . . . 52.8 111.128 -177.161 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 171' ' ' TYR . . . . . . . . . . . . . 56.2 t80 -69.06 -50.54 47.54 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 115.774 -0.648 . . . . 54.08 109.644 170.52 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 172' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -63.18 -35.17 79.41 Favored 'General case' 0 C--O 1.254 1.302 0 N-CA-C 113.917 1.08 . . . . 53.25 113.917 -179.236 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 173' ' ' ASN . . . . . 1.432 ' ND2' ' CE1' ' A' ' 169' ' ' TYR . 74.4 m-20 -103.41 21.6 15.7 Favored 'General case' 0 C--O 1.209 -1.064 0 C-N-CA 119.804 -0.758 . . . . 60.69 112.447 -169.992 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 63.9 mt 44.27 55.54 5.47 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.982 0.913 . . . . 52.57 112.364 -178.797 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 2.6 mmtt -106.06 122.0 45.27 Favored 'General case' 0 N--CA 1.434 -1.231 0 CA-C-N 115.851 -0.613 . . . . 67.01 109.391 178.231 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 176' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.43 124.84 25.5 Favored 'General case' 0 CA--C 1.5 -0.945 0 CA-C-N 114.961 -1.018 . . . . 59.2 110.918 -173.476 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 177' ' ' THR . . . . . 0.578 ' CB ' ' O ' ' A' ' 223' ' ' HOH . 9.9 t -131.53 126.84 35.93 Favored 'General case' 0 C--O 1.253 1.28 0 CA-C-N 114.345 -1.298 . . . . 58.64 109.164 -171.232 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 80.8 mt -106.14 132.41 53.33 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 C-N-CA 123.766 0.826 . . . . 55.85 109.72 -178.126 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 24.2 mt -129.11 141.42 46.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 N-CA-C 112.384 0.513 . . . . 55.17 112.384 -170.954 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 180' ' ' THR . . . . . . . . . . . . . 62.1 p -126.12 135.56 51.84 Favored 'General case' 0 CA--C 1.488 -1.408 0 N-CA-C 107.903 -1.147 . . . . 59.93 107.903 169.353 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -142.81 155.27 44.78 Favored 'General case' 0 N--CA 1.427 -1.606 0 CA-C-N 115.129 -0.941 . . . . 68.18 109.378 -177.727 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 182' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -92.39 134.78 34.61 Favored 'General case' 0 C--N 1.314 -0.967 0 N-CA-C 114.089 1.144 . . . . 80.74 114.089 179.604 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 60.8 t80 -137.88 140.24 40.3 Favored 'General case' 0 N--CA 1.494 1.757 0 C-N-CA 127.732 2.413 . . . . 95.5 107.212 173.55 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 184' ' ' SER . . . . . 0.424 ' CB ' ' O ' ' A' ' 38' ' ' HOH . 81.8 p -132.61 -38.56 1.02 Allowed 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 118.481 2.771 . . . . 96.66 118.481 -164.074 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 185' ' ' LEU . . . . . . . . . . . . . 76.8 mt -90.16 130.89 36.26 Favored 'General case' 0 N--CA 1.515 2.782 0 C-N-CA 124.007 0.923 . . . . 102.91 112.3 177.024 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 186' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -103.77 -31.76 9.67 Favored 'General case' 0 N--CA 1.501 2.1 1 N-CA-C 128.887 6.625 . . . . 110.19 128.887 -126.271 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.473 0.713 0 C-N-CA 114.358 -2.937 . . . . 109.02 116.046 -163.579 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 191' ' ' SER . . . . . 0.619 ' CB ' ' O ' ' A' ' 18' ' ' HOH . 0.1 OUTLIER . . . . . 0 CA--C 1.507 -0.675 0 N-CA-C 112.802 0.667 . . . . 111.26 112.802 . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 192' ' ' SER . . . . . 0.727 ' O ' ' O ' ' A' ' 17' ' ' HOH . 6.0 m -34.99 -61.41 0.42 Allowed 'General case' 0 CA--C 1.491 -1.316 0 CA-C-O 122.794 1.283 . . . . 110.5 109.937 -176.507 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 193' ' ' VAL . . . . . . . . . . . . 0.481 85.8 t -108.84 -3.59 10.38 Favored 'Isoleucine or valine' 0 N--CA 1.386 -3.654 1 C-N-CA 103.873 -7.131 . . . . 107.79 110.893 -156.085 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 194' ' ' ARG . . . . . 0.481 ' CG ' ' O ' ' A' ' 28' ' ' HOH . 38.8 ttm180 -72.71 -46.46 53.54 Favored 'General case' 0 C--O 1.252 1.223 0 N-CA-C 103.793 -2.669 . . . . 109.49 103.793 170.09 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 195' ' ' ILE . . . . . 0.582 ' CG1' ' O ' ' A' ' 191' ' ' SER . 21.1 mt -53.76 -26.22 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.864 0 N-CA-C 105.65 -1.981 . . . . 97.23 105.65 178.321 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 196' ' ' SER . . . . . 0.408 ' N ' ' C ' ' A' ' 194' ' ' ARG . 66.6 m -70.57 -47.05 62.17 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 120.01 -0.676 . . . . 90.96 111.629 178.782 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -81.88 -27.97 33.18 Favored 'General case' 0 CA--C 1.503 -0.828 0 N-CA-C 107.528 -1.286 . . . . 85.35 107.528 -169.212 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 198' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -66.46 -47.14 74.04 Favored 'General case' 0 N--CA 1.434 -1.243 0 CA-C-N 114.773 -1.103 . . . . 78.9 109.697 178.302 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 199' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -62.68 -41.45 99.1 Favored 'General case' 0 C--O 1.255 1.387 0 CA-C-O 121.205 0.526 . . . . 74.23 111.298 173.894 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 200' ' ' ALA . . . . . . . . . . . . . . . -58.92 -34.61 71.9 Favored 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 115.276 -0.875 . . . . 69.47 112.523 178.356 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' SER . . . . . . . . . . . . . 50.5 p -62.45 -22.9 66.57 Favored 'General case' 0 CA--C 1.556 1.174 0 N-CA-C 118.745 2.868 . . . . 66.85 118.745 -177.765 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' ARG . . . . . 0.784 ' O ' ' CZ ' ' A' ' 160' ' ' ARG . 8.5 ptt-85 -125.4 -8.89 6.92 Favored 'General case' 0 C--O 1.253 1.242 0 CA-C-N 119.245 0.929 . . . . 68.53 109.382 179.821 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 12.0 mt -101.82 -29.96 11.56 Favored 'General case' 0 C--O 1.215 -0.722 0 N-CA-C 115.428 1.64 . . . . 63.47 115.428 171.434 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' GLY . . . . . . . . . . . . . . . 101.31 143.79 14.33 Favored Glycine 0 CA--C 1.523 0.538 0 CA-C-N 116.501 -0.318 . . . . 63.82 112.395 -170.654 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 74.5 mm-40 -50.41 -42.69 54.17 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 121.401 0.619 . . . . 87.21 112.3 174.646 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 51.8 t30 -63.5 -50.5 69.38 Favored 'General case' 0 CA--C 1.505 -0.772 0 CA-C-N 115.6 -0.727 . . . . 65.19 112.178 -169.634 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 207' ' ' VAL . . . . . . . . . . . . . 65.2 t -64.52 -40.9 90.67 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 O-C-N 123.787 0.679 . . . . 58.27 111.152 -178.423 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' VAL . . . . . . . . . . . . . 25.2 t -67.07 -43.79 88.59 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 CA-C-N 116.225 -0.443 . . . . 52.81 112.118 -178.108 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 5.5 t -55.98 -46.23 78.71 Favored 'General case' 0 CA--C 1.494 -1.209 0 CA-C-O 121.502 0.668 . . . . 51.33 111.0 175.61 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 68.5 mttt -63.62 -47.44 81.37 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-N 115.787 -0.642 . . . . 56.26 111.47 175.68 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 211' ' ' ILE . . . . . . . . . . . . . 17.9 mt -51.47 -31.32 12.01 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.946 0 C-N-CA 118.958 -1.097 . . . . 57.16 110.789 -179.605 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 3.0 m-30 -78.46 -27.4 46.35 Favored 'General case' 0 CA--C 1.466 -2.253 0 N-CA-C 113.003 0.742 . . . . 74.39 113.003 -175.955 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 213' ' ' GLU . . . . . 0.519 ' CG ' ' O ' ' A' ' 213' ' ' GLU . 0.1 OUTLIER -88.16 -0.7 57.4 Favored 'General case' 0 N--CA 1.407 -2.589 0 C-N-CA 115.121 -2.632 . . . . 68.76 106.695 -174.973 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 214' ' ' MSE . . . . . . . . . . . . . 0.8 OUTLIER -109.46 -29.12 8.57 Favored 'General case' 0 C--N 1.313 -0.998 0 C-N-CA 116.812 -1.955 . . . . 59.91 112.71 179.803 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 215' ' ' ASN . . . . . . . . . . . . . 37.5 m-20 -121.04 149.61 42.44 Favored 'General case' 0 N--CA 1.433 -1.279 0 CA-C-N 115.562 -0.745 . . . . 58.81 112.909 -167.53 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 216' ' ' GLU . . . . . . . . . . . . . 49.2 tt0 -90.65 139.93 30.25 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 115.87 -0.605 . . . . 67.71 110.685 168.968 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 217' ' ' LEU . . . . . . . . . . . . . 27.9 tp -89.31 124.38 34.36 Favored 'General case' 0 N--CA 1.44 -0.927 0 N-CA-C 112.098 0.407 . . . . 58.1 112.098 -171.586 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 68.4 mt -121.06 102.72 8.51 Favored 'General case' 0 C--O 1.202 -1.415 0 N-CA-C 111.787 0.292 . . . . 53.7 111.787 177.012 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 219' ' ' VAL . . . . . . . . . . . . 0.326 54.0 t -86.81 116.34 29.19 Favored 'Isoleucine or valine' 0 CA--C 1.47 -2.099 0 CA-C-O 117.263 -1.351 . . . . 55.91 109.89 177.785 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 220' ' ' ILE . . . . . . . . . . . . . 20.8 mt -106.47 127.24 61.99 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.689 0 C-N-CA 125.201 1.4 . . . . 62.16 111.18 -177.174 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 221' ' ' LYS . . . . . 0.477 ' CD ' ' O ' ' A' ' 22' ' ' HOH . 10.2 mtmt . . . . . 0 CA--C 1.504 -0.818 0 C-N-CA 120.85 -0.34 . . . . 64.41 111.837 -172.461 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 222' ' ' ADP . . . . . 0.46 ' N6 ' ' CE1' ' A' ' 53' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 300' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' HOH . . . . . 0.435 ' O ' ' NH1' ' A' ' 44' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' HOH . . . . . 0.727 ' O ' ' O ' ' A' ' 192' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' HOH . . . . . 0.619 ' O ' ' CB ' ' A' ' 191' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' HOH . . . . . 0.477 ' O ' ' CD ' ' A' ' 221' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' HOH . . . . . 0.725 ' O ' ' CA ' ' A' ' 43' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' HOH . . . . . 0.481 ' O ' ' CG ' ' A' ' 194' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' HOH . . . . . 0.414 ' O ' ' CA ' ' A' ' 134' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' HOH . . . . . 0.424 ' O ' ' CB ' ' A' ' 184' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' HOH . . . . . 0.769 ' O ' ' CG ' ' A' ' 153' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' HOH . . . . . 0.519 ' O ' ' CE ' ' A' ' 131' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 223' ' ' HOH . . . . . 0.665 ' O ' ' CB ' ' A' ' 170' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 225' ' ' HOH . . . . . 0.55 ' O ' ' CG ' ' A' ' 153' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 226' ' ' HOH . . . . . 0.691 ' O ' ' CE ' ' A' ' 134' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 228' ' ' HOH . . . . . 0.672 ' O ' ' CD2' ' A' ' 126' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ALA . . . . . 0.569 ' O ' ' HG2' ' A' ' 43' ' ' LYS . . . . . . . . 0 N--CA 1.492 1.63 0 N-CA-C 114.39 1.256 . . . . 68.74 114.39 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' LYS . . . . . 0.725 ' CA ' ' O ' ' A' ' 24' ' ' HOH 0.343 18.1 mtmt -144.2 55.93 1.3 Allowed 'General case' 0 CA--C 1.483 -1.596 0 N-CA-C 120.667 3.58 . . . . 68.04 120.667 -161.927 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.4 ttm105 -92.75 -10.68 36.14 Favored 'General case' 0 N--CA 1.402 -2.847 0 N-CA-C 102.49 -3.152 . . . . 63.53 102.49 153.393 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 91.7 m-85 -110.34 18.64 19.65 Favored 'General case' 0 C--O 1.218 -0.567 0 CA-C-N 114.887 -1.051 . . . . 56.78 111.588 -177.294 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' TRP . . . . . 0.741 ' CG ' ' N ' ' A' ' 47' ' ' ASN . 39.3 p-90 -46.22 -57.37 4.61 Favored 'General case' 0 C--O 1.199 -1.596 0 N-CA-C 108.397 -0.964 . . . . 57.16 108.397 176.183 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ASN . . . . . 0.741 ' N ' ' CG ' ' A' ' 46' ' ' TRP . 9.6 p-10 -59.07 -19.81 47.61 Favored 'General case' 0 CA--C 1.584 2.265 0 N-CA-C 119.508 3.151 . . . . 65.2 119.508 172.309 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -53.2 107.84 0.27 Allowed 'General case' 0 N--CA 1.485 1.323 0 O-C-N 120.628 -1.295 . . . . 66.72 114.246 -177.833 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' ASN . . . . . 0.748 ' C ' ' H ' ' A' ' 51' ' ' ASP . 30.9 m-80 -139.46 138.88 36.81 Favored 'General case' 0 CA--C 1.501 -0.927 0 O-C-N 121.517 -0.74 . . . . 75.47 111.718 -179.723 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 50' ' ' LEU . . . . . 0.468 HD21 HG21 ' A' ' 67' ' ' ILE . 6.8 mt -46.84 -9.92 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 107.583 -1.266 . . . . 77.44 107.583 173.411 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 51' ' ' ASP . . . . . 0.906 ' C ' ' H ' ' A' ' 53' ' ' TYR . 0.4 OUTLIER -105.3 -40.0 5.98 Favored 'General case' 0 C--O 1.217 -0.633 0 N-CA-C 120.043 3.349 . . . . 88.84 120.043 -168.589 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 52' ' ' THR . . . . . 1.066 HG22 ' O ' ' A' ' 52' ' ' THR 0.438 15.4 m -51.03 0.34 0.01 OUTLIER 'General case' 0 CA--C 1.471 -2.082 0 N-CA-C 104.707 -2.331 . . . . 78.73 104.707 163.201 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 53' ' ' TYR . . . . . 0.906 ' H ' ' C ' ' A' ' 51' ' ' ASP 0.47 9.2 t80 -82.28 112.8 19.61 Favored 'General case' 1 CA--C 1.407 -4.524 1 C-N-CA 108.531 -5.268 . . . . 76.19 115.476 -156.076 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 48.8 m80 -119.95 106.77 40.88 Favored Pre-proline 0 N--CA 1.413 -2.312 0 C-N-CA 114.243 -2.983 . . . . 84.88 114.233 175.022 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -71.3 148.37 55.11 Favored 'Trans proline' 0 N--CA 1.45 -1.044 0 C-N-CA 123.355 2.703 . . . . 70.96 110.986 -174.352 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 2.8 mttm -123.12 -2.93 8.57 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 112.688 0.625 . . . . 87.45 112.688 -168.934 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 21.4 p-10 -153.33 176.44 11.98 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 107.984 -1.117 . . . . 76.26 107.984 172.951 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 8.1 t -64.68 -33.91 66.42 Favored 'Isoleucine or valine' 0 C--O 1.237 0.433 0 C-N-CA 119.834 -0.747 . . . . 68.43 111.319 -178.959 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 5.9 m -52.29 -51.19 59.94 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 125.727 1.611 . . . . 68.74 109.756 174.848 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 57.8 mt-30 -73.38 -27.8 61.67 Favored 'General case' 0 N--CA 1.42 -1.935 0 C-N-CA 118.484 -1.286 . . . . 67.98 112.911 -175.033 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 20.0 t30 -72.39 -45.0 61.7 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-O 121.779 0.8 . . . . 61.36 110.83 -178.263 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' ARG . . . . . 0.753 ' HG2' ' O ' ' A' ' 27' ' ' HOH . 11.0 mtm105 -60.9 -47.24 87.3 Favored 'General case' 0 N--CA 1.439 -1.004 0 CA-C-N 114.268 -1.333 . . . . 79.43 111.669 176.296 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -51.09 -43.12 61.02 Favored 'General case' 0 C--O 1.202 -1.415 0 N-CA-C 112.931 0.715 . . . . 54.88 112.931 171.219 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 38.0 tp -73.32 -34.13 65.52 Favored 'General case' 0 N--CA 1.482 1.14 0 CA-C-O 121.937 0.875 . . . . 52.58 111.264 -176.54 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 12.4 mt -64.83 -53.97 38.48 Favored 'General case' 0 C--O 1.247 0.958 0 CA-C-N 115.633 -0.712 . . . . 59.0 110.336 175.979 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' THR . . . . . 0.477 HG21 HD21 ' A' ' 218' ' ' LEU . 52.8 m -50.67 -50.15 55.45 Favored 'General case' 0 C--O 1.2 -1.524 0 CA-C-N 115.604 -0.726 . . . . 51.51 110.946 176.148 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 67' ' ' ILE . . . . . 0.578 ' O ' HG23 ' A' ' 71' ' ' VAL . 60.4 mt -59.69 -44.2 93.1 Favored 'Isoleucine or valine' 0 C--O 1.246 0.916 0 O-C-N 122.025 -0.422 . . . . 52.83 110.028 -175.18 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ARG . . . . . 1.021 ' CG ' HH11 ' A' ' 68' ' ' ARG . 0.0 OUTLIER -57.75 -53.57 56.66 Favored 'General case' 0 C--O 1.26 1.637 0 O-C-N 124.211 0.945 . . . . 64.26 113.334 178.586 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 72.7 t -54.42 -46.84 70.58 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.813 0 CA-C-O 121.512 0.672 . . . . 56.95 110.97 173.603 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 74.8 t80 -57.55 -47.09 82.97 Favored 'General case' 0 CA--C 1.496 -1.109 0 C-N-CA 123.213 0.605 . . . . 58.99 111.181 -178.841 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' VAL . . . . . 0.578 HG23 ' O ' ' A' ' 67' ' ' ILE . 57.8 t -69.2 -19.3 23.49 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.02 0 C-N-CA 120.1 -0.64 . . . . 62.76 112.46 -177.005 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 11.2 t-160 -90.64 -29.35 17.82 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 118.849 -1.14 . . . . 74.17 108.906 -166.99 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 79.6 m-20 -98.13 15.33 24.64 Favored 'General case' 0 C--O 1.222 -0.376 0 CA-C-N 112.953 -1.93 . . . . 67.05 110.904 175.841 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' PHE . . . . . 0.518 ' HA ' ' O ' ' A' ' 6' ' ' HOH . 66.1 t80 -67.41 137.22 55.76 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 118.924 -1.11 . . . . 63.36 113.786 -172.783 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ASN . . . . . 0.559 ' HB3' ' HG3' ' A' ' 78' ' ' GLU . 58.9 t-20 -145.29 98.73 4.62 Favored Pre-proline 0 CA--C 1.496 -1.13 0 N-CA-C 108.214 -1.032 . . . . 69.67 108.214 -175.767 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 76' ' ' PRO . . . . . 0.433 ' C ' ' O ' ' A' ' 75' ' ' ASN . 2.1 Cg_endo -38.0 -36.78 0.51 Allowed 'Trans proline' 0 N--CA 1.439 -1.721 0 C-N-CA 123.706 2.938 . . . . 67.15 107.952 -178.991 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 78.4 mm-40 -65.35 -22.23 66.79 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 118.256 2.687 . . . . 78.2 118.256 -176.169 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' GLU . . . . . 0.559 ' HG3' ' HB3' ' A' ' 75' ' ' ASN . 76.5 mt-10 -84.47 -12.61 53.98 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-O 121.154 0.502 . . . . 80.72 111.73 -173.397 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 52.67 37.09 50.31 Favored Glycine 0 N--CA 1.442 -0.906 0 C-N-CA 119.843 -1.17 . . . . 62.51 113.964 -173.894 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 7.2 mtmt -95.34 148.21 22.68 Favored 'General case' 0 C--O 1.242 0.702 0 C-N-CA 120.055 -0.658 . . . . 71.53 111.995 176.426 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -144.58 -172.09 14.91 Favored Glycine 0 C--O 1.247 0.927 0 C-N-CA 120.834 -0.698 . . . . 55.4 111.927 -179.26 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -132.14 151.3 51.86 Favored 'General case' 0 CA--C 1.48 -1.726 0 CA-C-O 121.558 0.694 . . . . 53.46 111.43 170.578 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 96.8 m -116.57 126.09 52.8 Favored 'General case' 0 N--CA 1.432 -1.327 0 N-CA-C 107.637 -1.246 . . . . 49.77 107.637 176.042 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' PHE . . . . . 0.552 ' HB2' HG22 ' A' ' 180' ' ' THR . 97.7 m-85 -108.64 121.23 44.59 Favored 'General case' 0 C--O 1.245 0.819 0 N-CA-C 107.63 -1.248 . . . . 52.23 107.63 177.243 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 85' ' ' VAL . . . . . 1.36 ' O ' ' CD ' ' A' ' 92' ' ' LYS . 6.4 t -103.78 -158.11 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 N-CA-C 106.418 -1.697 . . . . 56.39 106.418 -177.882 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 86' ' ' GLY . . . . . 0.795 ' H ' HG12 ' A' ' 85' ' ' VAL . . . 107.23 148.99 15.18 Favored Glycine 0 C--O 1.22 -0.757 0 N-CA-C 119.217 2.447 . . . . 54.13 119.217 176.516 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 87' ' ' SER . . . . . 0.742 ' HB3' ' CD ' ' A' ' 88' ' ' PRO . 14.0 m -58.99 176.02 0.3 Allowed Pre-proline 0 CA--C 1.489 -1.385 0 N-CA-C 104.593 -2.373 . . . . 59.55 104.593 172.29 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 88' ' ' PRO . . . . . 0.742 ' CD ' ' HB3' ' A' ' 87' ' ' SER . 18.9 Cg_endo -95.88 168.75 1.27 Allowed 'Trans proline' 0 C--O 1.248 0.992 1 C-N-CA 125.322 4.015 . . . . 61.78 113.464 -171.271 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 61.81 18.86 57.72 Favored Glycine 0 CA--C 1.524 0.597 0 N-CA-C 109.343 -1.503 . . . . 61.95 109.343 -173.771 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' VAL . . . . . 0.734 ' CG1' HG22 ' A' ' 220' ' ' ILE . 55.1 t -98.2 -0.62 10.34 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.29 0 N-CA-C 113.546 0.943 . . . . 60.45 113.546 -174.644 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 91' ' ' GLY . . . . . 0.661 ' HA3' ' O ' ' A' ' 229' ' ' HOH . . . 85.53 17.59 61.85 Favored Glycine 0 C--O 1.243 0.68 0 C-N-CA 118.107 -1.997 . . . . 55.96 114.026 178.433 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 92' ' ' LYS . . . . . 1.36 ' CD ' ' O ' ' A' ' 85' ' ' VAL . 8.8 mtmm -61.31 -53.04 61.83 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-N 116.692 0.246 . . . . 51.7 110.945 170.999 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 93.1 m -68.23 -42.2 80.08 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 109.98 -0.378 . . . . 50.34 109.98 -177.906 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' HIS . . . . . 0.438 ' HB2' " H2'" ' A' ' 222' ' ' ADP . 29.7 t60 -47.91 -50.49 26.64 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 122.33 -0.231 . . . . 55.56 110.577 172.165 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 18.9 mt -66.1 -30.23 70.69 Favored 'General case' 0 N--CA 1.439 -1.008 0 N-CA-C 114.649 1.351 . . . . 51.13 114.649 -178.977 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -75.79 -39.26 57.28 Favored 'General case' 0 C--O 1.217 -0.649 0 CA-C-O 120.467 0.175 . . . . 49.94 110.602 -178.288 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 12.8 t -63.64 -42.76 97.17 Favored 'Isoleucine or valine' 0 C--O 1.241 0.614 0 CA-C-O 121.222 0.534 . . . . 50.7 109.648 172.452 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -58.35 -55.11 39.22 Favored 'General case' 0 N--CA 1.439 -1.022 0 CA-C-N 115.574 -0.739 . . . . 52.81 109.017 178.387 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 86.0 m -49.98 -42.93 49.95 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 123.176 0.59 . . . . 53.01 112.582 176.643 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' LEU . . . . . 0.864 HD11 ' HA3' ' A' ' 111' ' ' GLY . 26.0 tp -65.55 -39.78 92.11 Favored 'General case' 0 C--O 1.21 -1.026 0 N-CA-C 109.69 -0.485 . . . . 55.96 109.69 -178.166 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 101' ' ' LYS . . . . . 0.526 ' O ' ' HG2' ' A' ' 105' ' ' GLU . 18.2 mtpp -68.51 -48.92 63.14 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 112.073 0.397 . . . . 72.07 112.073 -178.997 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 102' ' ' ALA . . . . . 1.171 ' HA ' ' OE2' ' A' ' 105' ' ' GLU . . . -57.11 -31.75 65.61 Favored 'General case' 0 C--O 1.209 -1.076 0 CA-C-O 121.697 0.761 . . . . 64.43 109.248 178.5 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 103' ' ' ILE . . . . . 0.492 ' O ' ' N ' ' A' ' 107' ' ' LYS . 7.0 mt -59.91 -59.29 4.23 Favored 'Isoleucine or valine' 0 C--O 1.26 1.607 0 C-N-CA 116.22 -2.192 . . . . 71.92 110.892 179.549 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 104' ' ' TYR . . . . . 1.258 ' O ' ' CD2' ' A' ' 104' ' ' TYR . 0.0 OUTLIER -78.58 -0.42 29.69 Favored 'General case' 0 CA--C 1.514 -0.442 0 CA-C-N 115.004 -0.998 . . . . 94.26 113.17 -170.423 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 105' ' ' GLU . . . . . 1.171 ' OE2' ' HA ' ' A' ' 102' ' ' ALA . 16.6 pt-20 -96.52 -28.39 14.42 Favored 'General case' 0 C--O 1.211 -0.928 0 N-CA-C 107.674 -1.232 . . . . 96.33 107.674 175.876 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 106' ' ' LYS . . . . . 0.788 ' O ' ' HD2' ' A' ' 107' ' ' LYS . 37.7 mttt -118.64 0.06 11.43 Favored 'General case' 0 C--O 1.246 0.902 0 CA-C-O 121.011 0.434 . . . . 86.83 110.308 -177.067 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 107' ' ' LYS . . . . . 0.788 ' HD2' ' O ' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -140.13 6.38 2.16 Favored 'General case' 0 C--O 1.242 0.706 0 N-CA-C 117.752 2.501 . . . . 78.29 117.752 175.963 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . 41.17 26.53 0.18 Allowed Glycine 0 N--CA 1.48 1.582 0 C-N-CA 127.561 2.505 . . . . 76.75 117.79 -174.057 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' ILE . . . . . 0.691 ' O ' ' HB2' ' A' ' 104' ' ' TYR . 40.8 mt -101.39 133.48 44.61 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.821 0 CA-C-O 121.622 0.725 . . . . 75.66 111.502 -177.942 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 4.8 mtt180 -94.69 119.72 33.78 Favored 'General case' 0 C--N 1.308 -1.225 0 C-N-CA 117.638 -1.625 . . . . 99.34 110.936 -170.042 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' GLY . . . . . 0.864 ' HA3' HD11 ' A' ' 100' ' ' LEU . . . -85.14 -150.65 13.13 Favored Glycine 0 N--CA 1.417 -2.626 0 C-N-CA 117.0 -2.524 . . . . 72.69 113.637 178.18 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 112' ' ' TYR . . . . . 0.63 ' HD2' ' HG ' ' A' ' 142' ' ' SER . 9.9 m-85 -157.9 143.97 17.39 Favored 'General case' 0 N--CA 1.437 -1.091 0 N-CA-C 108.32 -0.992 . . . . 80.01 108.32 170.725 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 58.6 t80 -122.12 121.54 37.16 Favored 'General case' 0 N--CA 1.426 -1.628 0 C-N-CA 118.277 -1.369 . . . . 59.73 111.13 -178.268 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 91.2 m-85 -129.32 144.6 51.3 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 114.066 1.136 . . . . 55.35 114.066 177.484 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -78.8 122.72 26.4 Favored 'General case' 0 CA--C 1.495 -1.169 0 N-CA-C 104.562 -2.384 . . . . 54.11 104.562 162.076 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' THR . . . . . 0.673 HG22 HD12 ' A' ' 120' ' ' ILE . 86.1 m -49.46 -44.28 45.68 Favored 'General case' 0 N--CA 1.432 -1.355 0 CA-C-N 115.183 -0.917 . . . . 59.55 111.985 -172.026 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 12.3 tttt -68.08 -34.8 77.09 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.536 0.684 . . . . 78.63 111.645 -178.168 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 55.0 t0 -67.37 -47.38 70.56 Favored 'General case' 0 N--CA 1.435 -1.207 0 CA-C-N 115.461 -0.79 . . . . 71.08 109.286 -179.126 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 62.3 tp -55.47 -55.87 26.82 Favored 'General case' 0 C--O 1.217 -0.606 0 CA-C-N 116.164 -0.471 . . . . 64.85 111.555 174.954 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' ILE . . . . . 0.788 HG23 HD12 ' A' ' 162' ' ' LEU . 3.8 mt -56.2 -56.82 11.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 121.999 0.904 . . . . 71.3 110.56 -178.617 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 10.4 m-85 -49.76 -44.89 48.96 Favored 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 118.883 -1.127 . . . . 79.77 113.814 174.741 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' ARG . . . . . 0.554 ' HB3' ' O ' ' A' ' 228' ' ' HOH . 12.4 mtt180 -58.69 -51.14 71.19 Favored 'General case' 0 CA--C 1.509 -0.627 0 O-C-N 121.146 -0.971 . . . . 86.38 110.275 178.762 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 123' ' ' LEU . . . . . 0.699 ' O ' ' HB2' ' A' ' 127' ' ' MSE . 98.3 mt -63.37 -44.58 94.35 Favored 'General case' 0 CA--C 1.5 -0.969 0 CA-C-N 115.163 -0.926 . . . . 78.24 111.707 -172.328 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 124' ' ' LYS . . . . . 0.991 ' HD2' ' CE3' ' A' ' 158' ' ' TRP . 23.3 tttt -58.86 -35.63 73.28 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 118.871 -1.131 . . . . 90.8 108.595 -178.858 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 125' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -77.79 -31.62 51.94 Favored 'General case' 0 N--CA 1.442 -0.857 0 N-CA-C 115.952 1.834 . . . . 91.32 115.952 -177.462 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' LEU . . . . . 1.344 ' CD1' ' OD2' ' A' ' 132' ' ' ASP . 0.6 OUTLIER -87.77 -6.06 58.35 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 118.002 -1.479 . . . . 91.46 111.082 172.042 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 127' ' ' MSE . . . . . 0.989 ' HE1' HD21 ' A' ' 162' ' ' LEU . 2.5 ttp -91.75 -32.12 15.52 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 115.006 -0.997 . . . . 94.0 110.85 178.025 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . 0.485 1.8 p30 -93.8 -16.02 24.55 Favored 'General case' 0 C--N 1.314 -0.963 0 C-N-CA 114.424 -2.91 . . . . 98.68 117.906 164.761 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 17.3 tp10 -66.39 -39.61 89.17 Favored 'General case' 0 C--O 1.207 -1.135 0 N-CA-C 104.51 -2.404 . . . . 106.42 104.51 160.358 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 93.48 16.4 46.42 Favored Glycine 0 C--O 1.22 -0.781 0 C-N-CA 116.929 -2.558 . . . . 98.6 115.697 160.948 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' LYS . . . . . 0.725 ' HE3' ' O ' ' A' ' 41' ' ' HOH . 68.5 mttt -105.59 -56.18 2.22 Favored 'General case' 0 C--N 1.309 -1.177 0 C-N-CA 117.55 -1.66 . . . . 104.31 111.971 -169.454 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 132' ' ' ASP . . . . . 1.344 ' OD2' ' CD1' ' A' ' 126' ' ' LEU 0.647 7.8 t0 -66.84 103.33 1.1 Allowed 'General case' 0 CA--C 1.469 -2.156 0 N-CA-C 119.63 3.196 . . . . 106.17 119.63 175.418 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -100.01 -4.21 30.48 Favored 'General case' 0 C--O 1.253 1.278 0 N-CA-C 104.463 -2.421 . . . . 96.65 104.463 172.118 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 134' ' ' LYS . . . . . 1.14 ' HE2' ' O ' ' A' ' 226' ' ' HOH . 7.3 mttt -77.94 -34.97 50.94 Favored 'General case' 0 C--O 1.246 0.898 0 CA-C-N 112.867 -1.969 . . . . 102.95 113.638 -171.186 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 135' ' ' PHE . . . . . 0.503 ' HB3' HD11 ' A' ' 126' ' ' LEU . 71.0 t80 -69.68 -47.12 64.35 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.831 -0.622 . . . . 83.64 110.493 175.169 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 48.1 tp -55.69 -42.91 75.86 Favored 'General case' 0 C--O 1.224 -0.283 0 N-CA-C 113.54 0.941 . . . . 77.59 113.54 176.071 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 35.5 mttt -69.59 -40.57 76.6 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 113.343 0.868 . . . . 82.71 113.343 -177.822 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 19.9 p -72.06 -27.78 62.91 Favored 'General case' 0 C--O 1.241 0.635 0 C-N-CA 120.886 -0.326 . . . . 76.31 111.244 -179.593 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 139' ' ' VAL . . . . . . . . . . . . . 35.9 t -73.11 -45.58 53.59 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.481 0 CA-C-O 121.066 0.46 . . . . 69.79 111.614 173.963 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 140' ' ' LEU . . . . . 0.951 ' HB3' ' CE2' ' A' ' 169' ' ' TYR . 42.6 mt -67.99 -29.75 68.84 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 114.17 1.174 . . . . 65.76 114.17 178.794 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -100.18 5.56 44.76 Favored 'General case' 0 CA--C 1.477 -1.837 0 N-CA-C 113.631 0.975 . . . . 68.28 113.631 -172.874 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 142' ' ' SER . . . . . 0.63 ' HG ' ' HD2' ' A' ' 112' ' ' TYR . 0.1 OUTLIER -62.75 132.41 94.69 Favored Pre-proline 0 N--CA 1.413 -2.275 0 CA-C-N 113.953 -1.476 . . . . 64.88 111.279 179.741 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -62.76 -31.75 78.39 Favored 'Trans proline' 0 C--O 1.235 0.35 0 C-N-CA 124.787 3.658 . . . . 60.74 114.541 173.497 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 2.6 t -139.57 135.37 39.79 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.288 0 N-CA-C 107.926 -1.138 . . . . 58.78 107.926 171.494 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 29.4 tp -138.3 127.67 24.59 Favored 'General case' 0 CA--C 1.503 -0.831 0 N-CA-C 109.409 -0.589 . . . . 55.61 109.409 -178.887 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 89.3 t -101.4 110.43 28.24 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.454 0 CA-C-O 121.537 0.684 . . . . 52.7 110.605 175.84 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 55.0 mt -96.5 93.5 6.83 Favored 'General case' 0 N--CA 1.424 -1.758 0 N-CA-C 107.843 -1.169 . . . . 53.98 107.843 173.597 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 148' ' ' ASP . . . . . 0.561 ' O ' ' HB2' ' A' ' 149' ' ' ASP . 10.5 t70 -77.92 129.52 35.45 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.104 -0.639 . . . . 59.67 111.874 -175.9 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 149' ' ' ASP . . . . . 0.561 ' HB2' ' O ' ' A' ' 148' ' ' ASP . 0.2 OUTLIER 65.79 40.2 4.39 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 117.271 -1.771 . . . . 65.81 114.552 -177.331 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 150' ' ' LEU . . . . . 0.451 HD11 HG23 ' A' ' 163' ' ' ILE . 25.1 tp -66.81 76.84 0.12 Allowed 'General case' 0 N--CA 1.435 -1.223 0 N-CA-C 108.836 -0.802 . . . . 68.84 108.836 -179.177 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 111.65 -2.5 27.62 Favored Glycine 0 C--O 1.21 -1.396 0 C-N-CA 116.344 -2.836 . . . . 74.61 117.723 159.35 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 152' ' ' SER . . . . . 0.74 ' HA ' ' O ' ' A' ' 21' ' ' HOH . 0.4 OUTLIER -44.07 139.2 2.58 Favored 'General case' 0 CA--C 1.564 1.482 0 CA-C-N 118.595 1.198 . . . . 78.91 109.616 157.231 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 153' ' ' GLU . . . . . 0.795 ' HG2' ' O ' ' A' ' 40' ' ' HOH . 0.0 OUTLIER 73.99 170.64 0.3 Allowed 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 108.582 -0.896 . . . . 88.0 108.582 -175.505 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 17.8 mtt180 -101.41 139.38 37.15 Favored 'General case' 0 C--O 1.244 0.765 0 N-CA-C 113.34 0.867 . . . . 97.8 113.34 -174.174 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 155' ' ' LEU . . . . . 1.079 ' HB2' ' HE ' ' A' ' 160' ' ' ARG . 60.5 mt -109.35 115.86 30.76 Favored 'General case' 0 CA--C 1.503 -0.845 0 C-N-CA 126.875 2.07 . . . . 78.7 111.391 -169.686 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 156' ' ' SER . . . . . 0.692 ' O ' ' N ' ' A' ' 158' ' ' TRP . 99.7 p -58.69 119.87 7.9 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 115.45 1.648 . . . . 77.24 115.45 174.76 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 157' ' ' ASP . . . . . 0.72 ' O ' ' HG3' ' A' ' 161' ' ' GLU . 0.7 OUTLIER 5.26 -52.42 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 119.376 3.102 . . . . 83.65 119.376 169.517 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 158' ' ' TRP . . . . . 0.991 ' CE3' ' HD2' ' A' ' 124' ' ' LYS 0.282 40.7 p-90 -73.93 -43.97 56.55 Favored 'General case' 0 N--CA 1.507 2.408 0 N-CA-C 113.786 1.032 . . . . 85.16 113.786 -178.714 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 6.0 mt-30 -63.57 -43.92 95.59 Favored 'General case' 0 C--O 1.221 -0.424 0 O-C-N 121.259 -0.901 . . . . 77.73 112.998 169.864 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 160' ' ' ARG . . . . . 1.079 ' HE ' ' HB2' ' A' ' 155' ' ' LEU . 29.0 mmt85 -45.58 -51.05 12.54 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 118.979 -0.534 . . . . 100.32 112.384 168.985 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 161' ' ' GLU . . . . . 0.72 ' HG3' ' O ' ' A' ' 157' ' ' ASP . 94.1 mt-10 -55.94 -49.71 72.74 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 115.148 1.536 . . . . 88.98 115.148 179.005 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 162' ' ' LEU . . . . . 0.989 HD21 ' HE1' ' A' ' 127' ' ' MSE . 74.0 mt -57.84 -43.88 86.13 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 126.497 1.919 . . . . 70.81 115.112 174.519 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 163' ' ' ILE . . . . . 0.568 HD12 HD13 ' A' ' 155' ' ' LEU . 96.9 mt -62.88 -54.16 37.31 Favored 'Isoleucine or valine' 0 C--N 1.35 0.624 0 O-C-N 124.215 0.947 . . . . 62.54 111.04 175.916 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 6.7 t -52.54 -43.95 65.49 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.475 0.655 . . . . 58.89 112.03 177.221 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 24.1 t80 -57.21 -52.51 65.01 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 113.043 0.757 . . . . 60.85 113.043 174.053 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 166' ' ' ILE . . . . . . . . . . . . . 40.0 mt -69.85 -34.88 62.37 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.815 0 N-CA-C 108.888 -0.782 . . . . 53.98 108.888 -171.268 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 167' ' ' ILE . . . . . 0.609 HG23 ' HE1' ' A' ' 214' ' ' MSE . 9.2 mt -79.74 -38.82 19.53 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.822 0 CA-C-N 116.183 -0.462 . . . . 54.77 111.273 -179.193 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 91.8 m -58.07 -42.29 85.2 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 119.531 -0.867 . . . . 54.31 109.833 173.557 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 169' ' ' TYR . . . . . 1.432 ' CE1' ' ND2' ' A' ' 173' ' ' ASN . 12.3 t80 -63.53 -47.87 79.86 Favored 'General case' 0 N--CA 1.439 -1.014 0 N-CA-C 114.598 1.333 . . . . 70.83 114.598 -178.252 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 170' ' ' ARG . . . . . 0.883 ' HB3' ' O ' ' A' ' 223' ' ' HOH . 72.3 mtp85 -73.19 -26.22 61.08 Favored 'General case' 0 CA--C 1.483 -1.617 0 CA-C-N 115.973 -0.558 . . . . 52.8 111.128 -177.161 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 171' ' ' TYR . . . . . . . . . . . . . 56.2 t80 -69.06 -50.54 47.54 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 115.774 -0.648 . . . . 54.08 109.644 170.52 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 172' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -63.18 -35.17 79.41 Favored 'General case' 0 C--O 1.254 1.302 0 N-CA-C 113.917 1.08 . . . . 53.25 113.917 -179.236 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 173' ' ' ASN . . . . . 1.432 ' ND2' ' CE1' ' A' ' 169' ' ' TYR . 74.4 m-20 -103.41 21.6 15.7 Favored 'General case' 0 C--O 1.209 -1.064 0 C-N-CA 119.804 -0.758 . . . . 60.69 112.447 -169.992 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 63.9 mt 44.27 55.54 5.47 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.982 0.913 . . . . 52.57 112.364 -178.797 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 2.6 mmtt -106.06 122.0 45.27 Favored 'General case' 0 N--CA 1.434 -1.231 0 CA-C-N 115.851 -0.613 . . . . 67.01 109.391 178.231 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 176' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.43 124.84 25.5 Favored 'General case' 0 CA--C 1.5 -0.945 0 CA-C-N 114.961 -1.018 . . . . 59.2 110.918 -173.476 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 177' ' ' THR . . . . . 0.78 ' HB ' ' O ' ' A' ' 223' ' ' HOH . 9.9 t -131.53 126.84 35.93 Favored 'General case' 0 C--O 1.253 1.28 0 CA-C-N 114.345 -1.298 . . . . 58.64 109.164 -171.232 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 80.8 mt -106.14 132.41 53.33 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 C-N-CA 123.766 0.826 . . . . 55.85 109.72 -178.126 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 24.2 mt -129.11 141.42 46.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 N-CA-C 112.384 0.513 . . . . 55.17 112.384 -170.954 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 180' ' ' THR . . . . . 0.552 HG22 ' HB2' ' A' ' 84' ' ' PHE . 62.1 p -126.12 135.56 51.84 Favored 'General case' 0 CA--C 1.488 -1.408 0 N-CA-C 107.903 -1.147 . . . . 59.93 107.903 169.353 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -142.81 155.27 44.78 Favored 'General case' 0 N--CA 1.427 -1.606 0 CA-C-N 115.129 -0.941 . . . . 68.18 109.378 -177.727 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 182' ' ' ASN . . . . . 0.458 ' HB3' ' HB3' ' A' ' 152' ' ' SER . 19.2 t-20 -92.39 134.78 34.61 Favored 'General case' 0 C--N 1.314 -0.967 0 N-CA-C 114.089 1.144 . . . . 80.74 114.089 179.604 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 183' ' ' TYR . . . . . 0.592 ' CZ ' HG12 ' A' ' 195' ' ' ILE . 60.8 t80 -137.88 140.24 40.3 Favored 'General case' 0 N--CA 1.494 1.757 0 C-N-CA 127.732 2.413 . . . . 95.5 107.212 173.55 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 184' ' ' SER . . . . . 0.424 ' CB ' ' O ' ' A' ' 38' ' ' HOH . 81.8 p -132.61 -38.56 1.02 Allowed 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 118.481 2.771 . . . . 96.66 118.481 -164.074 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 185' ' ' LEU . . . . . . . . . . . . . 76.8 mt -90.16 130.89 36.26 Favored 'General case' 0 N--CA 1.515 2.782 0 C-N-CA 124.007 0.923 . . . . 102.91 112.3 177.024 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 186' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -103.77 -31.76 9.67 Favored 'General case' 0 N--CA 1.501 2.1 1 N-CA-C 128.887 6.625 . . . . 110.19 128.887 -126.271 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.473 0.713 0 C-N-CA 114.358 -2.937 . . . . 109.02 116.046 -163.579 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 191' ' ' SER . . . . . 0.996 ' O ' HG13 ' A' ' 195' ' ' ILE . 0.1 OUTLIER . . . . . 0 CA--C 1.507 -0.675 0 N-CA-C 112.802 0.667 . . . . 111.26 112.802 . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 192' ' ' SER . . . . . 0.727 ' O ' ' O ' ' A' ' 17' ' ' HOH . 6.0 m -34.99 -61.41 0.42 Allowed 'General case' 0 CA--C 1.491 -1.316 0 CA-C-O 122.794 1.283 . . . . 110.5 109.937 -176.507 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 193' ' ' VAL . . . . . 0.615 ' O ' ' HB2' ' A' ' 196' ' ' SER 0.481 85.8 t -108.84 -3.59 10.38 Favored 'Isoleucine or valine' 0 N--CA 1.386 -3.654 1 C-N-CA 103.873 -7.131 . . . . 107.79 110.893 -156.085 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 194' ' ' ARG . . . . . 0.71 ' HG2' ' O ' ' A' ' 28' ' ' HOH . 38.8 ttm180 -72.71 -46.46 53.54 Favored 'General case' 0 C--O 1.252 1.223 0 N-CA-C 103.793 -2.669 . . . . 109.49 103.793 170.09 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 195' ' ' ILE . . . . . 0.996 HG13 ' O ' ' A' ' 191' ' ' SER . 21.1 mt -53.76 -26.22 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.864 0 N-CA-C 105.65 -1.981 . . . . 97.23 105.65 178.321 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 196' ' ' SER . . . . . 0.615 ' HB2' ' O ' ' A' ' 193' ' ' VAL . 66.6 m -70.57 -47.05 62.17 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 120.01 -0.676 . . . . 90.96 111.629 178.782 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -81.88 -27.97 33.18 Favored 'General case' 0 CA--C 1.503 -0.828 0 N-CA-C 107.528 -1.286 . . . . 85.35 107.528 -169.212 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 198' ' ' ASP . . . . . 0.825 ' HB2' ' O ' ' A' ' 28' ' ' HOH . 24.3 t0 -66.46 -47.14 74.04 Favored 'General case' 0 N--CA 1.434 -1.243 0 CA-C-N 114.773 -1.103 . . . . 78.9 109.697 178.302 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 199' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -62.68 -41.45 99.1 Favored 'General case' 0 C--O 1.255 1.387 0 CA-C-O 121.205 0.526 . . . . 74.23 111.298 173.894 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 200' ' ' ALA . . . . . . . . . . . . . . . -58.92 -34.61 71.9 Favored 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 115.276 -0.875 . . . . 69.47 112.523 178.356 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 201' ' ' SER . . . . . . . . . . . . . 50.5 p -62.45 -22.9 66.57 Favored 'General case' 0 CA--C 1.556 1.174 0 N-CA-C 118.745 2.868 . . . . 66.85 118.745 -177.765 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 202' ' ' ARG . . . . . 0.784 ' O ' ' CZ ' ' A' ' 160' ' ' ARG . 8.5 ptt-85 -125.4 -8.89 6.92 Favored 'General case' 0 C--O 1.253 1.242 0 CA-C-N 119.245 0.929 . . . . 68.53 109.382 179.821 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 12.0 mt -101.82 -29.96 11.56 Favored 'General case' 0 C--O 1.215 -0.722 0 N-CA-C 115.428 1.64 . . . . 63.47 115.428 171.434 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 204' ' ' GLY . . . . . . . . . . . . . . . 101.31 143.79 14.33 Favored Glycine 0 CA--C 1.523 0.538 0 CA-C-N 116.501 -0.318 . . . . 63.82 112.395 -170.654 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 74.5 mm-40 -50.41 -42.69 54.17 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 121.401 0.619 . . . . 87.21 112.3 174.646 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 51.8 t30 -63.5 -50.5 69.38 Favored 'General case' 0 CA--C 1.505 -0.772 0 CA-C-N 115.6 -0.727 . . . . 65.19 112.178 -169.634 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 207' ' ' VAL . . . . . . . . . . . . . 65.2 t -64.52 -40.9 90.67 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 O-C-N 123.787 0.679 . . . . 58.27 111.152 -178.423 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 208' ' ' VAL . . . . . . . . . . . . . 25.2 t -67.07 -43.79 88.59 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 CA-C-N 116.225 -0.443 . . . . 52.81 112.118 -178.108 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 5.5 t -55.98 -46.23 78.71 Favored 'General case' 0 CA--C 1.494 -1.209 0 CA-C-O 121.502 0.668 . . . . 51.33 111.0 175.61 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 210' ' ' LYS . . . . . 0.743 ' O ' ' HG2' ' A' ' 214' ' ' MSE . 68.5 mttt -63.62 -47.44 81.37 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-N 115.787 -0.642 . . . . 56.26 111.47 175.68 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 211' ' ' ILE . . . . . 0.557 ' HA ' ' HE3' ' A' ' 214' ' ' MSE . 17.9 mt -51.47 -31.32 12.01 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.946 0 C-N-CA 118.958 -1.097 . . . . 57.16 110.789 -179.605 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 3.0 m-30 -78.46 -27.4 46.35 Favored 'General case' 0 CA--C 1.466 -2.253 0 N-CA-C 113.003 0.742 . . . . 74.39 113.003 -175.955 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 213' ' ' GLU . . . . . 0.752 ' O ' ' HG3' ' A' ' 213' ' ' GLU . 0.1 OUTLIER -88.16 -0.7 57.4 Favored 'General case' 0 N--CA 1.407 -2.589 0 C-N-CA 115.121 -2.632 . . . . 68.76 106.695 -174.973 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 214' ' ' MSE . . . . . 0.743 ' HG2' ' O ' ' A' ' 210' ' ' LYS . 0.8 OUTLIER -109.46 -29.12 8.57 Favored 'General case' 0 C--N 1.313 -0.998 0 C-N-CA 116.812 -1.955 . . . . 59.91 112.71 179.803 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 215' ' ' ASN . . . . . . . . . . . . . 37.5 m-20 -121.04 149.61 42.44 Favored 'General case' 0 N--CA 1.433 -1.279 0 CA-C-N 115.562 -0.745 . . . . 58.81 112.909 -167.53 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 216' ' ' GLU . . . . . . . . . . . . . 49.2 tt0 -90.65 139.93 30.25 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 115.87 -0.605 . . . . 67.71 110.685 168.968 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 217' ' ' LEU . . . . . 0.487 HD11 HG21 ' A' ' 85' ' ' VAL . 27.9 tp -89.31 124.38 34.36 Favored 'General case' 0 N--CA 1.44 -0.927 0 N-CA-C 112.098 0.407 . . . . 58.1 112.098 -171.586 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 218' ' ' LEU . . . . . 0.477 HD21 HG21 ' A' ' 66' ' ' THR . 68.4 mt -121.06 102.72 8.51 Favored 'General case' 0 C--O 1.202 -1.415 0 N-CA-C 111.787 0.292 . . . . 53.7 111.787 177.012 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 219' ' ' VAL . . . . . . . . . . . . 0.326 54.0 t -86.81 116.34 29.19 Favored 'Isoleucine or valine' 0 CA--C 1.47 -2.099 0 CA-C-O 117.263 -1.351 . . . . 55.91 109.89 177.785 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 220' ' ' ILE . . . . . 0.734 HG22 ' CG1' ' A' ' 90' ' ' VAL . 20.8 mt -106.47 127.24 61.99 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.689 0 C-N-CA 125.201 1.4 . . . . 62.16 111.18 -177.174 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 221' ' ' LYS . . . . . 0.926 ' HD3' ' O ' ' A' ' 22' ' ' HOH . 10.2 mtmt . . . . . 0 CA--C 1.504 -0.818 0 C-N-CA 120.85 -0.34 . . . . 64.41 111.837 -172.461 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 222' ' ' ADP . . . . . 0.46 ' N6 ' ' CE1' ' A' ' 53' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 300' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 3' ' ' HOH . . . . . 0.447 ' O ' ' HE3' ' A' ' 127' ' ' MSE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 5' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 6' ' ' HOH . . . . . 0.518 ' O ' ' HA ' ' A' ' 74' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 8' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 9' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 10' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 11' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 12' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 13' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 14' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 15' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 16' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 17' ' ' HOH . . . . . 0.727 ' O ' ' O ' ' A' ' 192' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' HOH . . . . . 0.619 ' O ' ' CB ' ' A' ' 191' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' HOH . . . . . 0.584 ' O ' HG22 ' A' ' 177' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 21' ' ' HOH . . . . . 0.74 ' O ' ' HA ' ' A' ' 152' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' HOH . . . . . 0.926 ' O ' ' HD3' ' A' ' 221' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' HOH . . . . . 0.473 ' O ' ' HB2' ' A' ' 51' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' HOH . . . . . 0.725 ' O ' ' CA ' ' A' ' 43' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 26' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 27' ' ' HOH . . . . . 0.753 ' O ' ' HG2' ' A' ' 62' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' HOH . . . . . 0.825 ' O ' ' HB2' ' A' ' 198' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 30' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 31' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 32' ' ' HOH . . . . . 0.871 ' O ' ' HA ' ' A' ' 134' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' HOH . . . . . 0.562 ' O ' ' HB3' ' A' ' 87' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 35' ' ' HOH . . . . . 0.429 ' O ' ' HD2' ' A' ' 134' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 37' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 38' ' ' HOH . . . . . 0.424 ' O ' ' CB ' ' A' ' 184' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' HOH . . . . . 0.608 ' O ' ' HD1' ' A' ' 53' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' HOH . . . . . 0.795 ' O ' ' HG2' ' A' ' 153' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' HOH . . . . . 0.725 ' O ' ' HE3' ' A' ' 131' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 223' ' ' HOH . . . . . 0.883 ' O ' ' HB3' ' A' ' 170' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 225' ' ' HOH . . . . . 0.625 ' O ' ' HG3' ' A' ' 153' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 226' ' ' HOH . . . . . 1.14 ' O ' ' HE2' ' A' ' 134' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 228' ' ' HOH . . . . . 0.685 ' O ' HD23 ' A' ' 126' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 229' ' ' HOH . . . . . 0.661 ' O ' ' HA3' ' A' ' 91' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.569 ' O ' ' HG2' ' A' ' 43' ' ' LYS . . . . . . . . 0 N--CA 1.492 1.63 0 N-CA-C 114.39 1.256 . . . . 68.739999999999995 114.39 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.725 ' CA ' ' O ' ' A' ' 24' ' ' HOH 0.343 18.1 mtmt -144.2 55.93 1.3 Allowed 'General case' 0 CA--C 1.483 -1.596 0 N-CA-C 120.667 3.58 . . . . 68.040000000000006 120.667 -161.927 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.4 ttm105 -92.75 -10.68 36.14 Favored 'General case' 0 N--CA 1.402 -2.847 0 N-CA-C 102.49 -3.152 . . . . 63.530000000000001 102.49 153.393 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 91.7 m-85 -110.34 18.64 19.65 Favored 'General case' 0 C--O 1.218 -0.567 0 CA-C-N 114.887 -1.051 . . . . 56.780000000000001 111.588 -177.294 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' TRP . . . . . 0.741 ' CG ' ' N ' ' A' ' 47' ' ' ASN . 39.3 p-90 -46.22 -57.37 4.61 Favored 'General case' 0 C--O 1.199 -1.596 0 N-CA-C 108.397 -0.964 . . . . 57.159999999999997 108.397 176.183 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.741 ' N ' ' CG ' ' A' ' 46' ' ' TRP . 9.6 p-10 -59.07 -19.81 47.61 Favored 'General case' 0 CA--C 1.584 2.265 0 N-CA-C 119.508 3.151 . . . . 65.200000000000003 119.508 172.309 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -53.2 107.84 0.27 Allowed 'General case' 0 N--CA 1.485 1.323 0 O-C-N 120.628 -1.295 . . . . 66.719999999999999 114.246 -177.833 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.748 ' C ' ' H ' ' A' ' 51' ' ' ASP . 30.9 m-80 -139.46 138.88 36.81 Favored 'General case' 0 CA--C 1.501 -0.927 0 O-C-N 121.517 -0.74 . . . . 75.469999999999999 111.718 -179.723 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.468 HD21 HG21 ' A' ' 67' ' ' ILE . 6.8 mt -46.84 -9.92 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 107.583 -1.266 . . . . 77.439999999999998 107.583 173.411 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.906 ' C ' ' H ' ' A' ' 53' ' ' TYR . 0.4 OUTLIER -105.3 -40.0 5.98 Favored 'General case' 0 C--O 1.217 -0.633 0 N-CA-C 120.043 3.349 . . . . 88.840000000000003 120.043 -168.589 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' THR . . . . . 1.066 ' O ' HG22 ' A' ' 52' ' ' THR 0.438 15.4 m -51.03 0.34 0.01 OUTLIER 'General case' 0 CA--C 1.471 -2.082 0 N-CA-C 104.707 -2.331 . . . . 78.730000000000004 104.707 163.201 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.906 ' H ' ' C ' ' A' ' 51' ' ' ASP 0.47 9.2 t80 -82.28 112.8 19.61 Favored 'General case' 1 CA--C 1.407 -4.524 1 C-N-CA 108.531 -5.268 . . . . 76.189999999999998 115.476 -156.076 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 48.8 m80 -119.95 106.77 40.88 Favored Pre-proline 0 N--CA 1.413 -2.312 0 C-N-CA 114.243 -2.983 . . . . 84.879999999999995 114.233 175.022 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -71.3 148.37 55.11 Favored 'Trans proline' 0 N--CA 1.45 -1.044 0 C-N-CA 123.355 2.703 . . . . 70.959999999999994 110.986 -174.352 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 2.8 mttm -123.12 -2.93 8.57 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 112.688 0.625 . . . . 87.450000000000003 112.688 -168.934 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 21.4 p-10 -153.33 176.44 11.98 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 107.984 -1.117 . . . . 76.260000000000005 107.984 172.951 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 8.1 t -64.68 -33.91 66.42 Favored 'Isoleucine or valine' 0 C--O 1.237 0.433 0 C-N-CA 119.834 -0.747 . . . . 68.430000000000007 111.319 -178.959 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 5.9 m -52.29 -51.19 59.94 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 125.727 1.611 . . . . 68.739999999999995 109.756 174.848 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 57.8 mt-30 -73.38 -27.8 61.67 Favored 'General case' 0 N--CA 1.42 -1.935 0 C-N-CA 118.484 -1.286 . . . . 67.980000000000004 112.911 -175.033 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 20.0 t30 -72.39 -45.0 61.7 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-O 121.779 0.8 . . . . 61.359999999999999 110.83 -178.263 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.753 ' HG2' ' O ' ' A' ' 27' ' ' HOH . 11.0 mtm105 -60.9 -47.24 87.3 Favored 'General case' 0 N--CA 1.439 -1.004 0 CA-C-N 114.268 -1.333 . . . . 79.430000000000007 111.669 176.296 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -51.09 -43.12 61.02 Favored 'General case' 0 C--O 1.202 -1.415 0 N-CA-C 112.931 0.715 . . . . 54.880000000000003 112.931 171.219 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 38.0 tp -73.32 -34.13 65.52 Favored 'General case' 0 N--CA 1.482 1.14 0 CA-C-O 121.937 0.875 . . . . 52.579999999999998 111.264 -176.54 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 12.4 mt -64.83 -53.97 38.48 Favored 'General case' 0 C--O 1.247 0.958 0 CA-C-N 115.633 -0.712 . . . . 59.0 110.336 175.979 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' THR . . . . . 0.477 HG21 HD21 ' A' ' 218' ' ' LEU . 52.8 m -50.67 -50.15 55.45 Favored 'General case' 0 C--O 1.2 -1.524 0 CA-C-N 115.604 -0.726 . . . . 51.509999999999998 110.946 176.148 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.578 ' O ' HG23 ' A' ' 71' ' ' VAL . 60.4 mt -59.69 -44.2 93.1 Favored 'Isoleucine or valine' 0 C--O 1.246 0.916 0 O-C-N 122.025 -0.422 . . . . 52.829999999999998 110.028 -175.18 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ARG . . . . . 1.021 ' CG ' HH11 ' A' ' 68' ' ' ARG . 0.0 OUTLIER -57.75 -53.57 56.66 Favored 'General case' 0 C--O 1.26 1.637 0 O-C-N 124.211 0.945 . . . . 64.260000000000005 113.334 178.586 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 72.7 t -54.42 -46.84 70.58 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.813 0 CA-C-O 121.512 0.672 . . . . 56.950000000000003 110.97 173.603 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 74.8 t80 -57.55 -47.09 82.97 Favored 'General case' 0 CA--C 1.496 -1.109 0 C-N-CA 123.213 0.605 . . . . 58.990000000000002 111.181 -178.841 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.578 HG23 ' O ' ' A' ' 67' ' ' ILE . 57.8 t -69.2 -19.3 23.49 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.02 0 C-N-CA 120.1 -0.64 . . . . 62.759999999999998 112.46 -177.005 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 11.2 t-160 -90.64 -29.35 17.82 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 118.849 -1.14 . . . . 74.170000000000002 108.906 -166.99 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 79.6 m-20 -98.13 15.33 24.64 Favored 'General case' 0 C--O 1.222 -0.376 0 CA-C-N 112.953 -1.93 . . . . 67.049999999999997 110.904 175.841 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' PHE . . . . . 0.518 ' HA ' ' O ' ' A' ' 6' ' ' HOH . 66.1 t80 -67.41 137.22 55.76 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 118.924 -1.11 . . . . 63.359999999999999 113.786 -172.783 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ASN . . . . . 0.559 ' HB3' ' HG3' ' A' ' 78' ' ' GLU . 58.9 t-20 -145.29 98.73 4.62 Favored Pre-proline 0 CA--C 1.496 -1.13 0 N-CA-C 108.214 -1.032 . . . . 69.670000000000002 108.214 -175.767 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.433 ' C ' ' O ' ' A' ' 75' ' ' ASN . 2.1 Cg_endo -38.0 -36.78 0.51 Allowed 'Trans proline' 0 N--CA 1.439 -1.721 0 C-N-CA 123.706 2.938 . . . . 67.150000000000006 107.952 -178.991 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 78.4 mm-40 -65.35 -22.23 66.79 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 118.256 2.687 . . . . 78.200000000000003 118.256 -176.169 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.559 ' HG3' ' HB3' ' A' ' 75' ' ' ASN . 76.5 mt-10 -84.47 -12.61 53.98 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-O 121.154 0.502 . . . . 80.719999999999999 111.73 -173.397 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 52.67 37.09 50.31 Favored Glycine 0 N--CA 1.442 -0.906 0 C-N-CA 119.843 -1.17 . . . . 62.509999999999998 113.964 -173.894 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 7.2 mtmt -95.34 148.21 22.68 Favored 'General case' 0 C--O 1.242 0.702 0 C-N-CA 120.055 -0.658 . . . . 71.530000000000001 111.995 176.426 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -144.58 -172.09 14.91 Favored Glycine 0 C--O 1.247 0.927 0 C-N-CA 120.834 -0.698 . . . . 55.399999999999999 111.927 -179.26 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -132.14 151.3 51.86 Favored 'General case' 0 CA--C 1.48 -1.726 0 CA-C-O 121.558 0.694 . . . . 53.460000000000001 111.43 170.578 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 96.8 m -116.57 126.09 52.8 Favored 'General case' 0 N--CA 1.432 -1.327 0 N-CA-C 107.637 -1.246 . . . . 49.770000000000003 107.637 176.042 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' PHE . . . . . 0.552 ' HB2' HG22 ' A' ' 180' ' ' THR . 97.7 m-85 -108.64 121.23 44.59 Favored 'General case' 0 C--O 1.245 0.819 0 N-CA-C 107.63 -1.248 . . . . 52.229999999999997 107.63 177.243 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' VAL . . . . . 1.36 ' O ' ' CD ' ' A' ' 92' ' ' LYS . 6.4 t -103.78 -158.11 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 N-CA-C 106.418 -1.697 . . . . 56.390000000000001 106.418 -177.882 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' GLY . . . . . 0.795 ' H ' HG12 ' A' ' 85' ' ' VAL . . . 107.23 148.99 15.18 Favored Glycine 0 C--O 1.22 -0.757 0 N-CA-C 119.217 2.447 . . . . 54.130000000000003 119.217 176.516 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' SER . . . . . 0.742 ' HB3' ' CD ' ' A' ' 88' ' ' PRO . 14.0 m -58.99 176.02 0.3 Allowed Pre-proline 0 CA--C 1.489 -1.385 0 N-CA-C 104.593 -2.373 . . . . 59.549999999999997 104.593 172.29 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' PRO . . . . . 0.742 ' CD ' ' HB3' ' A' ' 87' ' ' SER . 18.9 Cg_endo -95.88 168.75 1.27 Allowed 'Trans proline' 0 C--O 1.248 0.992 1 C-N-CA 125.322 4.015 . . . . 61.780000000000001 113.464 -171.271 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 61.81 18.86 57.72 Favored Glycine 0 CA--C 1.524 0.597 0 N-CA-C 109.343 -1.503 . . . . 61.950000000000003 109.343 -173.771 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.734 ' CG1' HG22 ' A' ' 220' ' ' ILE . 55.1 t -98.2 -0.62 10.34 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.29 0 N-CA-C 113.546 0.943 . . . . 60.450000000000003 113.546 -174.644 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.661 ' HA3' ' O ' ' A' ' 229' ' ' HOH . . . 85.53 17.59 61.85 Favored Glycine 0 C--O 1.243 0.68 0 C-N-CA 118.107 -1.997 . . . . 55.960000000000001 114.026 178.433 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' LYS . . . . . 1.36 ' CD ' ' O ' ' A' ' 85' ' ' VAL . 8.8 mtmm -61.31 -53.04 61.83 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-N 116.692 0.246 . . . . 51.700000000000003 110.945 170.999 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 93.1 m -68.23 -42.2 80.08 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 109.98 -0.378 . . . . 50.340000000000003 109.98 -177.906 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' HIS . . . . . 0.438 ' HB2' " H2'" ' A' ' 222' ' ' ADP . 29.7 t60 -47.91 -50.49 26.64 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 122.33 -0.231 . . . . 55.560000000000002 110.577 172.165 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 18.9 mt -66.1 -30.23 70.69 Favored 'General case' 0 N--CA 1.439 -1.008 0 N-CA-C 114.649 1.351 . . . . 51.130000000000003 114.649 -178.977 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -75.79 -39.26 57.28 Favored 'General case' 0 C--O 1.217 -0.649 0 CA-C-O 120.467 0.175 . . . . 49.939999999999998 110.602 -178.288 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 12.8 t -63.64 -42.76 97.17 Favored 'Isoleucine or valine' 0 C--O 1.241 0.614 0 CA-C-O 121.222 0.534 . . . . 50.700000000000003 109.648 172.452 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -58.35 -55.11 39.22 Favored 'General case' 0 N--CA 1.439 -1.022 0 CA-C-N 115.574 -0.739 . . . . 52.810000000000002 109.017 178.387 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 86.0 m -49.98 -42.93 49.95 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 123.176 0.59 . . . . 53.009999999999998 112.582 176.643 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.864 HD11 ' HA3' ' A' ' 111' ' ' GLY . 26.0 tp -65.55 -39.78 92.11 Favored 'General case' 0 C--O 1.21 -1.026 0 N-CA-C 109.69 -0.485 . . . . 55.960000000000001 109.69 -178.166 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.526 ' O ' ' HG2' ' A' ' 105' ' ' GLU . 18.2 mtpp -68.51 -48.92 63.14 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 112.073 0.397 . . . . 72.069999999999993 112.073 -178.997 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' ALA . . . . . 1.171 ' HA ' ' OE2' ' A' ' 105' ' ' GLU . . . -57.11 -31.75 65.61 Favored 'General case' 0 C--O 1.209 -1.076 0 CA-C-O 121.697 0.761 . . . . 64.430000000000007 109.248 178.5 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.492 ' O ' ' N ' ' A' ' 107' ' ' LYS . 7.0 mt -59.91 -59.29 4.23 Favored 'Isoleucine or valine' 0 C--O 1.26 1.607 0 C-N-CA 116.22 -2.192 . . . . 71.920000000000002 110.892 179.549 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' TYR . . . . . 1.258 ' CD2' ' O ' ' A' ' 104' ' ' TYR . 0.0 OUTLIER -78.58 -0.42 29.69 Favored 'General case' 0 CA--C 1.514 -0.442 0 CA-C-N 115.004 -0.998 . . . . 94.260000000000005 113.17 -170.423 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' GLU . . . . . 1.171 ' OE2' ' HA ' ' A' ' 102' ' ' ALA . 16.6 pt-20 -96.52 -28.39 14.42 Favored 'General case' 0 C--O 1.211 -0.928 0 N-CA-C 107.674 -1.232 . . . . 96.329999999999998 107.674 175.876 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.788 ' O ' ' HD2' ' A' ' 107' ' ' LYS . 37.7 mttt -118.64 0.06 11.43 Favored 'General case' 0 C--O 1.246 0.902 0 CA-C-O 121.011 0.434 . . . . 86.829999999999998 110.308 -177.067 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.788 ' HD2' ' O ' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -140.13 6.38 2.16 Favored 'General case' 0 C--O 1.242 0.706 0 N-CA-C 117.752 2.501 . . . . 78.290000000000006 117.752 175.963 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . 41.17 26.53 0.18 Allowed Glycine 0 N--CA 1.48 1.582 0 C-N-CA 127.561 2.505 . . . . 76.75 117.79 -174.057 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' ILE . . . . . 0.691 ' O ' ' HB2' ' A' ' 104' ' ' TYR . 40.8 mt -101.39 133.48 44.61 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.821 0 CA-C-O 121.622 0.725 . . . . 75.659999999999997 111.502 -177.942 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 4.8 mtt180 -94.69 119.72 33.78 Favored 'General case' 0 C--N 1.308 -1.225 0 C-N-CA 117.638 -1.625 . . . . 99.340000000000003 110.936 -170.042 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' GLY . . . . . 0.864 ' HA3' HD11 ' A' ' 100' ' ' LEU . . . -85.14 -150.65 13.13 Favored Glycine 0 N--CA 1.417 -2.626 0 C-N-CA 117.0 -2.524 . . . . 72.689999999999998 113.637 178.18 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' TYR . . . . . 0.63 ' HD2' ' HG ' ' A' ' 142' ' ' SER . 9.9 m-85 -157.9 143.97 17.39 Favored 'General case' 0 N--CA 1.437 -1.091 0 N-CA-C 108.32 -0.992 . . . . 80.010000000000005 108.32 170.725 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' PHE . . . . . . . . . . . . . 58.6 t80 -122.12 121.54 37.16 Favored 'General case' 0 N--CA 1.426 -1.628 0 C-N-CA 118.277 -1.369 . . . . 59.729999999999997 111.13 -178.268 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 91.2 m-85 -129.32 144.6 51.3 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 114.066 1.136 . . . . 55.350000000000001 114.066 177.484 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -78.8 122.72 26.4 Favored 'General case' 0 CA--C 1.495 -1.169 0 N-CA-C 104.562 -2.384 . . . . 54.109999999999999 104.562 162.076 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' THR . . . . . 0.673 HG22 HD12 ' A' ' 120' ' ' ILE . 86.1 m -49.46 -44.28 45.68 Favored 'General case' 0 N--CA 1.432 -1.355 0 CA-C-N 115.183 -0.917 . . . . 59.549999999999997 111.985 -172.026 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 12.3 tttt -68.08 -34.8 77.09 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.536 0.684 . . . . 78.629999999999995 111.645 -178.168 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 55.0 t0 -67.37 -47.38 70.56 Favored 'General case' 0 N--CA 1.435 -1.207 0 CA-C-N 115.461 -0.79 . . . . 71.079999999999998 109.286 -179.126 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 62.3 tp -55.47 -55.87 26.82 Favored 'General case' 0 C--O 1.217 -0.606 0 CA-C-N 116.164 -0.471 . . . . 64.849999999999994 111.555 174.954 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.788 HG23 HD12 ' A' ' 162' ' ' LEU . 3.8 mt -56.2 -56.82 11.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 121.999 0.904 . . . . 71.299999999999997 110.56 -178.617 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 10.4 m-85 -49.76 -44.89 48.96 Favored 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 118.883 -1.127 . . . . 79.769999999999996 113.814 174.741 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' ARG . . . . . 0.554 ' HB3' ' O ' ' A' ' 228' ' ' HOH . 12.4 mtt180 -58.69 -51.14 71.19 Favored 'General case' 0 CA--C 1.509 -0.627 0 O-C-N 121.146 -0.971 . . . . 86.379999999999995 110.275 178.762 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.699 ' O ' ' HB2' ' A' ' 127' ' ' MSE . 98.3 mt -63.37 -44.58 94.35 Favored 'General case' 0 CA--C 1.5 -0.969 0 CA-C-N 115.163 -0.926 . . . . 78.239999999999995 111.707 -172.328 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' LYS . . . . . 0.991 ' HD2' ' CE3' ' A' ' 158' ' ' TRP . 23.3 tttt -58.86 -35.63 73.28 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 118.871 -1.131 . . . . 90.799999999999997 108.595 -178.858 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' HIS . . . . . 0.493 ' CD2' ' O ' ' A' ' 125' ' ' HIS . 11.6 t-160 -77.79 -31.62 51.94 Favored 'General case' 0 N--CA 1.442 -0.857 0 N-CA-C 115.952 1.834 . . . . 91.319999999999993 115.952 -177.462 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' LEU . . . . . 1.344 ' CD1' ' OD2' ' A' ' 132' ' ' ASP . 0.6 OUTLIER -87.77 -6.06 58.35 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 118.002 -1.479 . . . . 91.459999999999994 111.082 172.042 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' MSE . . . . . 0.989 ' HE1' HD21 ' A' ' 162' ' ' LEU . 2.5 ttp -91.75 -32.12 15.52 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 115.006 -0.997 . . . . 94.0 110.85 178.025 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . 0.485 1.8 p30 -93.8 -16.02 24.55 Favored 'General case' 0 C--N 1.314 -0.963 0 C-N-CA 114.424 -2.91 . . . . 98.680000000000007 117.906 164.761 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 17.3 tp10 -66.39 -39.61 89.17 Favored 'General case' 0 C--O 1.207 -1.135 0 N-CA-C 104.51 -2.404 . . . . 106.42 104.51 160.358 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 93.48 16.4 46.42 Favored Glycine 0 C--O 1.22 -0.781 0 C-N-CA 116.929 -2.558 . . . . 98.599999999999994 115.697 160.948 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.725 ' HE3' ' O ' ' A' ' 41' ' ' HOH . 68.5 mttt -105.59 -56.18 2.22 Favored 'General case' 0 C--N 1.309 -1.177 0 C-N-CA 117.55 -1.66 . . . . 104.31 111.971 -169.454 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' ASP . . . . . 1.344 ' OD2' ' CD1' ' A' ' 126' ' ' LEU 0.647 7.8 t0 -66.84 103.33 1.1 Allowed 'General case' 0 CA--C 1.469 -2.156 0 N-CA-C 119.63 3.196 . . . . 106.17 119.63 175.418 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -100.01 -4.21 30.48 Favored 'General case' 0 C--O 1.253 1.278 0 N-CA-C 104.463 -2.421 . . . . 96.650000000000006 104.463 172.118 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' LYS . . . . . 1.14 ' HE2' ' O ' ' A' ' 226' ' ' HOH . 7.3 mttt -77.94 -34.97 50.94 Favored 'General case' 0 C--O 1.246 0.898 0 CA-C-N 112.867 -1.969 . . . . 102.95 113.638 -171.186 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' PHE . . . . . 0.503 ' HB3' HD11 ' A' ' 126' ' ' LEU . 71.0 t80 -69.68 -47.12 64.35 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.831 -0.622 . . . . 83.640000000000001 110.493 175.169 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 48.1 tp -55.69 -42.91 75.86 Favored 'General case' 0 C--O 1.224 -0.283 0 N-CA-C 113.54 0.941 . . . . 77.590000000000003 113.54 176.071 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 35.5 mttt -69.59 -40.57 76.6 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 113.343 0.868 . . . . 82.709999999999994 113.343 -177.822 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 19.9 p -72.06 -27.78 62.91 Favored 'General case' 0 C--O 1.241 0.635 0 C-N-CA 120.886 -0.326 . . . . 76.310000000000002 111.244 -179.593 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' VAL . . . . . . . . . . . . . 35.9 t -73.11 -45.58 53.59 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.481 0 CA-C-O 121.066 0.46 . . . . 69.790000000000006 111.614 173.963 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.951 ' HB3' ' CE2' ' A' ' 169' ' ' TYR . 42.6 mt -67.99 -29.75 68.84 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 114.17 1.174 . . . . 65.760000000000005 114.17 178.794 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -100.18 5.56 44.76 Favored 'General case' 0 CA--C 1.477 -1.837 0 N-CA-C 113.631 0.975 . . . . 68.280000000000001 113.631 -172.874 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' SER . . . . . 0.63 ' HG ' ' HD2' ' A' ' 112' ' ' TYR . 0.1 OUTLIER -62.75 132.41 94.69 Favored Pre-proline 0 N--CA 1.413 -2.275 0 CA-C-N 113.953 -1.476 . . . . 64.879999999999995 111.279 179.741 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -62.76 -31.75 78.39 Favored 'Trans proline' 0 C--O 1.235 0.35 0 C-N-CA 124.787 3.658 . . . . 60.740000000000002 114.541 173.497 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' VAL . . . . . . . . . . . . . 2.6 t -139.57 135.37 39.79 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.288 0 N-CA-C 107.926 -1.138 . . . . 58.780000000000001 107.926 171.494 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 29.4 tp -138.3 127.67 24.59 Favored 'General case' 0 CA--C 1.503 -0.831 0 N-CA-C 109.409 -0.589 . . . . 55.609999999999999 109.409 -178.887 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' VAL . . . . . . . . . . . . . 89.3 t -101.4 110.43 28.24 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.454 0 CA-C-O 121.537 0.684 . . . . 52.700000000000003 110.605 175.84 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 55.0 mt -96.5 93.5 6.83 Favored 'General case' 0 N--CA 1.424 -1.758 0 N-CA-C 107.843 -1.169 . . . . 53.979999999999997 107.843 173.597 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' ASP . . . . . 0.561 ' O ' ' HB2' ' A' ' 149' ' ' ASP . 10.5 t70 -77.92 129.52 35.45 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.104 -0.639 . . . . 59.670000000000002 111.874 -175.9 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' ASP . . . . . 0.561 ' HB2' ' O ' ' A' ' 148' ' ' ASP . 0.2 OUTLIER 65.79 40.2 4.39 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 117.271 -1.771 . . . . 65.810000000000002 114.552 -177.331 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' LEU . . . . . 0.451 HD11 HG23 ' A' ' 163' ' ' ILE . 25.1 tp -66.81 76.84 0.12 Allowed 'General case' 0 N--CA 1.435 -1.223 0 N-CA-C 108.836 -0.802 . . . . 68.840000000000003 108.836 -179.177 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . 111.65 -2.5 27.62 Favored Glycine 0 C--O 1.21 -1.396 0 C-N-CA 116.344 -2.836 . . . . 74.609999999999999 117.723 159.35 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' SER . . . . . 0.74 ' HA ' ' O ' ' A' ' 21' ' ' HOH . 0.4 OUTLIER -44.07 139.2 2.58 Favored 'General case' 0 CA--C 1.564 1.482 0 CA-C-N 118.595 1.198 . . . . 78.909999999999997 109.616 157.231 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' GLU . . . . . 0.795 ' HG2' ' O ' ' A' ' 40' ' ' HOH . 0.0 OUTLIER 73.99 170.64 0.3 Allowed 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 108.582 -0.896 . . . . 88.0 108.582 -175.505 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' ARG . . . . . . . . . . . . . 17.8 mtt180 -101.41 139.38 37.15 Favored 'General case' 0 C--O 1.244 0.765 0 N-CA-C 113.34 0.867 . . . . 97.799999999999997 113.34 -174.174 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' LEU . . . . . 1.079 ' HB2' ' HE ' ' A' ' 160' ' ' ARG . 60.5 mt -109.35 115.86 30.76 Favored 'General case' 0 CA--C 1.503 -0.845 0 C-N-CA 126.875 2.07 . . . . 78.700000000000003 111.391 -169.686 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' SER . . . . . 0.692 ' O ' ' N ' ' A' ' 158' ' ' TRP . 99.7 p -58.69 119.87 7.9 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 115.45 1.648 . . . . 77.239999999999995 115.45 174.76 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' ASP . . . . . 0.72 ' O ' ' HG3' ' A' ' 161' ' ' GLU . 0.7 OUTLIER 5.26 -52.42 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 119.376 3.102 . . . . 83.650000000000006 119.376 169.517 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 158' ' ' TRP . . . . . 0.991 ' CE3' ' HD2' ' A' ' 124' ' ' LYS 0.282 40.7 p-90 -73.93 -43.97 56.55 Favored 'General case' 0 N--CA 1.507 2.408 0 N-CA-C 113.786 1.032 . . . . 85.159999999999997 113.786 -178.714 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 159' ' ' GLN . . . . . . . . . . . . . 6.0 mt-30 -63.57 -43.92 95.59 Favored 'General case' 0 C--O 1.221 -0.424 0 O-C-N 121.259 -0.901 . . . . 77.730000000000004 112.998 169.864 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 160' ' ' ARG . . . . . 1.079 ' HE ' ' HB2' ' A' ' 155' ' ' LEU . 29.0 mmt85 -45.58 -51.05 12.54 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 118.979 -0.534 . . . . 100.31999999999999 112.384 168.985 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 161' ' ' GLU . . . . . 0.72 ' HG3' ' O ' ' A' ' 157' ' ' ASP . 94.1 mt-10 -55.94 -49.71 72.74 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 115.148 1.536 . . . . 88.980000000000004 115.148 179.005 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 162' ' ' LEU . . . . . 0.989 HD21 ' HE1' ' A' ' 127' ' ' MSE . 74.0 mt -57.84 -43.88 86.13 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 126.497 1.919 . . . . 70.810000000000002 115.112 174.519 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 163' ' ' ILE . . . . . 0.568 HD12 HD13 ' A' ' 155' ' ' LEU . 96.9 mt -62.88 -54.16 37.31 Favored 'Isoleucine or valine' 0 C--N 1.35 0.624 0 O-C-N 124.215 0.947 . . . . 62.539999999999999 111.04 175.916 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 6.7 t -52.54 -43.95 65.49 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.475 0.655 . . . . 58.890000000000001 112.03 177.221 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 165' ' ' TYR . . . . . . . . . . . . . 24.1 t80 -57.21 -52.51 65.01 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 113.043 0.757 . . . . 60.850000000000001 113.043 174.053 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 166' ' ' ILE . . . . . . . . . . . . . 40.0 mt -69.85 -34.88 62.37 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.815 0 N-CA-C 108.888 -0.782 . . . . 53.979999999999997 108.888 -171.268 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 167' ' ' ILE . . . . . 0.609 HG23 ' HE1' ' A' ' 214' ' ' MSE . 9.2 mt -79.74 -38.82 19.53 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.822 0 CA-C-N 116.183 -0.462 . . . . 54.770000000000003 111.273 -179.193 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 168' ' ' THR . . . . . . . . . . . . . 91.8 m -58.07 -42.29 85.2 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 119.531 -0.867 . . . . 54.310000000000002 109.833 173.557 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 169' ' ' TYR . . . . . 1.432 ' CE1' ' ND2' ' A' ' 173' ' ' ASN . 12.3 t80 -63.53 -47.87 79.86 Favored 'General case' 0 N--CA 1.439 -1.014 0 N-CA-C 114.598 1.333 . . . . 70.829999999999998 114.598 -178.252 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 170' ' ' ARG . . . . . 0.883 ' HB3' ' O ' ' A' ' 223' ' ' HOH . 72.3 mtp85 -73.19 -26.22 61.08 Favored 'General case' 0 CA--C 1.483 -1.617 0 CA-C-N 115.973 -0.558 . . . . 52.799999999999997 111.128 -177.161 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 171' ' ' TYR . . . . . . . . . . . . . 56.2 t80 -69.06 -50.54 47.54 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 115.774 -0.648 . . . . 54.079999999999998 109.644 170.52 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 172' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -63.18 -35.17 79.41 Favored 'General case' 0 C--O 1.254 1.302 0 N-CA-C 113.917 1.08 . . . . 53.25 113.917 -179.236 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 173' ' ' ASN . . . . . 1.432 ' ND2' ' CE1' ' A' ' 169' ' ' TYR . 74.4 m-20 -103.41 21.6 15.7 Favored 'General case' 0 C--O 1.209 -1.064 0 C-N-CA 119.804 -0.758 . . . . 60.689999999999998 112.447 -169.992 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 174' ' ' LEU . . . . . . . . . . . . . 63.9 mt 44.27 55.54 5.47 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.982 0.913 . . . . 52.57 112.364 -178.797 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 2.6 mmtt -106.06 122.0 45.27 Favored 'General case' 0 N--CA 1.434 -1.231 0 CA-C-N 115.851 -0.613 . . . . 67.010000000000005 109.391 178.231 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 176' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.43 124.84 25.5 Favored 'General case' 0 CA--C 1.5 -0.945 0 CA-C-N 114.961 -1.018 . . . . 59.200000000000003 110.918 -173.476 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 177' ' ' THR . . . . . 0.78 ' HB ' ' O ' ' A' ' 223' ' ' HOH . 9.9 t -131.53 126.84 35.93 Favored 'General case' 0 C--O 1.253 1.28 0 CA-C-N 114.345 -1.298 . . . . 58.640000000000001 109.164 -171.232 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 80.8 mt -106.14 132.41 53.33 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 C-N-CA 123.766 0.826 . . . . 55.850000000000001 109.72 -178.126 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 24.2 mt -129.11 141.42 46.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 N-CA-C 112.384 0.513 . . . . 55.170000000000002 112.384 -170.954 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 180' ' ' THR . . . . . 0.552 HG22 ' HB2' ' A' ' 84' ' ' PHE . 62.1 p -126.12 135.56 51.84 Favored 'General case' 0 CA--C 1.488 -1.408 0 N-CA-C 107.903 -1.147 . . . . 59.93 107.903 169.353 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 181' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -142.81 155.27 44.78 Favored 'General case' 0 N--CA 1.427 -1.606 0 CA-C-N 115.129 -0.941 . . . . 68.180000000000007 109.378 -177.727 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 182' ' ' ASN . . . . . 0.458 ' HB3' ' HB3' ' A' ' 152' ' ' SER . 19.2 t-20 -92.39 134.78 34.61 Favored 'General case' 0 C--N 1.314 -0.967 0 N-CA-C 114.089 1.144 . . . . 80.739999999999995 114.089 179.604 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 183' ' ' TYR . . . . . 0.592 ' CZ ' HG12 ' A' ' 195' ' ' ILE . 60.8 t80 -137.88 140.24 40.3 Favored 'General case' 0 N--CA 1.494 1.757 0 C-N-CA 127.732 2.413 . . . . 95.5 107.212 173.55 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 184' ' ' SER . . . . . 0.424 ' CB ' ' O ' ' A' ' 38' ' ' HOH . 81.8 p -132.61 -38.56 1.02 Allowed 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 118.481 2.771 . . . . 96.659999999999997 118.481 -164.074 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 185' ' ' LEU . . . . . . . . . . . . . 76.8 mt -90.16 130.89 36.26 Favored 'General case' 0 N--CA 1.515 2.782 0 C-N-CA 124.007 0.923 . . . . 102.91 112.3 177.024 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 186' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -103.77 -31.76 9.67 Favored 'General case' 0 N--CA 1.501 2.1 1 N-CA-C 128.887 6.625 . . . . 110.19 128.887 -126.271 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.473 0.713 0 C-N-CA 114.358 -2.937 . . . . 109.02 116.046 -163.579 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 191' ' ' SER . . . . . 0.996 ' O ' HG13 ' A' ' 195' ' ' ILE . 0.1 OUTLIER . . . . . 0 CA--C 1.507 -0.675 0 N-CA-C 112.802 0.667 . . . . 111.26000000000001 112.802 . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 192' ' ' SER . . . . . 0.727 ' O ' ' O ' ' A' ' 17' ' ' HOH . 6.0 m -34.99 -61.41 0.42 Allowed 'General case' 0 CA--C 1.491 -1.316 0 CA-C-O 122.794 1.283 . . . . 110.5 109.937 -176.507 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 193' ' ' VAL . . . . . 0.615 ' O ' ' HB2' ' A' ' 196' ' ' SER 0.481 85.8 t -108.84 -3.59 10.38 Favored 'Isoleucine or valine' 0 N--CA 1.386 -3.654 1 C-N-CA 103.873 -7.131 . . . . 107.79000000000001 110.893 -156.085 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 194' ' ' ARG . . . . . 0.71 ' HG2' ' O ' ' A' ' 28' ' ' HOH . 38.8 ttm180 -72.71 -46.46 53.54 Favored 'General case' 0 C--O 1.252 1.223 0 N-CA-C 103.793 -2.669 . . . . 109.48999999999999 103.793 170.09 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 195' ' ' ILE . . . . . 0.996 HG13 ' O ' ' A' ' 191' ' ' SER . 21.1 mt -53.76 -26.22 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.864 0 N-CA-C 105.65 -1.981 . . . . 97.230000000000004 105.65 178.321 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 196' ' ' SER . . . . . 0.615 ' HB2' ' O ' ' A' ' 193' ' ' VAL . 66.6 m -70.57 -47.05 62.17 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 120.01 -0.676 . . . . 90.959999999999994 111.629 178.782 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -81.88 -27.97 33.18 Favored 'General case' 0 CA--C 1.503 -0.828 0 N-CA-C 107.528 -1.286 . . . . 85.349999999999994 107.528 -169.212 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 198' ' ' ASP . . . . . 0.825 ' HB2' ' O ' ' A' ' 28' ' ' HOH . 24.3 t0 -66.46 -47.14 74.04 Favored 'General case' 0 N--CA 1.434 -1.243 0 CA-C-N 114.773 -1.103 . . . . 78.900000000000006 109.697 178.302 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 199' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -62.68 -41.45 99.1 Favored 'General case' 0 C--O 1.255 1.387 0 CA-C-O 121.205 0.526 . . . . 74.230000000000004 111.298 173.894 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 200' ' ' ALA . . . . . . . . . . . . . . . -58.92 -34.61 71.9 Favored 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 115.276 -0.875 . . . . 69.469999999999999 112.523 178.356 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' SER . . . . . . . . . . . . . 50.5 p -62.45 -22.9 66.57 Favored 'General case' 0 CA--C 1.556 1.174 0 N-CA-C 118.745 2.868 . . . . 66.849999999999994 118.745 -177.765 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' ARG . . . . . 0.784 ' O ' ' CZ ' ' A' ' 160' ' ' ARG . 8.5 ptt-85 -125.4 -8.89 6.92 Favored 'General case' 0 C--O 1.253 1.242 0 CA-C-N 119.245 0.929 . . . . 68.530000000000001 109.382 179.821 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' LEU . . . . . . . . . . . . . 12.0 mt -101.82 -29.96 11.56 Favored 'General case' 0 C--O 1.215 -0.722 0 N-CA-C 115.428 1.64 . . . . 63.469999999999999 115.428 171.434 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' GLY . . . . . . . . . . . . . . . 101.31 143.79 14.33 Favored Glycine 0 CA--C 1.523 0.538 0 CA-C-N 116.501 -0.318 . . . . 63.82 112.395 -170.654 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' GLU . . . . . . . . . . . . . 74.5 mm-40 -50.41 -42.69 54.17 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 121.401 0.619 . . . . 87.209999999999994 112.3 174.646 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 51.8 t30 -63.5 -50.5 69.38 Favored 'General case' 0 CA--C 1.505 -0.772 0 CA-C-N 115.6 -0.727 . . . . 65.189999999999998 112.178 -169.634 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 207' ' ' VAL . . . . . . . . . . . . . 65.2 t -64.52 -40.9 90.67 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 O-C-N 123.787 0.679 . . . . 58.270000000000003 111.152 -178.423 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' VAL . . . . . . . . . . . . . 25.2 t -67.07 -43.79 88.59 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 CA-C-N 116.225 -0.443 . . . . 52.810000000000002 112.118 -178.108 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 209' ' ' SER . . . . . . . . . . . . . 5.5 t -55.98 -46.23 78.71 Favored 'General case' 0 CA--C 1.494 -1.209 0 CA-C-O 121.502 0.668 . . . . 51.329999999999998 111.0 175.61 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 210' ' ' LYS . . . . . 0.743 ' O ' ' HG2' ' A' ' 214' ' ' MSE . 68.5 mttt -63.62 -47.44 81.37 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-N 115.787 -0.642 . . . . 56.259999999999998 111.47 175.68 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 211' ' ' ILE . . . . . 0.557 ' HA ' ' HE3' ' A' ' 214' ' ' MSE . 17.9 mt -51.47 -31.32 12.01 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.946 0 C-N-CA 118.958 -1.097 . . . . 57.159999999999997 110.789 -179.605 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 212' ' ' TYR . . . . . . . . . . . . . 3.0 m-30 -78.46 -27.4 46.35 Favored 'General case' 0 CA--C 1.466 -2.253 0 N-CA-C 113.003 0.742 . . . . 74.390000000000001 113.003 -175.955 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 213' ' ' GLU . . . . . 0.752 ' O ' ' HG3' ' A' ' 213' ' ' GLU . 0.1 OUTLIER -88.16 -0.7 57.4 Favored 'General case' 0 N--CA 1.407 -2.589 0 C-N-CA 115.121 -2.632 . . . . 68.760000000000005 106.695 -174.973 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 214' ' ' MSE . . . . . 0.743 ' HG2' ' O ' ' A' ' 210' ' ' LYS . 0.8 OUTLIER -109.46 -29.12 8.57 Favored 'General case' 0 C--N 1.313 -0.998 0 C-N-CA 116.812 -1.955 . . . . 59.909999999999997 112.71 179.803 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 215' ' ' ASN . . . . . . . . . . . . . 37.5 m-20 -121.04 149.61 42.44 Favored 'General case' 0 N--CA 1.433 -1.279 0 CA-C-N 115.562 -0.745 . . . . 58.810000000000002 112.909 -167.53 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 216' ' ' GLU . . . . . . . . . . . . . 49.2 tt0 -90.65 139.93 30.25 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 115.87 -0.605 . . . . 67.709999999999994 110.685 168.968 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 217' ' ' LEU . . . . . 0.487 HD11 HG21 ' A' ' 85' ' ' VAL . 27.9 tp -89.31 124.38 34.36 Favored 'General case' 0 N--CA 1.44 -0.927 0 N-CA-C 112.098 0.407 . . . . 58.100000000000001 112.098 -171.586 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 218' ' ' LEU . . . . . 0.477 HD21 HG21 ' A' ' 66' ' ' THR . 68.4 mt -121.06 102.72 8.51 Favored 'General case' 0 C--O 1.202 -1.415 0 N-CA-C 111.787 0.292 . . . . 53.700000000000003 111.787 177.012 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 219' ' ' VAL . . . . . . . . . . . . 0.326 54.0 t -86.81 116.34 29.19 Favored 'Isoleucine or valine' 0 CA--C 1.47 -2.099 0 CA-C-O 117.263 -1.351 . . . . 55.909999999999997 109.89 177.785 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 220' ' ' ILE . . . . . 0.734 HG22 ' CG1' ' A' ' 90' ' ' VAL . 20.8 mt -106.47 127.24 61.99 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.689 0 C-N-CA 125.201 1.4 . . . . 62.159999999999997 111.18 -177.174 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 221' ' ' LYS . . . . . 0.926 ' HD3' ' O ' ' A' ' 22' ' ' HOH . 10.2 mtmt . . . . . 0 CA--C 1.504 -0.818 0 C-N-CA 120.85 -0.34 . . . . 64.409999999999997 111.837 -172.461 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 222' ' ' ADP . . . . . 0.46 ' N6 ' ' CE1' ' A' ' 53' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 300' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' HOH . . . . . 0.447 ' O ' ' HE3' ' A' ' 127' ' ' MSE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' HOH . . . . . 0.518 ' O ' ' HA ' ' A' ' 74' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' HOH . . . . . 0.727 ' O ' ' O ' ' A' ' 192' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' HOH . . . . . 0.619 ' O ' ' CB ' ' A' ' 191' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' HOH . . . . . 0.584 ' O ' HG22 ' A' ' 177' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' HOH . . . . . 0.74 ' O ' ' HA ' ' A' ' 152' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' HOH . . . . . 0.926 ' O ' ' HD3' ' A' ' 221' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' HOH . . . . . 0.473 ' O ' ' HB2' ' A' ' 51' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' HOH . . . . . 0.725 ' O ' ' CA ' ' A' ' 43' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' HOH . . . . . 0.753 ' O ' ' HG2' ' A' ' 62' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' HOH . . . . . 0.825 ' O ' ' HB2' ' A' ' 198' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' HOH . . . . . 0.871 ' O ' ' HA ' ' A' ' 134' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' HOH . . . . . 0.562 ' O ' ' HB3' ' A' ' 87' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' HOH . . . . . 0.429 ' O ' ' HD2' ' A' ' 134' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' HOH . . . . . 0.424 ' O ' ' CB ' ' A' ' 184' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' HOH . . . . . 0.608 ' O ' ' HD1' ' A' ' 53' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' HOH . . . . . 0.795 ' O ' ' HG2' ' A' ' 153' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' HOH . . . . . 0.725 ' O ' ' HE3' ' A' ' 131' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 223' ' ' HOH . . . . . 0.883 ' O ' ' HB3' ' A' ' 170' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 225' ' ' HOH . . . . . 0.625 ' O ' ' HG3' ' A' ' 153' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 226' ' ' HOH . . . . . 1.14 ' O ' ' HE2' ' A' ' 134' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 228' ' ' HOH . . . . . 0.685 ' O ' HD23 ' A' ' 126' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 229' ' ' HOH . . . . . 0.661 ' O ' ' HA3' ' A' ' 91' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 stop_ save_