data_2hti_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 2hti _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 ' 10' ' ' GLU . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.499 2.011 0 CA-C-O 121.023 0.439 . . . . 106.69 110.31 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' CYS . . . . . 0.476 ' SG ' ' N ' ' A' ' 12' ' ' LYS . 5.0 t -54.05 158.65 2.07 Favored 'General case' 0 CA--C 1.548 0.871 0 N-CA-C 117.649 2.463 . . . . 110.64 117.649 -167.84 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' LYS . . . . . 0.476 ' N ' ' SG ' ' A' ' 11' ' ' CYS . . . -159.25 45.39 0.26 Allowed 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 113.231 0.826 . . . . 104.39 113.231 -178.054 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -109.18 91.72 3.76 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.338 0.655 . . . . 110.0 110.601 176.505 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . . . -48.56 -28.89 3.71 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 115.04 1.496 . . . . 91.079999999999998 115.04 -170.554 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . . . -80.17 -40.79 26.56 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 118.32 0.509 . . . . 84.159999999999997 111.708 -178.269 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . . . -59.84 -45.61 91.88 Favored 'General case' 0 CA--C 1.547 0.831 0 CA-C-N 116.078 -0.51 . . . . 78.280000000000001 110.684 177.242 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 79.4 mt -62.12 -46.55 96.22 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.322 0 CA-C-N 115.592 -0.731 . . . . 77.329999999999998 111.19 -179.403 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 28.3 m -61.08 -44.74 96.91 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.307 -0.861 . . . . 73.879999999999995 110.294 179.733 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . . . -58.68 -45.48 89.34 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.217 -1.031 . . . . 67.109999999999999 108.217 178.951 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -59.22 -49.62 77.16 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 115.748 -0.66 . . . . 64.560000000000002 111.109 178.58 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 76.5 mt -62.82 -25.05 68.07 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 113.192 0.812 . . . . 60.25 113.192 -179.565 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -79.17 -31.0 43.8 Favored 'General case' 0 CA--C 1.506 -0.746 0 C-N-CA 120.58 -0.448 . . . . 70.670000000000002 110.806 178.766 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . . . -93.49 -37.76 11.76 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 113.998 1.11 . . . . 66.810000000000002 113.998 -173.7 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -50.57 133.32 25.35 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 112.502 0.556 . . . . 53.469999999999999 112.502 -179.389 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -85.63 -34.12 21.45 Favored 'General case' 0 CA--C 1.514 -0.406 0 N-CA-C 114.665 1.357 . . . . 82.310000000000002 114.665 -172.839 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 98.3 m -135.23 136.43 41.73 Favored 'General case' 0 CA--C 1.503 -0.848 0 CA-C-N 116.215 -0.448 . . . . 56.880000000000003 110.446 -169.173 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -124.51 164.72 17.81 Favored Glycine 0 N--CA 1.443 -0.841 0 N-CA-C 110.066 -1.214 . . . . 46.469999999999999 110.066 176.454 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 72.7 m-85 -123.25 115.95 22.57 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-O 121.457 0.646 . . . . 53.049999999999997 110.985 -174.755 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 51.6 tp -97.2 121.25 38.88 Favored 'General case' 0 CA--C 1.491 -1.316 0 CA-C-N 114.708 -1.133 . . . . 42.450000000000003 108.314 -172.117 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -106.88 127.61 8.92 Favored Glycine 0 N--CA 1.474 1.217 0 N-CA-C 110.04 -1.224 . . . . 46.0 110.04 -179.14 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 27.1 mt -128.91 159.92 34.29 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 124.682 1.193 . . . . 53.75 108.386 -178.897 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 84.2 p -150.55 139.92 21.37 Favored 'General case' 0 CA--C 1.51 -0.569 0 CA-C-O 120.988 0.423 . . . . 63.509999999999998 111.102 169.79 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 40.3 p -127.53 141.42 51.65 Favored 'General case' 0 CA--C 1.512 -0.499 0 N-CA-C 106.338 -1.727 . . . . 66.209999999999994 106.338 161.819 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 25.5 m-20 57.99 -148.24 0.49 Allowed 'General case' 0 C--O 1.263 1.814 0 N-CA-C 106.242 -1.762 . . . . 84.370000000000005 106.242 -161.3 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . . . -98.91 39.07 1.3 Allowed 'General case' 0 CA--C 1.549 0.919 0 CA-C-N 115.638 -0.71 . . . . 74.569999999999993 109.354 174.204 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 71.5 tp60 -117.35 103.09 51.79 Favored Pre-proline 0 N--CA 1.465 0.299 0 CA-C-O 121.731 0.777 . . . . 97.400000000000006 111.728 -176.987 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -72.59 152.09 53.39 Favored 'Trans proline' 0 N--CA 1.453 -0.862 0 C-N-CA 121.967 1.778 . . . . 57.530000000000001 114.001 -179.869 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 22.4 t80 -145.64 125.38 13.4 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 106.717 -1.586 . . . . 49.710000000000001 106.717 176.844 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 94.0 t -125.61 122.31 62.09 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 C-N-CA 123.544 0.737 . . . . 46.549999999999997 109.745 -175.751 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 25.2 pt -128.75 144.21 51.48 Favored Pre-proline 0 CA--C 1.505 -0.784 0 N-CA-C 112.049 0.389 . . . . 54.310000000000002 112.049 177.563 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_endo -76.72 144.41 24.77 Favored 'Trans proline' 0 C--O 1.251 1.15 0 O-C-N 122.925 0.961 . . . . 40.210000000000001 112.272 175.246 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 67.9 mt -145.43 146.48 31.53 Favored 'General case' 0 CA--C 1.508 -0.658 0 O-C-N 123.956 0.785 . . . . 47.950000000000003 111.192 -179.624 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 -74.41 147.37 42.13 Favored 'General case' 0 CA--C 1.511 -0.525 0 O-C-N 124.46 1.1 . . . . 56.619999999999997 108.066 163.239 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 30.0 p90 -160.07 164.3 33.22 Favored 'General case' 0 N--CA 1.434 -1.245 0 C-N-CA 119.348 -0.941 . . . . 53.640000000000001 108.825 -170.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 35.4 m -129.65 150.09 34.28 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.901 0 O-C-N 124.286 0.991 . . . . 56.259999999999998 110.115 163.094 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 56.6 t-105 -100.39 123.94 45.26 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 105.706 -1.961 . . . . 65.0 105.706 174.993 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' HIS . . . . . 0.402 ' O ' ' C ' ' A' ' 48' ' ' ASN . 6.4 t60 -155.92 154.66 31.54 Favored 'General case' 0 C--O 1.245 0.821 0 N-CA-C 105.317 -2.105 . . . . 94.849999999999994 105.317 -170.047 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ASN . . . . . 0.402 ' C ' ' O ' ' A' ' 47' ' ' HIS . 5.9 m-20 46.76 -141.74 0.42 Allowed 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 105.038 -2.208 . . . . 89.159999999999997 105.038 -168.296 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' HIS . . . . . 0.647 ' ND1' ' O ' ' A' ' 206' ' ' HOH . 56.6 t60 -108.89 54.02 0.67 Allowed 'General case' 0 C--O 1.244 0.772 0 N-CA-C 102.428 -3.175 . . . . 79.709999999999994 102.428 176.983 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -156.67 159.11 38.09 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 116.082 1.882 . . . . 59.630000000000003 116.082 -168.595 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 29.2 mm -104.11 128.43 57.5 Favored 'Isoleucine or valine' 0 C--O 1.244 0.764 0 CA-C-N 114.076 -1.42 . . . . 51.640000000000001 108.136 176.044 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -118.71 145.79 45.25 Favored 'General case' 0 N--CA 1.442 -0.827 0 N-CA-C 109.51 -0.552 . . . . 57.020000000000003 109.51 174.987 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 51.4 p90 -146.83 158.72 43.99 Favored 'General case' 0 N--CA 1.445 -0.687 0 C-N-CA 119.81 -0.756 . . . . 54.07 109.752 168.174 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 16.6 t-160 -101.06 133.01 46.22 Favored 'General case' 0 N--CA 1.442 -0.871 0 N-CA-C 106.262 -1.755 . . . . 67.739999999999995 106.262 177.573 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -153.07 154.82 25.75 Favored Glycine 0 C--O 1.228 -0.219 0 C-N-CA 121.629 -0.32 . . . . 55.149999999999999 112.725 -174.278 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -62.6 138.22 58.44 Favored 'General case' 0 N--CA 1.449 -0.475 0 N-CA-C 106.583 -1.636 . . . . 61.189999999999998 106.583 174.126 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.8 p -87.49 23.84 1.81 Allowed 'General case' 0 C--O 1.218 -0.582 0 CA-C-O 121.056 0.455 . . . . 65.819999999999993 111.48 179.301 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . . . -133.35 160.66 36.69 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 107.839 -1.171 . . . . 60.789999999999999 107.839 171.875 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 121.74 174.32 14.68 Favored Glycine 0 N--CA 1.469 0.847 0 C-N-CA 121.304 -0.475 . . . . 57.649999999999999 113.469 176.634 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 72.2 ttt180 -56.69 -44.97 82.01 Favored 'General case' 0 C--O 1.243 0.755 0 CA-C-O 121.36 0.6 . . . . 66.659999999999997 111.036 -179.748 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 22.8 pttm -51.99 -38.88 58.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.4 -0.818 . . . . 57.0 112.095 -179.849 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 46.2 mm -82.83 -33.86 11.02 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 N-CA-C 112.376 0.51 . . . . 56.740000000000002 112.376 -174.514 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . . . -57.73 -49.23 77.26 Favored 'General case' 0 C--O 1.241 0.657 0 C-N-CA 119.07 -1.052 . . . . 60.57 109.945 170.143 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' MSE . . . . . . . . . . . . . 94.3 mtp -62.56 -39.27 93.11 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 113.011 0.745 . . . . 61.170000000000002 113.011 -176.676 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 8.5 mt -64.75 -42.36 94.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.545 -0.752 . . . . 73.810000000000002 111.194 -178.96 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 71.7 mt-10 -65.32 -35.04 79.78 Favored 'General case' 0 N--CA 1.446 -0.642 0 N-CA-C 108.451 -0.944 . . . . 89.849999999999994 108.451 179.9 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -73.81 -43.15 59.68 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.373 -0.376 . . . . 65.120000000000005 111.954 175.551 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 21.8 t30 -148.85 96.16 3.83 Favored Pre-proline 0 C--O 1.218 -0.553 0 O-C-N 121.842 -0.536 . . . . 61.609999999999999 111.063 -172.802 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -80.64 4.47 6.87 Favored 'Trans proline' 0 CA--C 1.514 -0.504 0 C-N-CA 124.275 3.317 . . . . 57.719999999999999 114.559 -175.295 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 41.3 mm-40 -79.9 119.55 22.92 Favored 'General case' 0 C--O 1.248 1.004 0 N-CA-C 109.011 -0.737 . . . . 84.069999999999993 109.011 172.69 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 16.4 m -133.6 173.59 14.49 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.69 0 CA-C-O 122.113 0.959 . . . . 50.43 112.93 -173.497 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 45.2 t -129.71 138.71 51.28 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 114.026 -1.443 . . . . 58.509999999999998 108.815 176.667 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 31.9 t80 -130.87 120.05 23.09 Favored 'General case' 0 C--N 1.322 -0.595 0 O-C-N 121.501 -0.75 . . . . 46.07 110.375 174.735 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 70.9 m -120.46 132.07 55.05 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-O 121.414 0.626 . . . . 47.859999999999999 110.547 -171.221 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 5.1 mt -131.08 138.54 53.18 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.897 0 CA-C-O 122.282 1.039 . . . . 53.950000000000003 108.641 -177.508 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 1.5 t -155.59 131.0 9.61 Favored 'General case' 0 N--CA 1.435 -1.209 0 C-N-CA 119.027 -1.069 . . . . 65.590000000000003 109.875 -170.99 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -169.27 -166.91 0.66 Allowed 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.301 0.572 . . . . 86.099999999999994 111.268 -171.649 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -81.12 -79.88 0.15 Allowed 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 116.114 1.894 . . . . 106.90000000000001 116.114 -165.998 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 41.8 mt . . . . . 0 N--CA 1.48 1.052 0 CA-C-O 121.26 0.552 . . . . 99.299999999999997 112.229 -166.936 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.562 0 N-CA-C 111.808 0.299 . . . . 83.890000000000001 111.808 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 -110.96 133.02 53.72 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 112.901 0.704 . . . . 93.980000000000004 112.901 -177.386 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' MSE . . . . . . . . . . . . . 6.3 ttm -101.6 142.99 32.13 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 112.042 0.386 . . . . 78.879999999999995 112.042 168.642 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 96.5 p -135.36 134.99 40.36 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-O 121.552 0.691 . . . . 58.869999999999997 110.089 176.559 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 35.4 t -120.14 137.64 53.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 N-CA-C 108.975 -0.75 . . . . 55.659999999999997 108.975 178.29 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 77.1 mt -121.71 134.0 66.38 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.856 0 N-CA-C 107.788 -1.19 . . . . 53.759999999999998 107.788 174.297 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 87.7 mt -123.88 123.03 66.03 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.769 0 N-CA-C 107.37 -1.345 . . . . 55.329999999999998 107.37 -175.718 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 71.5 m-85 -106.38 147.33 29.38 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 108.345 -0.983 . . . . 57.609999999999999 108.345 174.818 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 169.56 -164.12 37.64 Favored Glycine 0 C--N 1.323 -0.139 0 C-N-CA 120.736 -0.745 . . . . 53.920000000000002 111.377 -178.062 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 8.7 p -123.9 144.93 49.47 Favored 'General case' 0 CA--C 1.509 -0.599 0 N-CA-C 107.538 -1.282 . . . . 59.380000000000003 107.538 -178.358 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 20.4 tt -106.27 151.88 8.12 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.539 0 N-CA-C 107.736 -1.209 . . . . 57.359999999999999 107.736 -174.22 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -162.25 150.57 12.28 Favored Pre-proline 0 N--CA 1.447 -0.6 0 N-CA-C 108.749 -0.834 . . . . 93.310000000000002 108.749 175.191 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -74.66 146.79 34.63 Favored 'Trans proline' 0 N--CA 1.447 -1.237 0 N-CA-C 109.174 -1.125 . . . . 55.399999999999999 109.174 178.806 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 53.4 t -90.97 128.3 42.87 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.004 0 O-C-N 123.66 0.6 . . . . 57.159999999999997 109.441 -177.948 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 56.4 p -110.22 -21.91 12.01 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 116.208 -0.451 . . . . 60.170000000000002 111.655 175.671 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -60.59 113.59 2.53 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.206 0.527 . . . . 60.899999999999999 112.071 174.335 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 12.6 mt -61.72 -38.34 80.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 N-CA-C 112.462 0.541 . . . . 64.689999999999998 112.462 -168.462 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 46.9 mp0 -84.44 -43.17 14.89 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.927 -0.579 . . . . 69.010000000000005 111.519 -171.484 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 76.7 tt0 -53.02 -50.89 63.33 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 108.244 -1.021 . . . . 80.689999999999998 108.244 168.793 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -55.68 -39.48 76.13 Favored Glycine 0 N--CA 1.453 -0.18 0 CA-C-N 116.34 -0.391 . . . . 67.359999999999999 113.509 177.208 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 73.7 m -78.47 -37.69 42.79 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 111.971 0.359 . . . . 68.819999999999993 111.971 -177.121 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . . . -57.16 -58.08 9.78 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 107.788 -1.189 . . . . 62.240000000000002 107.788 174.567 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -51.57 -38.61 55.19 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 115.807 -0.633 . . . . 65.519999999999996 112.389 -177.738 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' MSE . . . . . . . . . . . . . 53.1 tpp -68.56 -41.86 79.17 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 120.596 -0.442 . . . . 99.709999999999994 112.177 178.758 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . . . -66.54 -39.98 88.84 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 107.803 -1.184 . . . . 71.719999999999999 107.803 179.325 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . . . -58.29 -31.91 67.92 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 109.141 -0.689 . . . . 74.709999999999994 109.141 -179.842 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' MSE . . . . . . . . . . . . . 10.5 mtm -77.07 -42.69 37.29 Favored 'General case' 0 CA--C 1.501 -0.934 0 N-CA-C 112.879 0.696 . . . . 83.469999999999999 112.879 -177.502 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 42.8 mt -61.78 -46.46 89.46 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 108.139 -1.06 . . . . 72.299999999999997 108.139 178.453 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . . . -55.31 -37.71 67.74 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 120.704 -0.398 . . . . 81.760000000000005 111.276 176.986 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 37.7 tttt -76.25 -42.6 45.18 Favored 'General case' 0 C--O 1.215 -0.746 0 C-N-CA 120.891 -0.323 . . . . 68.980000000000004 111.595 -177.795 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' TYR . . . . . . . . . . . . . 90.2 m-85 -99.6 -24.24 14.8 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 113.632 0.975 . . . . 74.180000000000007 113.632 -171.965 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 5.7 m -134.86 61.56 48.12 Favored Pre-proline 0 CA--C 1.536 0.429 0 N-CA-C 113.413 0.894 . . . . 82.129999999999995 113.413 -178.667 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo . . . . . 0 C--N 1.351 0.658 0 O-C-N 122.31 0.637 . . . . 89.650000000000006 112.319 177.49 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 42.3 t . . . . . 0 CA--C 1.546 0.807 0 N-CA-C 114.682 1.364 . . . . 92.430000000000007 114.682 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 39.7 mt -87.72 31.07 0.78 Allowed 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 103.391 -2.818 . . . . 91.620000000000005 103.391 159.002 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -31.24 -60.94 0.26 Allowed Glycine 0 N--CA 1.473 1.145 1 N-CA-C 136.743 9.457 . . . . 83.629999999999995 136.743 -130.929 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 32.3 t -68.15 -58.81 3.86 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 117.553 -1.659 . . . . 78.659999999999997 112.572 -158.122 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . . . -131.42 111.17 11.59 Favored 'General case' 1 C--N 1.506 7.399 0 O-C-N 128.782 3.801 . . . . 70.549999999999997 110.407 -169.655 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 7.6 p -125.93 169.51 12.61 Favored 'General case' 0 N--CA 1.44 -0.955 0 CA-C-N 116.233 -0.439 . . . . 62.049999999999997 111.563 -175.204 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -153.9 165.48 35.96 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.369 -0.832 . . . . 54.909999999999997 110.146 175.859 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 48.8 mm -94.82 133.14 36.74 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.538 0 N-CA-C 107.938 -1.134 . . . . 60.149999999999999 107.938 169.98 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -113.41 149.6 33.9 Favored 'General case' 0 C--O 1.224 -0.282 0 CA-C-O 121.104 0.478 . . . . 56.210000000000001 111.518 178.753 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' LYS . . . . . . . . . . . . . 72.8 tttt -133.39 122.35 23.63 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.951 -0.568 . . . . 64.739999999999995 111.202 -174.303 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 30.7 mt -101.7 114.47 41.1 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.444 0 N-CA-C 106.176 -1.787 . . . . 55.460000000000001 106.176 174.599 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 26.1 p -80.65 122.65 27.36 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 107.085 -1.45 . . . . 72.790000000000006 107.085 179.142 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 45.2 t -73.28 90.79 1.65 Allowed 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.964 0.727 . . . . 78.780000000000001 112.964 -177.706 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 21.5 ttp-105 -69.4 -52.67 24.76 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 121.054 0.454 . . . . 93.319999999999993 110.344 173.228 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 55.8 tt0 -135.21 144.0 46.69 Favored 'General case' 0 C--O 1.22 -0.449 0 CA-C-N 115.898 -0.592 . . . . 98.109999999999999 112.086 179.079 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 158' ' ' ARG . . . . . . . . . . . . . 41.8 ttp180 -137.46 139.05 40.37 Favored 'General case' 0 N--CA 1.436 -1.142 0 CA-C-N 115.59 -0.732 . . . . 79.269999999999996 110.668 -176.885 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 35.9 p -137.05 142.2 42.43 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 109.283 -0.636 . . . . 66.780000000000001 109.283 177.063 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -124.8 158.91 32.22 Favored 'General case' 0 CA--C 1.512 -0.494 0 N-CA-C 109.566 -0.531 . . . . 68.030000000000001 109.566 -178.721 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 23.7 mtpt -155.89 146.52 21.96 Favored 'General case' 0 CA--C 1.506 -0.736 0 N-CA-C 108.715 -0.846 . . . . 79.480000000000004 108.715 179.17 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 162' ' ' VAL . . . . . . . . . . . . . 16.7 t -111.99 137.81 43.27 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.366 0 N-CA-C 106.95 -1.5 . . . . 82.290000000000006 106.95 170.683 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 163' ' ' ASN . . . . . . . . . . . . . 19.9 m120 -128.43 145.55 51.06 Favored 'General case' 0 C--O 1.246 0.871 0 N-CA-C 112.419 0.525 . . . . 91.269999999999996 112.419 -167.513 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 164' ' ' GLU . . . . . . . . . . . . . . . -63.06 -70.25 0.49 Allowed Pre-proline 0 C--O 1.242 0.685 0 N-CA-C 115.43 1.641 . . . . 94.900000000000006 115.43 -178.178 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 0.577 1 C-N-CA 125.81 4.34 . . . . 95.379999999999995 111.407 -179.878 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 185' ' ' ' NA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 200' ' ' FAD . . . . . 0.566 " C2'" ' N1 ' ' A' ' 200' ' ' FAD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' HOH . . . . . 0.647 ' O ' ' ND1' ' A' ' 49' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.499 2.011 0 CA-C-O 121.023 0.439 . . . . 106.69 110.31 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 11' ' ' CYS . . . . . 0.476 ' SG ' ' N ' ' A' ' 12' ' ' LYS . 5.0 t -54.05 158.65 2.07 Favored 'General case' 0 CA--C 1.548 0.871 0 N-CA-C 117.649 2.463 . . . . 110.64 117.649 -167.84 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 12' ' ' LYS . . . . . 0.476 ' N ' ' SG ' ' A' ' 11' ' ' CYS . . . -159.25 45.39 0.26 Allowed 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 113.231 0.826 . . . . 104.39 113.231 -178.054 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -109.18 91.72 3.76 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.338 0.655 . . . . 110.0 110.601 176.505 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . . . -48.56 -28.89 3.71 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 115.04 1.496 . . . . 91.079999999999998 115.04 -170.554 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . . . -80.17 -40.79 26.56 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 118.32 0.509 . . . . 84.159999999999997 111.708 -178.269 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . . . -59.84 -45.61 91.88 Favored 'General case' 0 CA--C 1.547 0.831 0 CA-C-N 116.078 -0.51 . . . . 78.280000000000001 110.684 177.242 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 79.4 mt -62.12 -46.55 96.22 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.322 0 CA-C-N 115.592 -0.731 . . . . 77.329999999999998 111.19 -179.403 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 28.3 m -61.08 -44.74 96.91 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.307 -0.861 . . . . 73.879999999999995 110.294 179.733 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . . . -58.68 -45.48 89.34 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.217 -1.031 . . . . 67.109999999999999 108.217 178.951 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -59.22 -49.62 77.16 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 115.748 -0.66 . . . . 64.560000000000002 111.109 178.58 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 76.5 mt -62.82 -25.05 68.07 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 113.192 0.812 . . . . 60.25 113.192 -179.565 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -79.17 -31.0 43.8 Favored 'General case' 0 CA--C 1.506 -0.746 0 C-N-CA 120.58 -0.448 . . . . 70.670000000000002 110.806 178.766 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . . . -93.49 -37.76 11.76 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 113.998 1.11 . . . . 66.810000000000002 113.998 -173.7 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -50.57 133.32 25.35 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 112.502 0.556 . . . . 53.469999999999999 112.502 -179.389 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -85.63 -34.12 21.45 Favored 'General case' 0 CA--C 1.514 -0.406 0 N-CA-C 114.665 1.357 . . . . 82.310000000000002 114.665 -172.839 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 98.3 m -135.23 136.43 41.73 Favored 'General case' 0 CA--C 1.503 -0.848 0 CA-C-N 116.215 -0.448 . . . . 56.880000000000003 110.446 -169.173 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' GLY . . . . . 0.489 ' HA3' ' CZ ' ' A' ' 73' ' ' PHE . . . -124.51 164.72 17.81 Favored Glycine 0 N--CA 1.443 -0.841 0 N-CA-C 110.066 -1.214 . . . . 46.469999999999999 110.066 176.454 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 72.7 m-85 -123.25 115.95 22.57 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-O 121.457 0.646 . . . . 53.049999999999997 110.985 -174.755 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 51.6 tp -97.2 121.25 38.88 Favored 'General case' 0 CA--C 1.491 -1.316 0 CA-C-N 114.708 -1.133 . . . . 42.450000000000003 108.314 -172.117 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -106.88 127.61 8.92 Favored Glycine 0 N--CA 1.474 1.217 0 N-CA-C 110.04 -1.224 . . . . 46.0 110.04 -179.14 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 27.1 mt -128.91 159.92 34.29 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 124.682 1.193 . . . . 53.75 108.386 -178.897 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 84.2 p -150.55 139.92 21.37 Favored 'General case' 0 CA--C 1.51 -0.569 0 CA-C-O 120.988 0.423 . . . . 63.509999999999998 111.102 169.79 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 40.3 p -127.53 141.42 51.65 Favored 'General case' 0 CA--C 1.512 -0.499 0 N-CA-C 106.338 -1.727 . . . . 66.209999999999994 106.338 161.819 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 25.5 m-20 57.99 -148.24 0.49 Allowed 'General case' 0 C--O 1.263 1.814 0 N-CA-C 106.242 -1.762 . . . . 84.370000000000005 106.242 -161.3 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . . . -98.91 39.07 1.3 Allowed 'General case' 0 CA--C 1.549 0.919 0 CA-C-N 115.638 -0.71 . . . . 74.569999999999993 109.354 174.204 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 71.5 tp60 -117.35 103.09 51.79 Favored Pre-proline 0 N--CA 1.465 0.299 0 CA-C-O 121.731 0.777 . . . . 97.400000000000006 111.728 -176.987 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -72.59 152.09 53.39 Favored 'Trans proline' 0 N--CA 1.453 -0.862 0 C-N-CA 121.967 1.778 . . . . 57.530000000000001 114.001 -179.869 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 22.4 t80 -145.64 125.38 13.4 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 106.717 -1.586 . . . . 49.710000000000001 106.717 176.844 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 94.0 t -125.61 122.31 62.09 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 C-N-CA 123.544 0.737 . . . . 46.549999999999997 109.745 -175.751 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 25.2 pt -128.75 144.21 51.48 Favored Pre-proline 0 CA--C 1.505 -0.784 0 N-CA-C 112.049 0.389 . . . . 54.310000000000002 112.049 177.563 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_endo -76.72 144.41 24.77 Favored 'Trans proline' 0 C--O 1.251 1.15 0 O-C-N 122.925 0.961 . . . . 40.210000000000001 112.272 175.246 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 67.9 mt -145.43 146.48 31.53 Favored 'General case' 0 CA--C 1.508 -0.658 0 O-C-N 123.956 0.785 . . . . 47.950000000000003 111.192 -179.624 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 -74.41 147.37 42.13 Favored 'General case' 0 CA--C 1.511 -0.525 0 O-C-N 124.46 1.1 . . . . 56.619999999999997 108.066 163.239 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 30.0 p90 -160.07 164.3 33.22 Favored 'General case' 0 N--CA 1.434 -1.245 0 C-N-CA 119.348 -0.941 . . . . 53.640000000000001 108.825 -170.921 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' VAL . . . . . 0.504 HG13 ' CG ' ' A' ' 119' ' ' MSE . 35.4 m -129.65 150.09 34.28 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.901 0 O-C-N 124.286 0.991 . . . . 56.259999999999998 110.115 163.094 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 56.6 t-105 -100.39 123.94 45.26 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 105.706 -1.961 . . . . 65.0 105.706 174.993 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' HIS . . . . . 0.402 ' O ' ' C ' ' A' ' 48' ' ' ASN . 6.4 t60 -155.92 154.66 31.54 Favored 'General case' 0 C--O 1.245 0.821 0 N-CA-C 105.317 -2.105 . . . . 94.849999999999994 105.317 -170.047 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ASN . . . . . 0.43 ' HB3' ' H ' ' A' ' 49' ' ' HIS . 5.9 m-20 46.76 -141.74 0.42 Allowed 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 105.038 -2.208 . . . . 89.159999999999997 105.038 -168.296 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 49' ' ' HIS . . . . . 0.647 ' ND1' ' O ' ' A' ' 206' ' ' HOH . 56.6 t60 -108.89 54.02 0.67 Allowed 'General case' 0 C--O 1.244 0.772 0 N-CA-C 102.428 -3.175 . . . . 79.709999999999994 102.428 176.983 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -156.67 159.11 38.09 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 116.082 1.882 . . . . 59.630000000000003 116.082 -168.595 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 29.2 mm -104.11 128.43 57.5 Favored 'Isoleucine or valine' 0 C--O 1.244 0.764 0 CA-C-N 114.076 -1.42 . . . . 51.640000000000001 108.136 176.044 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -118.71 145.79 45.25 Favored 'General case' 0 N--CA 1.442 -0.827 0 N-CA-C 109.51 -0.552 . . . . 57.020000000000003 109.51 174.987 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 51.4 p90 -146.83 158.72 43.99 Favored 'General case' 0 N--CA 1.445 -0.687 0 C-N-CA 119.81 -0.756 . . . . 54.07 109.752 168.174 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 16.6 t-160 -101.06 133.01 46.22 Favored 'General case' 0 N--CA 1.442 -0.871 0 N-CA-C 106.262 -1.755 . . . . 67.739999999999995 106.262 177.573 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -153.07 154.82 25.75 Favored Glycine 0 C--O 1.228 -0.219 0 C-N-CA 121.629 -0.32 . . . . 55.149999999999999 112.725 -174.278 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -62.6 138.22 58.44 Favored 'General case' 0 N--CA 1.449 -0.475 0 N-CA-C 106.583 -1.636 . . . . 61.189999999999998 106.583 174.126 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.8 p -87.49 23.84 1.81 Allowed 'General case' 0 C--O 1.218 -0.582 0 CA-C-O 121.056 0.455 . . . . 65.819999999999993 111.48 179.301 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . . . -133.35 160.66 36.69 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 107.839 -1.171 . . . . 60.789999999999999 107.839 171.875 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 121.74 174.32 14.68 Favored Glycine 0 N--CA 1.469 0.847 0 C-N-CA 121.304 -0.475 . . . . 57.649999999999999 113.469 176.634 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 72.2 ttt180 -56.69 -44.97 82.01 Favored 'General case' 0 C--O 1.243 0.755 0 CA-C-O 121.36 0.6 . . . . 66.659999999999997 111.036 -179.748 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 22.8 pttm -51.99 -38.88 58.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.4 -0.818 . . . . 57.0 112.095 -179.849 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 46.2 mm -82.83 -33.86 11.02 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 N-CA-C 112.376 0.51 . . . . 56.740000000000002 112.376 -174.514 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . . . -57.73 -49.23 77.26 Favored 'General case' 0 C--O 1.241 0.657 0 C-N-CA 119.07 -1.052 . . . . 60.57 109.945 170.143 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' MSE . . . . . . . . . . . . . 94.3 mtp -62.56 -39.27 93.11 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 113.011 0.745 . . . . 61.170000000000002 113.011 -176.676 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 8.5 mt -64.75 -42.36 94.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.545 -0.752 . . . . 73.810000000000002 111.194 -178.96 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 71.7 mt-10 -65.32 -35.04 79.78 Favored 'General case' 0 N--CA 1.446 -0.642 0 N-CA-C 108.451 -0.944 . . . . 89.849999999999994 108.451 179.9 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -73.81 -43.15 59.68 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.373 -0.376 . . . . 65.120000000000005 111.954 175.551 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 21.8 t30 -148.85 96.16 3.83 Favored Pre-proline 0 C--O 1.218 -0.553 0 O-C-N 121.842 -0.536 . . . . 61.609999999999999 111.063 -172.802 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -80.64 4.47 6.87 Favored 'Trans proline' 0 CA--C 1.514 -0.504 0 C-N-CA 124.275 3.317 . . . . 57.719999999999999 114.559 -175.295 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 41.3 mm-40 -79.9 119.55 22.92 Favored 'General case' 0 C--O 1.248 1.004 0 N-CA-C 109.011 -0.737 . . . . 84.069999999999993 109.011 172.69 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 16.4 m -133.6 173.59 14.49 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.69 0 CA-C-O 122.113 0.959 . . . . 50.43 112.93 -173.497 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 45.2 t -129.71 138.71 51.28 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 114.026 -1.443 . . . . 58.509999999999998 108.815 176.667 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' PHE . . . . . 0.489 ' CZ ' ' HA3' ' A' ' 27' ' ' GLY . 31.9 t80 -130.87 120.05 23.09 Favored 'General case' 0 C--N 1.322 -0.595 0 O-C-N 121.501 -0.75 . . . . 46.07 110.375 174.735 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 70.9 m -120.46 132.07 55.05 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-O 121.414 0.626 . . . . 47.859999999999999 110.547 -171.221 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 5.1 mt -131.08 138.54 53.18 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.897 0 CA-C-O 122.282 1.039 . . . . 53.950000000000003 108.641 -177.508 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 1.5 t -155.59 131.0 9.61 Favored 'General case' 0 N--CA 1.435 -1.209 0 C-N-CA 119.027 -1.069 . . . . 65.590000000000003 109.875 -170.99 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -169.27 -166.91 0.66 Allowed 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.301 0.572 . . . . 86.099999999999994 111.268 -171.649 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -81.12 -79.88 0.15 Allowed 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 116.114 1.894 . . . . 106.90000000000001 116.114 -165.998 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 41.8 mt . . . . . 0 N--CA 1.48 1.052 0 CA-C-O 121.26 0.552 . . . . 99.299999999999997 112.229 -166.936 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.562 0 N-CA-C 111.808 0.299 . . . . 83.890000000000001 111.808 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 -110.96 133.02 53.72 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 112.901 0.704 . . . . 93.980000000000004 112.901 -177.386 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' MSE . . . . . . . . . . . . . 6.3 ttm -101.6 142.99 32.13 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 112.042 0.386 . . . . 78.879999999999995 112.042 168.642 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 96.5 p -135.36 134.99 40.36 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-O 121.552 0.691 . . . . 58.869999999999997 110.089 176.559 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 35.4 t -120.14 137.64 53.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 N-CA-C 108.975 -0.75 . . . . 55.659999999999997 108.975 178.29 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 77.1 mt -121.71 134.0 66.38 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.856 0 N-CA-C 107.788 -1.19 . . . . 53.759999999999998 107.788 174.297 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 87.7 mt -123.88 123.03 66.03 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.769 0 N-CA-C 107.37 -1.345 . . . . 55.329999999999998 107.37 -175.718 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 71.5 m-85 -106.38 147.33 29.38 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 108.345 -0.983 . . . . 57.609999999999999 108.345 174.818 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 169.56 -164.12 37.64 Favored Glycine 0 C--N 1.323 -0.139 0 C-N-CA 120.736 -0.745 . . . . 53.920000000000002 111.377 -178.062 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 8.7 p -123.9 144.93 49.47 Favored 'General case' 0 CA--C 1.509 -0.599 0 N-CA-C 107.538 -1.282 . . . . 59.380000000000003 107.538 -178.358 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 20.4 tt -106.27 151.88 8.12 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.539 0 N-CA-C 107.736 -1.209 . . . . 57.359999999999999 107.736 -174.22 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -162.25 150.57 12.28 Favored Pre-proline 0 N--CA 1.447 -0.6 0 N-CA-C 108.749 -0.834 . . . . 93.310000000000002 108.749 175.191 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -74.66 146.79 34.63 Favored 'Trans proline' 0 N--CA 1.447 -1.237 0 N-CA-C 109.174 -1.125 . . . . 55.399999999999999 109.174 178.806 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 53.4 t -90.97 128.3 42.87 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.004 0 O-C-N 123.66 0.6 . . . . 57.159999999999997 109.441 -177.948 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 56.4 p -110.22 -21.91 12.01 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 116.208 -0.451 . . . . 60.170000000000002 111.655 175.671 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -60.59 113.59 2.53 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.206 0.527 . . . . 60.899999999999999 112.071 174.335 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 12.6 mt -61.72 -38.34 80.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 N-CA-C 112.462 0.541 . . . . 64.689999999999998 112.462 -168.462 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 46.9 mp0 -84.44 -43.17 14.89 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.927 -0.579 . . . . 69.010000000000005 111.519 -171.484 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 76.7 tt0 -53.02 -50.89 63.33 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 108.244 -1.021 . . . . 80.689999999999998 108.244 168.793 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -55.68 -39.48 76.13 Favored Glycine 0 N--CA 1.453 -0.18 0 CA-C-N 116.34 -0.391 . . . . 67.359999999999999 113.509 177.208 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 73.7 m -78.47 -37.69 42.79 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 111.971 0.359 . . . . 68.819999999999993 111.971 -177.121 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . . . -57.16 -58.08 9.78 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 107.788 -1.189 . . . . 62.240000000000002 107.788 174.567 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -51.57 -38.61 55.19 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 115.807 -0.633 . . . . 65.519999999999996 112.389 -177.738 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' MSE . . . . . 0.604 ' HE2' HD11 ' A' ' 150' ' ' ILE . 53.1 tpp -68.56 -41.86 79.17 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 120.596 -0.442 . . . . 99.709999999999994 112.177 178.758 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . . . -66.54 -39.98 88.84 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 107.803 -1.184 . . . . 71.719999999999999 107.803 179.325 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . . . -58.29 -31.91 67.92 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 109.141 -0.689 . . . . 74.709999999999994 109.141 -179.842 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' MSE . . . . . 0.504 ' CG ' HG13 ' A' ' 45' ' ' VAL . 10.5 mtm -77.07 -42.69 37.29 Favored 'General case' 0 CA--C 1.501 -0.934 0 N-CA-C 112.879 0.696 . . . . 83.469999999999999 112.879 -177.502 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 42.8 mt -61.78 -46.46 89.46 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 108.139 -1.06 . . . . 72.299999999999997 108.139 178.453 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . . . -55.31 -37.71 67.74 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 120.704 -0.398 . . . . 81.760000000000005 111.276 176.986 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 37.7 tttt -76.25 -42.6 45.18 Favored 'General case' 0 C--O 1.215 -0.746 0 C-N-CA 120.891 -0.323 . . . . 68.980000000000004 111.595 -177.795 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' TYR . . . . . . . . . . . . . 90.2 m-85 -99.6 -24.24 14.8 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 113.632 0.975 . . . . 74.180000000000007 113.632 -171.965 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 5.7 m -134.86 61.56 48.12 Favored Pre-proline 0 CA--C 1.536 0.429 0 N-CA-C 113.413 0.894 . . . . 82.129999999999995 113.413 -178.667 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo . . . . . 0 C--N 1.351 0.658 0 O-C-N 122.31 0.637 . . . . 89.650000000000006 112.319 177.49 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 42.3 t . . . . . 0 CA--C 1.546 0.807 0 N-CA-C 114.682 1.364 . . . . 92.430000000000007 114.682 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 39.7 mt -87.72 31.07 0.78 Allowed 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 103.391 -2.818 . . . . 91.620000000000005 103.391 159.002 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -31.24 -60.94 0.26 Allowed Glycine 0 N--CA 1.473 1.145 1 N-CA-C 136.743 9.457 . . . . 83.629999999999995 136.743 -130.929 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 32.3 t -68.15 -58.81 3.86 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 117.553 -1.659 . . . . 78.659999999999997 112.572 -158.122 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . . . -131.42 111.17 11.59 Favored 'General case' 1 C--N 1.506 7.399 0 O-C-N 128.782 3.801 . . . . 70.549999999999997 110.407 -169.655 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 7.6 p -125.93 169.51 12.61 Favored 'General case' 0 N--CA 1.44 -0.955 0 CA-C-N 116.233 -0.439 . . . . 62.049999999999997 111.563 -175.204 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -153.9 165.48 35.96 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.369 -0.832 . . . . 54.909999999999997 110.146 175.859 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 150' ' ' ILE . . . . . 0.604 HD11 ' HE2' ' A' ' 116' ' ' MSE . 48.8 mm -94.82 133.14 36.74 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.538 0 N-CA-C 107.938 -1.134 . . . . 60.149999999999999 107.938 169.98 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -113.41 149.6 33.9 Favored 'General case' 0 C--O 1.224 -0.282 0 CA-C-O 121.104 0.478 . . . . 56.210000000000001 111.518 178.753 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 152' ' ' LYS . . . . . . . . . . . . . 72.8 tttt -133.39 122.35 23.63 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.951 -0.568 . . . . 64.739999999999995 111.202 -174.303 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 30.7 mt -101.7 114.47 41.1 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.444 0 N-CA-C 106.176 -1.787 . . . . 55.460000000000001 106.176 174.599 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 26.1 p -80.65 122.65 27.36 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 107.085 -1.45 . . . . 72.790000000000006 107.085 179.142 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 45.2 t -73.28 90.79 1.65 Allowed 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.964 0.727 . . . . 78.780000000000001 112.964 -177.706 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 21.5 ttp-105 -69.4 -52.67 24.76 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 121.054 0.454 . . . . 93.319999999999993 110.344 173.228 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 55.8 tt0 -135.21 144.0 46.69 Favored 'General case' 0 C--O 1.22 -0.449 0 CA-C-N 115.898 -0.592 . . . . 98.109999999999999 112.086 179.079 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 158' ' ' ARG . . . . . . . . . . . . . 41.8 ttp180 -137.46 139.05 40.37 Favored 'General case' 0 N--CA 1.436 -1.142 0 CA-C-N 115.59 -0.732 . . . . 79.269999999999996 110.668 -176.885 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 35.9 p -137.05 142.2 42.43 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 109.283 -0.636 . . . . 66.780000000000001 109.283 177.063 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -124.8 158.91 32.22 Favored 'General case' 0 CA--C 1.512 -0.494 0 N-CA-C 109.566 -0.531 . . . . 68.030000000000001 109.566 -178.721 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 23.7 mtpt -155.89 146.52 21.96 Favored 'General case' 0 CA--C 1.506 -0.736 0 N-CA-C 108.715 -0.846 . . . . 79.480000000000004 108.715 179.17 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 162' ' ' VAL . . . . . . . . . . . . . 16.7 t -111.99 137.81 43.27 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.366 0 N-CA-C 106.95 -1.5 . . . . 82.290000000000006 106.95 170.683 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 163' ' ' ASN . . . . . . . . . . . . . 19.9 m120 -128.43 145.55 51.06 Favored 'General case' 0 C--O 1.246 0.871 0 N-CA-C 112.419 0.525 . . . . 91.269999999999996 112.419 -167.513 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 164' ' ' GLU . . . . . . . . . . . . . . . -63.06 -70.25 0.49 Allowed Pre-proline 0 C--O 1.242 0.685 0 N-CA-C 115.43 1.641 . . . . 94.900000000000006 115.43 -178.178 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 0.577 1 C-N-CA 125.81 4.34 . . . . 95.379999999999995 111.407 -179.878 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 185' ' ' ' NA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 200' ' ' FAD . . . . . 0.566 " C2'" ' N1 ' ' A' ' 200' ' ' FAD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 206' ' ' HOH . . . . . 0.647 ' O ' ' ND1' ' A' ' 49' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.499 2.011 0 CA-C-O 121.023 0.439 . . . . 106.69 110.31 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.476 ' SG ' ' N ' ' A' ' 12' ' ' LYS . 5.0 t -54.05 158.65 2.07 Favored 'General case' 0 CA--C 1.548 0.871 0 N-CA-C 117.649 2.463 . . . . 110.64 117.649 -167.84 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.476 ' N ' ' SG ' ' A' ' 11' ' ' CYS . . . -159.25 45.39 0.26 Allowed 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 113.231 0.826 . . . . 104.39 113.231 -178.054 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -109.18 91.72 3.76 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.338 0.655 . . . . 110.0 110.601 176.505 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . . . -48.56 -28.89 3.71 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 115.04 1.496 . . . . 91.08 115.04 -170.554 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . . . -80.17 -40.79 26.56 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 118.32 0.509 . . . . 84.16 111.708 -178.269 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . . . -59.84 -45.61 91.88 Favored 'General case' 0 CA--C 1.547 0.831 0 CA-C-N 116.078 -0.51 . . . . 78.28 110.684 177.242 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 79.4 mt -62.12 -46.55 96.22 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.322 0 CA-C-N 115.592 -0.731 . . . . 77.33 111.19 -179.403 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 28.3 m -61.08 -44.74 96.91 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.307 -0.861 . . . . 73.88 110.294 179.733 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . . . -58.68 -45.48 89.34 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.217 -1.031 . . . . 67.11 108.217 178.951 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -59.22 -49.62 77.16 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 115.748 -0.66 . . . . 64.56 111.109 178.58 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 76.5 mt -62.82 -25.05 68.07 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 113.192 0.812 . . . . 60.25 113.192 -179.565 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -79.17 -31.0 43.8 Favored 'General case' 0 CA--C 1.506 -0.746 0 C-N-CA 120.58 -0.448 . . . . 70.67 110.806 178.766 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . . . -93.49 -37.76 11.76 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 113.998 1.11 . . . . 66.81 113.998 -173.7 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -50.57 133.32 25.35 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 112.502 0.556 . . . . 53.47 112.502 -179.389 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -85.63 -34.12 21.45 Favored 'General case' 0 CA--C 1.514 -0.406 0 N-CA-C 114.665 1.357 . . . . 82.31 114.665 -172.839 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 98.3 m -135.23 136.43 41.73 Favored 'General case' 0 CA--C 1.503 -0.848 0 CA-C-N 116.215 -0.448 . . . . 56.88 110.446 -169.173 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.489 ' HA3' ' CZ ' ' A' ' 73' ' ' PHE . . . -124.51 164.72 17.81 Favored Glycine 0 N--CA 1.443 -0.841 0 N-CA-C 110.066 -1.214 . . . . 46.47 110.066 176.454 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 72.7 m-85 -123.25 115.95 22.57 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-O 121.457 0.646 . . . . 53.05 110.985 -174.755 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 51.6 tp -97.2 121.25 38.88 Favored 'General case' 0 CA--C 1.491 -1.316 0 CA-C-N 114.708 -1.133 . . . . 42.45 108.314 -172.117 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -106.88 127.61 8.92 Favored Glycine 0 N--CA 1.474 1.217 0 N-CA-C 110.04 -1.224 . . . . 46.0 110.04 -179.14 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 27.1 mt -128.91 159.92 34.29 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 124.682 1.193 . . . . 53.75 108.386 -178.897 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 84.2 p -150.55 139.92 21.37 Favored 'General case' 0 CA--C 1.51 -0.569 0 CA-C-O 120.988 0.423 . . . . 63.51 111.102 169.79 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 40.3 p -127.53 141.42 51.65 Favored 'General case' 0 CA--C 1.512 -0.499 0 N-CA-C 106.338 -1.727 . . . . 66.21 106.338 161.819 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 25.5 m-20 57.99 -148.24 0.49 Allowed 'General case' 0 C--O 1.263 1.814 0 N-CA-C 106.242 -1.762 . . . . 84.37 106.242 -161.3 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . . . -98.91 39.07 1.3 Allowed 'General case' 0 CA--C 1.549 0.919 0 CA-C-N 115.638 -0.71 . . . . 74.57 109.354 174.204 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 71.5 tp60 -117.35 103.09 51.79 Favored Pre-proline 0 N--CA 1.465 0.299 0 CA-C-O 121.731 0.777 . . . . 97.4 111.728 -176.987 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -72.59 152.09 53.39 Favored 'Trans proline' 0 N--CA 1.453 -0.862 0 C-N-CA 121.967 1.778 . . . . 57.53 114.001 -179.869 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 22.4 t80 -145.64 125.38 13.4 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 106.717 -1.586 . . . . 49.71 106.717 176.844 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 94.0 t -125.61 122.31 62.09 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 C-N-CA 123.544 0.737 . . . . 46.55 109.745 -175.751 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 25.2 pt -128.75 144.21 51.48 Favored Pre-proline 0 CA--C 1.505 -0.784 0 N-CA-C 112.049 0.389 . . . . 54.31 112.049 177.563 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_endo -76.72 144.41 24.77 Favored 'Trans proline' 0 C--O 1.251 1.15 0 O-C-N 122.925 0.961 . . . . 40.21 112.272 175.246 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 67.9 mt -145.43 146.48 31.53 Favored 'General case' 0 CA--C 1.508 -0.658 0 O-C-N 123.956 0.785 . . . . 47.95 111.192 -179.624 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 -74.41 147.37 42.13 Favored 'General case' 0 CA--C 1.511 -0.525 0 O-C-N 124.46 1.1 . . . . 56.62 108.066 163.239 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 30.0 p90 -160.07 164.3 33.22 Favored 'General case' 0 N--CA 1.434 -1.245 0 C-N-CA 119.348 -0.941 . . . . 53.64 108.825 -170.921 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.504 HG13 ' CG ' ' A' ' 119' ' ' MSE . 35.4 m -129.65 150.09 34.28 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.901 0 O-C-N 124.286 0.991 . . . . 56.26 110.115 163.094 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 56.6 t-105 -100.39 123.94 45.26 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 105.706 -1.961 . . . . 65.0 105.706 174.993 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' HIS . . . . . 0.402 ' O ' ' C ' ' A' ' 48' ' ' ASN . 6.4 t60 -155.92 154.66 31.54 Favored 'General case' 0 C--O 1.245 0.821 0 N-CA-C 105.317 -2.105 . . . . 94.85 105.317 -170.047 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.43 ' HB3' ' H ' ' A' ' 49' ' ' HIS . 5.9 m-20 46.76 -141.74 0.42 Allowed 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 105.038 -2.208 . . . . 89.16 105.038 -168.296 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' HIS . . . . . 0.647 ' ND1' ' O ' ' A' ' 206' ' ' HOH . 56.6 t60 -108.89 54.02 0.67 Allowed 'General case' 0 C--O 1.244 0.772 0 N-CA-C 102.428 -3.175 . . . . 79.71 102.428 176.983 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -156.67 159.11 38.09 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 116.082 1.882 . . . . 59.63 116.082 -168.595 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 29.2 mm -104.11 128.43 57.5 Favored 'Isoleucine or valine' 0 C--O 1.244 0.764 0 CA-C-N 114.076 -1.42 . . . . 51.64 108.136 176.044 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -118.71 145.79 45.25 Favored 'General case' 0 N--CA 1.442 -0.827 0 N-CA-C 109.51 -0.552 . . . . 57.02 109.51 174.987 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 51.4 p90 -146.83 158.72 43.99 Favored 'General case' 0 N--CA 1.445 -0.687 0 C-N-CA 119.81 -0.756 . . . . 54.07 109.752 168.174 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' HIS . . . . . . . . . . . . . 16.6 t-160 -101.06 133.01 46.22 Favored 'General case' 0 N--CA 1.442 -0.871 0 N-CA-C 106.262 -1.755 . . . . 67.74 106.262 177.573 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -153.07 154.82 25.75 Favored Glycine 0 C--O 1.228 -0.219 0 C-N-CA 121.629 -0.32 . . . . 55.15 112.725 -174.278 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -62.6 138.22 58.44 Favored 'General case' 0 N--CA 1.449 -0.475 0 N-CA-C 106.583 -1.636 . . . . 61.19 106.583 174.126 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.8 p -87.49 23.84 1.81 Allowed 'General case' 0 C--O 1.218 -0.582 0 CA-C-O 121.056 0.455 . . . . 65.82 111.48 179.301 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . . . -133.35 160.66 36.69 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 107.839 -1.171 . . . . 60.79 107.839 171.875 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 121.74 174.32 14.68 Favored Glycine 0 N--CA 1.469 0.847 0 C-N-CA 121.304 -0.475 . . . . 57.65 113.469 176.634 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 72.2 ttt180 -56.69 -44.97 82.01 Favored 'General case' 0 C--O 1.243 0.755 0 CA-C-O 121.36 0.6 . . . . 66.66 111.036 -179.748 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 22.8 pttm -51.99 -38.88 58.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.4 -0.818 . . . . 57.0 112.095 -179.849 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 46.2 mm -82.83 -33.86 11.02 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 N-CA-C 112.376 0.51 . . . . 56.74 112.376 -174.514 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . . . -57.73 -49.23 77.26 Favored 'General case' 0 C--O 1.241 0.657 0 C-N-CA 119.07 -1.052 . . . . 60.57 109.945 170.143 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' MSE . . . . . . . . . . . . . 94.3 mtp -62.56 -39.27 93.11 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 113.011 0.745 . . . . 61.17 113.011 -176.676 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 8.5 mt -64.75 -42.36 94.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.545 -0.752 . . . . 73.81 111.194 -178.96 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 71.7 mt-10 -65.32 -35.04 79.78 Favored 'General case' 0 N--CA 1.446 -0.642 0 N-CA-C 108.451 -0.944 . . . . 89.85 108.451 179.9 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -73.81 -43.15 59.68 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.373 -0.376 . . . . 65.12 111.954 175.551 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 21.8 t30 -148.85 96.16 3.83 Favored Pre-proline 0 C--O 1.218 -0.553 0 O-C-N 121.842 -0.536 . . . . 61.61 111.063 -172.802 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -80.64 4.47 6.87 Favored 'Trans proline' 0 CA--C 1.514 -0.504 0 C-N-CA 124.275 3.317 . . . . 57.72 114.559 -175.295 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 41.3 mm-40 -79.9 119.55 22.92 Favored 'General case' 0 C--O 1.248 1.004 0 N-CA-C 109.011 -0.737 . . . . 84.07 109.011 172.69 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 16.4 m -133.6 173.59 14.49 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.69 0 CA-C-O 122.113 0.959 . . . . 50.43 112.93 -173.497 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 45.2 t -129.71 138.71 51.28 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 114.026 -1.443 . . . . 58.51 108.815 176.667 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.489 ' CZ ' ' HA3' ' A' ' 27' ' ' GLY . 31.9 t80 -130.87 120.05 23.09 Favored 'General case' 0 C--N 1.322 -0.595 0 O-C-N 121.501 -0.75 . . . . 46.07 110.375 174.735 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 70.9 m -120.46 132.07 55.05 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-O 121.414 0.626 . . . . 47.86 110.547 -171.221 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 5.1 mt -131.08 138.54 53.18 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.897 0 CA-C-O 122.282 1.039 . . . . 53.95 108.641 -177.508 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 1.5 t -155.59 131.0 9.61 Favored 'General case' 0 N--CA 1.435 -1.209 0 C-N-CA 119.027 -1.069 . . . . 65.59 109.875 -170.99 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -169.27 -166.91 0.66 Allowed 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.301 0.572 . . . . 86.1 111.268 -171.649 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -81.12 -79.88 0.15 Allowed 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 116.114 1.894 . . . . 106.9 116.114 -165.998 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 41.8 mt . . . . . 0 N--CA 1.48 1.052 0 CA-C-O 121.26 0.552 . . . . 99.3 112.229 -166.936 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.562 0 N-CA-C 111.808 0.299 . . . . 83.89 111.808 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 -110.96 133.02 53.72 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 112.901 0.704 . . . . 93.98 112.901 -177.386 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' MSE . . . . . . . . . . . . . 6.3 ttm -101.6 142.99 32.13 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 112.042 0.386 . . . . 78.88 112.042 168.642 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 96.5 p -135.36 134.99 40.36 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-O 121.552 0.691 . . . . 58.87 110.089 176.559 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 35.4 t -120.14 137.64 53.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 N-CA-C 108.975 -0.75 . . . . 55.66 108.975 178.29 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 77.1 mt -121.71 134.0 66.38 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.856 0 N-CA-C 107.788 -1.19 . . . . 53.76 107.788 174.297 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 87.7 mt -123.88 123.03 66.03 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.769 0 N-CA-C 107.37 -1.345 . . . . 55.33 107.37 -175.718 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 71.5 m-85 -106.38 147.33 29.38 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 108.345 -0.983 . . . . 57.61 108.345 174.818 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 169.56 -164.12 37.64 Favored Glycine 0 C--N 1.323 -0.139 0 C-N-CA 120.736 -0.745 . . . . 53.92 111.377 -178.062 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 8.7 p -123.9 144.93 49.47 Favored 'General case' 0 CA--C 1.509 -0.599 0 N-CA-C 107.538 -1.282 . . . . 59.38 107.538 -178.358 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 20.4 tt -106.27 151.88 8.12 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.539 0 N-CA-C 107.736 -1.209 . . . . 57.36 107.736 -174.22 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -162.25 150.57 12.28 Favored Pre-proline 0 N--CA 1.447 -0.6 0 N-CA-C 108.749 -0.834 . . . . 93.31 108.749 175.191 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -74.66 146.79 34.63 Favored 'Trans proline' 0 N--CA 1.447 -1.237 0 N-CA-C 109.174 -1.125 . . . . 55.4 109.174 178.806 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 53.4 t -90.97 128.3 42.87 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.004 0 O-C-N 123.66 0.6 . . . . 57.16 109.441 -177.948 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 56.4 p -110.22 -21.91 12.01 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 116.208 -0.451 . . . . 60.17 111.655 175.671 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -60.59 113.59 2.53 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.206 0.527 . . . . 60.9 112.071 174.335 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 12.6 mt -61.72 -38.34 80.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 N-CA-C 112.462 0.541 . . . . 64.69 112.462 -168.462 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 46.9 mp0 -84.44 -43.17 14.89 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.927 -0.579 . . . . 69.01 111.519 -171.484 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 76.7 tt0 -53.02 -50.89 63.33 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 108.244 -1.021 . . . . 80.69 108.244 168.793 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -55.68 -39.48 76.13 Favored Glycine 0 N--CA 1.453 -0.18 0 CA-C-N 116.34 -0.391 . . . . 67.36 113.509 177.208 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 73.7 m -78.47 -37.69 42.79 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 111.971 0.359 . . . . 68.82 111.971 -177.121 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . . . -57.16 -58.08 9.78 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 107.788 -1.189 . . . . 62.24 107.788 174.567 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -51.57 -38.61 55.19 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 115.807 -0.633 . . . . 65.52 112.389 -177.738 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' MSE . . . . . 0.604 ' HE2' HD11 ' A' ' 150' ' ' ILE . 53.1 tpp -68.56 -41.86 79.17 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 120.596 -0.442 . . . . 99.71 112.177 178.758 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . . . -66.54 -39.98 88.84 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 107.803 -1.184 . . . . 71.72 107.803 179.325 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . . . -58.29 -31.91 67.92 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 109.141 -0.689 . . . . 74.71 109.141 -179.842 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' MSE . . . . . 0.504 ' CG ' HG13 ' A' ' 45' ' ' VAL . 10.5 mtm -77.07 -42.69 37.29 Favored 'General case' 0 CA--C 1.501 -0.934 0 N-CA-C 112.879 0.696 . . . . 83.47 112.879 -177.502 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 42.8 mt -61.78 -46.46 89.46 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 108.139 -1.06 . . . . 72.3 108.139 178.453 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . . . -55.31 -37.71 67.74 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 120.704 -0.398 . . . . 81.76 111.276 176.986 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 37.7 tttt -76.25 -42.6 45.18 Favored 'General case' 0 C--O 1.215 -0.746 0 C-N-CA 120.891 -0.323 . . . . 68.98 111.595 -177.795 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' TYR . . . . . . . . . . . . . 90.2 m-85 -99.6 -24.24 14.8 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 113.632 0.975 . . . . 74.18 113.632 -171.965 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 5.7 m -134.86 61.56 48.12 Favored Pre-proline 0 CA--C 1.536 0.429 0 N-CA-C 113.413 0.894 . . . . 82.13 113.413 -178.667 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo . . . . . 0 C--N 1.351 0.658 0 O-C-N 122.31 0.637 . . . . 89.65 112.319 177.49 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 42.3 t . . . . . 0 CA--C 1.546 0.807 0 N-CA-C 114.682 1.364 . . . . 92.43 114.682 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 39.7 mt -87.72 31.07 0.78 Allowed 'General case' 0 N--CA 1.477 0.92 0 N-CA-C 103.391 -2.818 . . . . 91.62 103.391 159.002 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' GLY . . . . . . . . . . . . . . . -31.24 -60.94 0.26 Allowed Glycine 0 N--CA 1.473 1.145 1 N-CA-C 136.743 9.457 . . . . 83.63 136.743 -130.929 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 32.3 t -68.15 -58.81 3.86 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 117.553 -1.659 . . . . 78.66 112.572 -158.122 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' ARG . . . . . . . . . . . . . . . -131.42 111.17 11.59 Favored 'General case' 1 C--N 1.506 7.399 0 O-C-N 128.782 3.801 . . . . 70.55 110.407 -169.655 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 7.6 p -125.93 169.51 12.61 Favored 'General case' 0 N--CA 1.44 -0.955 0 CA-C-N 116.233 -0.439 . . . . 62.05 111.563 -175.204 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -153.9 165.48 35.96 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.369 -0.832 . . . . 54.91 110.146 175.859 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' ILE . . . . . 0.604 HD11 ' HE2' ' A' ' 116' ' ' MSE . 48.8 mm -94.82 133.14 36.74 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.538 0 N-CA-C 107.938 -1.134 . . . . 60.15 107.938 169.98 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -113.41 149.6 33.9 Favored 'General case' 0 C--O 1.224 -0.282 0 CA-C-O 121.104 0.478 . . . . 56.21 111.518 178.753 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' LYS . . . . . . . . . . . . . 72.8 tttt -133.39 122.35 23.63 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.951 -0.568 . . . . 64.74 111.202 -174.303 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 30.7 mt -101.7 114.47 41.1 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.444 0 N-CA-C 106.176 -1.787 . . . . 55.46 106.176 174.599 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 26.1 p -80.65 122.65 27.36 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 107.085 -1.45 . . . . 72.79 107.085 179.142 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 45.2 t -73.28 90.79 1.65 Allowed 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.964 0.727 . . . . 78.78 112.964 -177.706 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' ARG . . . . . . . . . . . . . 21.5 ttp-105 -69.4 -52.67 24.76 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 121.054 0.454 . . . . 93.32 110.344 173.228 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 55.8 tt0 -135.21 144.0 46.69 Favored 'General case' 0 C--O 1.22 -0.449 0 CA-C-N 115.898 -0.592 . . . . 98.11 112.086 179.079 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 158' ' ' ARG . . . . . . . . . . . . . 41.8 ttp180 -137.46 139.05 40.37 Favored 'General case' 0 N--CA 1.436 -1.142 0 CA-C-N 115.59 -0.732 . . . . 79.27 110.668 -176.885 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 159' ' ' THR . . . . . . . . . . . . . 35.9 p -137.05 142.2 42.43 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 109.283 -0.636 . . . . 66.78 109.283 177.063 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -124.8 158.91 32.22 Favored 'General case' 0 CA--C 1.512 -0.494 0 N-CA-C 109.566 -0.531 . . . . 68.03 109.566 -178.721 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 23.7 mtpt -155.89 146.52 21.96 Favored 'General case' 0 CA--C 1.506 -0.736 0 N-CA-C 108.715 -0.846 . . . . 79.48 108.715 179.17 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 162' ' ' VAL . . . . . . . . . . . . . 16.7 t -111.99 137.81 43.27 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.366 0 N-CA-C 106.95 -1.5 . . . . 82.29 106.95 170.683 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 163' ' ' ASN . . . . . . . . . . . . . 19.9 m120 -128.43 145.55 51.06 Favored 'General case' 0 C--O 1.246 0.871 0 N-CA-C 112.419 0.525 . . . . 91.27 112.419 -167.513 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 164' ' ' GLU . . . . . . . . . . . . . . . -63.06 -70.25 0.49 Allowed Pre-proline 0 C--O 1.242 0.685 0 N-CA-C 115.43 1.641 . . . . 94.9 115.43 -178.178 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 165' ' ' PRO . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 0.577 1 C-N-CA 125.81 4.34 . . . . 95.38 111.407 -179.878 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 185' ' ' ' NA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 200' ' ' FAD . . . . . 0.566 ' N1 ' " C2'" ' A' ' 200' ' ' FAD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' HOH . . . . . 0.647 ' O ' ' ND1' ' A' ' 49' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_