data_3klu_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 3klu _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 ' 8' ' ' LYS . . . . . 0.44 ' O ' ' C ' ' A' ' 9' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.747 0 CA-C-O 120.529 0.204 . . . . 114.26000000000001 111.205 . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' VAL . . . . . 0.44 ' C ' ' O ' ' A' ' 8' ' ' LYS . 9.9 p 20.74 101.18 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 N-CA-C 114.123 1.157 . . . . 114.45999999999999 114.123 -179.587 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 57.3 m-85 -76.27 138.16 40.38 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 114.968 -1.015 . . . . 55.57 112.77 -179.879 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 63.8 t0 -91.87 100.09 12.83 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 113.694 0.998 . . . . 38.549999999999997 113.694 -178.387 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 69.6 mt -87.9 1.91 52.85 Favored 'General case' 0 N--CA 1.434 -1.247 0 N-CA-C 116.883 2.179 . . . . 22.390000000000001 116.883 -177.521 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 35.3 p -59.07 -30.75 68.29 Favored 'General case' 0 CA--C 1.54 0.582 0 O-C-N 120.787 -1.196 . . . . 29.0 111.313 -179.342 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 18.7 m-85 -65.54 -20.61 66.4 Favored 'General case' 0 CA--C 1.508 -0.646 0 N-CA-C 116.113 1.894 . . . . 28.620000000000001 116.113 -178.176 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 70.4 m-85 -102.76 23.54 11.94 Favored 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 120.24 -0.584 . . . . 21.82 110.167 179.623 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' MSE . . . . . . . . . . . . . 30.9 mtt -120.67 150.87 53.42 Favored Pre-proline 0 N--CA 1.439 -1.0 0 C-N-CA 118.252 -1.379 . . . . 84.140000000000001 113.022 178.966 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' PRO . . . . . 0.527 ' O ' ' N ' ' A' ' 19' ' ' GLN . 68.6 Cg_endo -37.03 -44.49 1.17 Allowed 'Trans proline' 0 N--CA 1.471 0.196 1 C-N-CA 126.397 4.731 . . . . 57.07 115.477 -179.268 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' GLY . . . . . 0.434 ' O ' ' CB ' ' A' ' 19' ' ' GLN . . . -72.74 53.88 1.66 Allowed Glycine 0 N--CA 1.446 -0.684 0 N-CA-C 105.703 -2.959 . . . . 113.91 105.703 178.23 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' GLN . . . . . 0.527 ' N ' ' O ' ' A' ' 17' ' ' PRO . 1.7 tp-100 172.14 -79.06 0.0 OUTLIER 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 117.493 2.405 . . . . 91.670000000000002 117.493 -178.716 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' THR . . . . . 0.46 ' C ' ' O ' ' A' ' 19' ' ' GLN . 4.3 p -32.71 112.62 0.12 Allowed 'General case' 0 CA--C 1.511 -0.547 0 N-CA-C 112.541 0.571 . . . . 43.140000000000001 112.541 -177.734 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 80.5 mt -47.97 138.44 3.05 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.318 0 O-C-N 124.271 0.982 . . . . 60.350000000000001 108.688 178.573 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -98.35 164.87 12.11 Favored 'General case' 0 N--CA 1.425 -1.702 0 C-N-CA 115.131 -2.628 . . . . 76.849999999999994 114.152 -179.099 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -55.22 137.86 46.27 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 113.445 -1.707 . . . . 55.149999999999999 114.86 179.89 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -27.93 -127.26 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.964 1 N-CA-C 123.348 4.573 . . . . 138.36000000000001 123.348 178.765 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 137.08 84.28 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.616 1 N-CA-C 94.207 -6.22 . . . . 56.289999999999999 94.207 -177.889 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 72.9 t -98.71 125.05 52.21 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 CA-C-N 113.552 -1.658 . . . . 30.289999999999999 111.896 -177.305 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -89.93 135.21 33.78 Favored 'General case' 0 C--O 1.221 -0.401 0 N-CA-C 108.437 -0.949 . . . . 61.539999999999999 108.437 178.935 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 48.7 t -143.81 125.08 8.07 Favored Pre-proline 0 C--O 1.242 0.66 0 N-CA-C 109.0 -0.741 . . . . 31.91 109.0 -177.965 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -79.67 82.79 2.4 Favored 'Trans proline' 0 CA--C 1.537 0.636 0 C-N-CA 120.904 1.07 . . . . 30.73 110.118 179.601 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 16.6 mm -63.61 -26.04 39.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 114.316 1.228 . . . . 32.509999999999998 114.316 -179.079 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 26.1 t -154.96 140.88 18.25 Favored 'General case' 0 C--O 1.24 0.557 0 N-CA-C 113.365 0.876 . . . . 27.109999999999999 113.365 179.544 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 94.7 mttt -83.05 -3.87 57.73 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-N 115.545 -0.752 . . . . 41.689999999999998 111.962 179.78 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' ARG . . . . . 0.572 ' NH1' ' OE1' ' A' ' 122' ' ' GLU . 22.7 mtp180 -81.03 -9.44 59.84 Favored 'General case' 0 C--O 1.222 -0.384 0 CA-C-O 119.288 -0.387 . . . . 39.659999999999997 110.208 -179.521 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 -105.3 112.78 26.01 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 118.175 -1.41 . . . . 18.09 109.734 177.713 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 17.6 m -133.84 158.13 42.33 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.328 0 CA-C-O 121.388 0.613 . . . . 29.07 111.84 179.565 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 31.8 p30 -95.01 -176.47 3.85 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 120.091 -0.644 . . . . 39.229999999999997 109.354 -179.902 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 14.3 pttp -50.0 -30.64 11.0 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 113.961 1.097 . . . . 88.900000000000006 113.961 -179.681 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -93.3 16.67 12.7 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 115.148 1.536 . . . . 60.979999999999997 115.148 -179.308 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 74.18 3.59 65.67 Favored Glycine 0 C--O 1.217 -0.917 0 N-CA-C 118.268 2.067 . . . . 35.100000000000001 118.268 178.775 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 16.6 m120 -87.86 144.15 26.74 Favored 'General case' 0 C--O 1.239 0.515 0 N-CA-C 113.643 0.979 . . . . 36.210000000000001 113.643 178.788 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 59.5 t -60.74 141.72 16.79 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.615 0 CA-C-N 115.001 -1.0 . . . . 27.329999999999998 110.005 -179.825 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 99.3 t -102.95 101.48 21.49 Favored Pre-proline 0 C--N 1.324 -0.521 0 N-CA-C 104.7 -2.333 . . . . 25.43 104.7 178.895 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_endo -71.18 154.84 61.82 Favored 'Trans proline' 0 C--N 1.344 0.328 0 N-CA-C 113.727 0.626 . . . . 21.260000000000002 113.727 -179.658 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -81.83 148.14 29.0 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 105.558 -2.015 . . . . 22.460000000000001 105.558 176.963 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 79.8 mt -111.33 119.44 59.75 Favored 'Isoleucine or valine' 0 C--O 1.264 1.824 0 N-CA-C 107.577 -1.268 . . . . 35.640000000000001 107.577 176.255 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 62.0 m-85 -108.54 156.03 19.97 Favored 'General case' 0 C--O 1.246 0.9 0 CA-C-N 114.686 -1.143 . . . . 23.539999999999999 109.147 179.705 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 43.3 tttm -163.3 113.05 1.33 Allowed 'General case' 0 CA--C 1.511 -0.547 0 N-CA-C 106.581 -1.637 . . . . 38.200000000000003 106.581 178.284 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -45.41 143.26 1.86 Allowed 'General case' 0 C--O 1.241 0.634 0 CA-C-O 122.412 1.101 . . . . 27.350000000000001 113.94 179.367 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 39.7 pt -94.58 -175.32 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 N-CA-C 105.387 -2.079 . . . . 36.149999999999999 105.387 177.754 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 44.8 p -88.27 163.08 16.27 Favored 'General case' 0 C--O 1.258 1.544 0 CA-C-O 122.435 1.112 . . . . 18.57 112.619 -177.42 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 95.7 m -66.86 -41.89 86.57 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 114.058 -1.428 . . . . 24.16 107.845 178.684 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 72.6 m-20 -55.5 -43.88 76.06 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 108.614 -0.884 . . . . 43.140000000000001 108.614 178.158 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 29.2 tpt180 -68.2 -34.18 75.79 Favored 'General case' 0 CA--C 1.511 -0.527 0 N-CA-C 114.28 1.215 . . . . 28.59 114.28 -177.16 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 61.1 mt -68.12 -27.07 35.89 Favored 'Isoleucine or valine' 0 C--O 1.245 0.849 0 N-CA-C 106.195 -1.78 . . . . 34.969999999999999 106.195 179.679 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 50.0 m-20 -71.32 -50.46 32.23 Favored 'General case' 0 C--O 1.218 -0.592 0 CA-C-N 115.275 -0.875 . . . . 61.490000000000002 110.812 179.179 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -60.33 -30.48 69.54 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 117.734 -1.587 . . . . 48.520000000000003 110.09 179.214 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 61.9 mt -69.37 -37.79 77.74 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 118.33 -1.348 . . . . 29.77 111.078 179.611 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' GLU . . . . . 0.431 ' O ' ' OG1' ' A' ' 62' ' ' THR . 12.4 tt0 -63.72 -50.44 69.13 Favored 'General case' 0 CA--C 1.509 -0.626 0 C-N-CA 118.658 -1.217 . . . . 62.850000000000001 108.715 -179.064 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 27.6 tttm -51.09 -54.27 26.55 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 108.303 -0.999 . . . . 80.629999999999995 108.303 178.346 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -52.32 -24.2 7.11 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 114.488 -1.233 . . . . 51.420000000000002 114.019 178.822 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 35.9 m-80 -118.83 28.22 8.42 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 115.089 1.515 . . . . 41.5 115.089 -179.581 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' THR . . . . . 0.431 ' OG1' ' O ' ' A' ' 58' ' ' GLU . 0.0 OUTLIER -124.73 149.74 46.96 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.126 -0.943 . . . . 62.840000000000003 109.31 178.886 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' THR . . . . . 0.607 ' N ' ' O ' ' A' ' 75' ' ' GLU . 1.5 p . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 115.426 -0.806 . . . . 76.709999999999994 109.722 -179.577 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' GLU . . . . . 0.607 ' O ' ' N ' ' A' ' 63' ' ' THR . 7.4 tp10 . . . . . 0 CA--C 1.537 0.463 0 N-CA-C 113.647 0.98 . . . . 98.390000000000001 113.647 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 3.2 tp -109.87 129.72 55.61 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 116.314 1.968 . . . . 56.509999999999998 116.314 -179.174 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 44.9 t0 -81.93 88.82 6.35 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 105.194 -2.15 . . . . 51.829999999999998 105.194 177.125 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 4.2 m -61.43 -51.36 69.04 Favored 'General case' 0 CA--C 1.509 -0.626 0 CA-C-O 121.304 0.573 . . . . 55.32 112.308 -177.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 1.7 tp60 -43.61 -54.34 5.04 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.669 -1.151 . . . . 58.920000000000002 109.448 -179.424 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' ARG . . . . . 0.465 ' O ' ' CG ' ' A' ' 84' ' ' ARG . 25.5 tpt180 -66.85 -43.13 84.46 Favored 'General case' 0 N--CA 1.434 -1.259 0 CA-C-N 113.702 -1.59 . . . . 50.82 111.808 -178.475 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 18.3 t80 -56.46 -52.89 62.99 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 124.298 1.039 . . . . 30.420000000000002 110.174 178.939 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -65.15 -37.76 88.42 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 113.322 0.86 . . . . 53.969999999999999 113.322 -179.316 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.17 -45.38 92.06 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 108.217 -1.031 . . . . 28.609999999999999 108.217 -179.085 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ARG . . . . . 0.465 ' CG ' ' O ' ' A' ' 80' ' ' ARG . 10.7 mmm-85 -61.15 -39.34 89.72 Favored 'General case' 0 C--O 1.217 -0.655 0 N-CA-C 108.392 -0.966 . . . . 41.299999999999997 108.392 -179.759 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 70.7 mt -59.7 -46.11 93.75 Favored 'Isoleucine or valine' 0 C--O 1.272 2.283 0 O-C-N 121.572 -0.705 . . . . 34.450000000000003 110.239 179.801 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -60.27 -47.95 83.8 Favored 'General case' 0 C--O 1.246 0.875 0 CA-C-N 114.659 -1.155 . . . . 19.100000000000001 110.962 -179.979 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 21.2 t -52.91 -49.2 49.48 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.865 0 C-N-CA 120.031 -0.668 . . . . 16.120000000000001 109.648 178.64 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 74.3 mt-10 -75.1 -25.43 58.5 Favored 'General case' 0 CA--C 1.563 1.453 0 N-CA-C 115.089 1.514 . . . . 34.939999999999998 115.089 -178.273 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 99.8 m -77.9 -15.1 59.29 Favored 'General case' 0 C--N 1.32 -0.688 0 O-C-N 121.255 -0.903 . . . . 17.300000000000001 109.128 176.148 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 93.5 m -95.8 107.52 19.76 Favored 'General case' 0 CA--C 1.501 -0.905 0 C-N-CA 119.322 -0.951 . . . . 20.030000000000001 112.82 -177.975 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 3.7 t -71.98 -42.52 68.47 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.148 0 N-CA-C 114.409 1.263 . . . . 22.710000000000001 114.409 -177.962 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' TYR . . . . . . . . . . . . . 60.5 t80 -145.64 117.46 5.1 Favored Pre-proline 0 C--O 1.249 1.032 0 N-CA-C 105.4 -2.074 . . . . 19.170000000000002 105.4 -179.739 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 0.4 OUTLIER -85.4 145.48 39.67 Favored 'Cis proline' 0 C--O 1.214 -0.714 0 C-N-CA 124.165 -1.181 . . . . 16.760000000000002 111.407 0.503 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 1.2 t -95.04 116.25 28.46 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 105.5 -2.037 . . . . 34.340000000000003 105.5 177.275 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 31.1 m-85 -66.72 -3.18 6.04 Favored 'General case' 0 C--O 1.245 0.844 0 N-CA-C 117.341 2.349 . . . . 16.710000000000001 117.341 -177.541 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -89.41 -12.47 40.2 Favored 'General case' 0 C--O 1.217 -0.634 0 CA-C-N 115.011 -0.995 . . . . 33.829999999999998 108.983 178.17 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -53.57 132.48 40.42 Favored 'General case' 0 CA--C 1.502 -0.902 0 CA-C-O 120.984 0.421 . . . . 18.969999999999999 110.725 -178.422 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 46.8 tptt -54.37 -40.57 68.25 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-N 115.033 -0.985 . . . . 46.350000000000001 110.473 178.667 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -59.55 -39.48 84.15 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 119.758 -0.777 . . . . 42.25 110.99 -177.844 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 53.8 mt -76.13 -35.31 59.31 Favored 'General case' 0 CA--C 1.503 -0.842 0 C-N-CA 119.667 -0.813 . . . . 19.260000000000002 111.114 179.458 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 34.6 mtm105 -64.92 -40.02 94.42 Favored 'General case' 0 C--O 1.246 0.9 0 C-N-CA 119.02 -1.072 . . . . 29.440000000000001 109.424 -179.809 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -63.87 -63.18 1.23 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.447 -0.797 . . . . 58.009999999999998 109.8 178.215 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -52.37 -40.44 62.02 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 116.617 2.08 . . . . 27.920000000000002 116.617 -176.775 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 50.9 m-85 -93.1 3.06 56.37 Favored 'General case' 0 N--CA 1.443 -0.776 0 C-N-CA 119.58 -0.848 . . . . 30.109999999999999 111.612 -178.774 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 11.3 mttp 52.82 55.6 8.76 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 118.274 2.694 . . . . 51.340000000000003 118.274 178.624 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 4.3 t -162.5 137.55 6.92 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.646 -0.872 . . . . 28.460000000000001 108.646 175.34 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 75.2 mm-40 -88.6 -3.89 58.7 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 115.845 -0.616 . . . . 32.539999999999999 110.83 -179.244 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 54.8 t0 -88.24 106.53 12.62 Favored Pre-proline 0 C--O 1.243 0.725 0 CA-C-N 115.876 -0.602 . . . . 31.809999999999999 109.67 179.423 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -54.36 -30.57 63.66 Favored 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 123.466 2.777 . . . . 22.23 112.606 -179.574 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 52.6 t -73.15 -31.92 36.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 121.323 0.583 . . . . 20.890000000000001 109.551 178.851 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 21.1 tp10 -75.81 -37.68 58.88 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 106.187 -1.783 . . . . 43.100000000000001 106.187 179.278 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 59.2 t -56.02 -47.05 80.76 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.738 0 N-CA-C 105.924 -1.88 . . . . 19.039999999999999 105.924 177.104 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -58.25 -43.99 88.09 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 119.557 -0.857 . . . . 15.449999999999999 112.073 179.87 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 56.3 mttm -66.21 -33.33 75.52 Favored 'General case' 0 C--O 1.217 -0.652 0 C-N-CA 119.575 -0.85 . . . . 43.789999999999999 112.554 -178.927 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -76.51 -32.72 58.47 Favored 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 118.82 -1.152 . . . . 23.199999999999999 111.065 176.971 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 81.7 t -74.55 -50.78 25.04 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 O-C-N 121.293 -0.879 . . . . 19.07 110.436 178.657 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 29.6 mt -89.11 64.6 7.1 Favored 'General case' 0 CA--C 1.551 0.985 0 N-CA-C 105.308 -2.108 . . . . 19.079999999999998 105.308 179.198 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 27.1 p -72.35 -0.21 11.76 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 119.033 2.975 . . . . 24.030000000000001 119.033 -176.045 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 55.1 t -102.72 120.27 52.27 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.7 0 N-CA-C 104.674 -2.343 . . . . 22.539999999999999 104.674 175.89 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -34.98 -63.21 0.53 Allowed Glycine 0 C--O 1.247 0.956 0 N-CA-C 115.905 1.122 . . . . 28.780000000000001 115.905 -177.343 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . -50.23 -40.34 36.99 Favored Glycine 0 C--O 1.218 -0.865 0 CA-C-O 118.976 -0.902 . . . . 22.149999999999999 113.668 -178.963 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' GLU . . . . . 0.572 ' OE1' ' NH1' ' A' ' 33' ' ' ARG . 89.9 mt-10 -61.91 -46.99 86.94 Favored 'General case' 0 C--O 1.224 -0.259 0 CA-C-N 118.26 1.03 . . . . 27.149999999999999 109.883 -179.524 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' TYR . . . . . . . . . . . . . 71.6 t80 -60.42 -43.23 96.95 Favored 'General case' 0 N--CA 1.433 -1.283 0 C-N-CA 119.083 -1.047 . . . . 22.010000000000002 112.19 -179.311 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -66.86 -39.18 87.48 Favored 'General case' 0 C--O 1.217 -0.656 0 N-CA-C 109.011 -0.736 . . . . 25.949999999999999 109.011 -178.115 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -67.32 -38.95 85.75 Favored 'General case' 0 CA--C 1.507 -0.676 0 CA-C-N 116.348 -0.387 . . . . 38.149999999999999 110.959 -179.179 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 42.2 t90 -61.31 -46.68 89.29 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.109 -0.636 . . . . 21.800000000000001 109.367 179.105 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 16.9 mt -56.81 -52.89 63.29 Favored 'General case' 0 CA--C 1.494 -1.2 0 CA-C-N 116.087 -0.506 . . . . 26.039999999999999 110.811 -179.618 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 62.5 m-20 -62.9 -40.11 96.56 Favored 'General case' 0 C--O 1.216 -0.683 0 C-N-CA 118.906 -1.118 . . . . 41.759999999999998 113.148 -178.765 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 12.7 tptt -59.01 -41.65 88.24 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 117.72 -1.592 . . . . 39.020000000000003 109.842 179.477 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -60.8 -47.0 88.3 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.902 -0.59 . . . . 29.309999999999999 110.78 -179.222 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 25.8 mm -60.72 -39.36 81.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 N-CA-C 108.744 -0.836 . . . . 32.57 108.744 -179.847 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -69.64 -44.72 70.01 Favored 'General case' 0 N--CA 1.444 -0.772 0 CA-C-N 115.079 -0.964 . . . . 59.350000000000001 110.232 -179.801 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' ILE . . . . . . . . . . . . . 9.9 mm -57.73 -23.76 21.17 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.416 0 N-CA-C 111.9 0.333 . . . . 37.039999999999999 111.9 178.78 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 52.8 m-80 -94.54 23.71 5.1 Favored 'General case' 0 N--CA 1.446 -0.668 0 O-C-N 121.697 -0.627 . . . . 25.859999999999999 110.824 -179.639 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 67.51 8.11 50.01 Favored Glycine 0 C--O 1.224 -0.518 0 N-CA-C 118.164 2.026 . . . . 34.710000000000001 118.164 -179.631 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 64.3 m-85 -82.93 116.96 22.44 Favored 'General case' 0 C--N 1.321 -0.652 0 O-C-N 120.258 -1.731 . . . . 45.850000000000001 112.467 179.653 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 22.2 t70 . . . . . 0 C--N 1.327 -0.407 0 C-N-CA 120.511 -0.476 . . . . 117.95 111.026 179.588 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 158' ' ' ' MN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 159' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 160' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 161' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 162' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 163' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 164' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 165' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 166' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 167' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 168' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 169' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 170' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 171' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 172' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 173' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 174' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 176' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 177' ' ' HOH . . . . . 0.463 ' O ' ' NH2' ' A' ' 80' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 178' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 179' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 181' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 182' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 183' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 184' ' ' HOH . . . . . 0.434 ' O ' ' NH1' ' A' ' 84' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 185' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 186' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 8' ' ' LYS . . . . . 0.491 ' O ' ' HG2' ' A' ' 8' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.747 0 CA-C-O 120.529 0.204 . . . . 114.26000000000001 111.205 . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 9' ' ' VAL . . . . . 0.505 ' O ' HG13 ' A' ' 9' ' ' VAL . 9.9 p 20.74 101.18 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 N-CA-C 114.123 1.157 . . . . 114.45999999999999 114.123 -179.587 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 10' ' ' TYR . . . . . 0.401 ' CZ ' ' HD3' ' A' ' 8' ' ' LYS . 57.3 m-85 -76.27 138.16 40.38 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 114.968 -1.015 . . . . 55.57 112.77 -179.879 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 63.8 t0 -91.87 100.09 12.83 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 113.694 0.998 . . . . 38.549999999999997 113.694 -178.387 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 69.6 mt -87.9 1.91 52.85 Favored 'General case' 0 N--CA 1.434 -1.247 0 N-CA-C 116.883 2.179 . . . . 22.390000000000001 116.883 -177.521 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 35.3 p -59.07 -30.75 68.29 Favored 'General case' 0 CA--C 1.54 0.582 0 O-C-N 120.787 -1.196 . . . . 29.0 111.313 -179.342 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' PHE . . . . . 0.496 ' HA ' ' HG2' ' A' ' 19' ' ' GLN . 18.7 m-85 -65.54 -20.61 66.4 Favored 'General case' 0 CA--C 1.508 -0.646 0 N-CA-C 116.113 1.894 . . . . 28.620000000000001 116.113 -178.176 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 70.4 m-85 -102.76 23.54 11.94 Favored 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 120.24 -0.584 . . . . 21.82 110.167 179.623 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' MSE . . . . . 0.642 ' HB3' ' HD2' ' A' ' 17' ' ' PRO . 30.9 mtt -120.67 150.87 53.42 Favored Pre-proline 0 N--CA 1.439 -1.0 0 C-N-CA 118.252 -1.379 . . . . 84.140000000000001 113.022 178.966 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 17' ' ' PRO . . . . . 0.642 ' HD2' ' HB3' ' A' ' 16' ' ' MSE . 68.6 Cg_endo -37.03 -44.49 1.17 Allowed 'Trans proline' 0 N--CA 1.471 0.196 1 C-N-CA 126.397 4.731 . . . . 57.07 115.477 -179.268 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 18' ' ' GLY . . . . . 0.516 ' O ' ' HB2' ' A' ' 19' ' ' GLN . . . -72.74 53.88 1.66 Allowed Glycine 0 N--CA 1.446 -0.684 0 N-CA-C 105.703 -2.959 . . . . 113.91 105.703 178.23 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 19' ' ' GLN . . . . . 0.516 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 1.7 tp-100 172.14 -79.06 0.0 OUTLIER 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 117.493 2.405 . . . . 91.670000000000002 117.493 -178.716 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 20' ' ' THR . . . . . 0.494 ' N ' ' HG3' ' A' ' 19' ' ' GLN . 4.3 p -32.71 112.62 0.12 Allowed 'General case' 0 CA--C 1.511 -0.547 0 N-CA-C 112.541 0.571 . . . . 43.140000000000001 112.541 -177.734 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 80.5 mt -47.97 138.44 3.05 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.318 0 O-C-N 124.271 0.982 . . . . 60.350000000000001 108.688 178.573 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -98.35 164.87 12.11 Favored 'General case' 0 N--CA 1.425 -1.702 0 C-N-CA 115.131 -2.628 . . . . 76.849999999999994 114.152 -179.099 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -55.22 137.86 46.27 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 113.445 -1.707 . . . . 55.149999999999999 114.86 179.89 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' GLU . . . . . 0.697 ' OE1' ' HA ' ' A' ' 47' ' ' LYS . 0.0 OUTLIER -27.93 -127.26 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.964 1 N-CA-C 123.348 4.573 . . . . 138.36000000000001 123.348 178.765 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 137.08 84.28 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.616 1 N-CA-C 94.207 -6.22 . . . . 56.289999999999999 94.207 -177.889 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 26' ' ' VAL . . . . . 0.637 HG23 ' HB2' ' A' ' 24' ' ' GLU . 72.9 t -98.71 125.05 52.21 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 CA-C-N 113.552 -1.658 . . . . 30.289999999999999 111.896 -177.305 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -89.93 135.21 33.78 Favored 'General case' 0 C--O 1.221 -0.401 0 N-CA-C 108.437 -0.949 . . . . 61.539999999999999 108.437 178.935 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 48.7 t -143.81 125.08 8.07 Favored Pre-proline 0 C--O 1.242 0.66 0 N-CA-C 109.0 -0.741 . . . . 31.91 109.0 -177.965 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -79.67 82.79 2.4 Favored 'Trans proline' 0 CA--C 1.537 0.636 0 C-N-CA 120.904 1.07 . . . . 30.73 110.118 179.601 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 16.6 mm -63.61 -26.04 39.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 114.316 1.228 . . . . 32.509999999999998 114.316 -179.079 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 26.1 t -154.96 140.88 18.25 Favored 'General case' 0 C--O 1.24 0.557 0 N-CA-C 113.365 0.876 . . . . 27.109999999999999 113.365 179.544 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 94.7 mttt -83.05 -3.87 57.73 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-N 115.545 -0.752 . . . . 41.689999999999998 111.962 179.78 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' ARG . . . . . 0.572 ' NH1' ' OE1' ' A' ' 122' ' ' GLU . 22.7 mtp180 -81.03 -9.44 59.84 Favored 'General case' 0 C--O 1.222 -0.384 0 CA-C-O 119.288 -0.387 . . . . 39.659999999999997 110.208 -179.521 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 -105.3 112.78 26.01 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 118.175 -1.41 . . . . 18.09 109.734 177.713 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 17.6 m -133.84 158.13 42.33 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.328 0 CA-C-O 121.388 0.613 . . . . 29.07 111.84 179.565 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 31.8 p30 -95.01 -176.47 3.85 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 120.091 -0.644 . . . . 39.229999999999997 109.354 -179.902 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' LYS . . . . . 0.495 ' NZ ' ' HG3' ' A' ' 38' ' ' GLU . 14.3 pttp -50.0 -30.64 11.0 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 113.961 1.097 . . . . 88.900000000000006 113.961 -179.681 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 38' ' ' GLU . . . . . 0.495 ' HG3' ' NZ ' ' A' ' 37' ' ' LYS . 28.8 mt-10 -93.3 16.67 12.7 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 115.148 1.536 . . . . 60.979999999999997 115.148 -179.308 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 74.18 3.59 65.67 Favored Glycine 0 C--O 1.217 -0.917 0 N-CA-C 118.268 2.067 . . . . 35.100000000000001 118.268 178.775 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 -87.86 144.15 26.74 Favored 'General case' 0 C--O 1.239 0.515 0 N-CA-C 113.643 0.979 . . . . 36.210000000000001 113.643 178.788 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 59.5 t -60.74 141.72 16.79 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.615 0 CA-C-N 115.001 -1.0 . . . . 27.329999999999998 110.005 -179.825 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 99.3 t -102.95 101.48 21.49 Favored Pre-proline 0 C--N 1.324 -0.521 0 N-CA-C 104.7 -2.333 . . . . 25.43 104.7 178.895 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_endo -71.18 154.84 61.82 Favored 'Trans proline' 0 C--N 1.344 0.328 0 N-CA-C 113.727 0.626 . . . . 21.260000000000002 113.727 -179.658 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -81.83 148.14 29.0 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 105.558 -2.015 . . . . 22.460000000000001 105.558 176.963 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 79.8 mt -111.33 119.44 59.75 Favored 'Isoleucine or valine' 0 C--O 1.264 1.824 0 N-CA-C 107.577 -1.268 . . . . 35.640000000000001 107.577 176.255 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 62.0 m-85 -108.54 156.03 19.97 Favored 'General case' 0 C--O 1.246 0.9 0 CA-C-N 114.686 -1.143 . . . . 23.539999999999999 109.147 179.705 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' LYS . . . . . 0.697 ' HA ' ' OE1' ' A' ' 24' ' ' GLU . 43.3 tttm -163.3 113.05 1.33 Allowed 'General case' 0 CA--C 1.511 -0.547 0 N-CA-C 106.581 -1.637 . . . . 38.200000000000003 106.581 178.284 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -45.41 143.26 1.86 Allowed 'General case' 0 C--O 1.241 0.634 0 CA-C-O 122.412 1.101 . . . . 27.350000000000001 113.94 179.367 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 39.7 pt -94.58 -175.32 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 N-CA-C 105.387 -2.079 . . . . 36.149999999999999 105.387 177.754 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 44.8 p -88.27 163.08 16.27 Favored 'General case' 0 C--O 1.258 1.544 0 CA-C-O 122.435 1.112 . . . . 18.57 112.619 -177.42 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 95.7 m -66.86 -41.89 86.57 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 114.058 -1.428 . . . . 24.16 107.845 178.684 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 72.6 m-20 -55.5 -43.88 76.06 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 108.614 -0.884 . . . . 43.140000000000001 108.614 178.158 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 29.2 tpt180 -68.2 -34.18 75.79 Favored 'General case' 0 CA--C 1.511 -0.527 0 N-CA-C 114.28 1.215 . . . . 28.59 114.28 -177.16 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 61.1 mt -68.12 -27.07 35.89 Favored 'Isoleucine or valine' 0 C--O 1.245 0.849 0 N-CA-C 106.195 -1.78 . . . . 34.969999999999999 106.195 179.679 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 50.0 m-20 -71.32 -50.46 32.23 Favored 'General case' 0 C--O 1.218 -0.592 0 CA-C-N 115.275 -0.875 . . . . 61.490000000000002 110.812 179.179 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' GLU . . . . . 0.471 ' O ' ' HB2' ' A' ' 60' ' ' GLU . 2.0 mt-10 -60.33 -30.48 69.54 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 117.734 -1.587 . . . . 48.520000000000003 110.09 179.214 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 61.9 mt -69.37 -37.79 77.74 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 118.33 -1.348 . . . . 29.77 111.078 179.611 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -63.72 -50.44 69.13 Favored 'General case' 0 CA--C 1.509 -0.626 0 C-N-CA 118.658 -1.217 . . . . 62.850000000000001 108.715 -179.064 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 27.6 tttm -51.09 -54.27 26.55 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 108.303 -0.999 . . . . 80.629999999999995 108.303 178.346 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' GLU . . . . . 0.471 ' HB2' ' O ' ' A' ' 56' ' ' GLU . 5.5 tt0 -52.32 -24.2 7.11 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 114.488 -1.233 . . . . 51.420000000000002 114.019 178.822 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 35.9 m-80 -118.83 28.22 8.42 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 115.089 1.515 . . . . 41.5 115.089 -179.581 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' THR . . . . . 0.744 ' CG2' ' HB2' ' A' ' 76' ' ' LEU . 0.0 OUTLIER -124.73 149.74 46.96 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.126 -0.943 . . . . 62.840000000000003 109.31 178.886 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 63' ' ' THR . . . . . 0.664 HG23 ' O ' ' A' ' 62' ' ' THR . 1.5 p . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 115.426 -0.806 . . . . 76.709999999999994 109.722 -179.577 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' GLU . . . . . 0.556 ' O ' ' N ' ' A' ' 63' ' ' THR . 7.4 tp10 . . . . . 0 CA--C 1.537 0.463 0 N-CA-C 113.647 0.98 . . . . 98.390000000000001 113.647 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' LEU . . . . . 0.744 ' HB2' ' CG2' ' A' ' 62' ' ' THR . 3.2 tp -109.87 129.72 55.61 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 116.314 1.968 . . . . 56.509999999999998 116.314 -179.174 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 44.9 t0 -81.93 88.82 6.35 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 105.194 -2.15 . . . . 51.829999999999998 105.194 177.125 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 4.2 m -61.43 -51.36 69.04 Favored 'General case' 0 CA--C 1.509 -0.626 0 CA-C-O 121.304 0.573 . . . . 55.32 112.308 -177.921 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 1.7 tp60 -43.61 -54.34 5.04 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.669 -1.151 . . . . 58.920000000000002 109.448 -179.424 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' ARG . . . . . 0.822 ' O ' ' HG2' ' A' ' 84' ' ' ARG . 25.5 tpt180 -66.85 -43.13 84.46 Favored 'General case' 0 N--CA 1.434 -1.259 0 CA-C-N 113.702 -1.59 . . . . 50.82 111.808 -178.475 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 18.3 t80 -56.46 -52.89 62.99 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 124.298 1.039 . . . . 30.420000000000002 110.174 178.939 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -65.15 -37.76 88.42 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 113.322 0.86 . . . . 53.969999999999999 113.322 -179.316 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.17 -45.38 92.06 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 108.217 -1.031 . . . . 28.609999999999999 108.217 -179.085 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ARG . . . . . 0.822 ' HG2' ' O ' ' A' ' 80' ' ' ARG . 10.7 mmm-85 -61.15 -39.34 89.72 Favored 'General case' 0 C--O 1.217 -0.655 0 N-CA-C 108.392 -0.966 . . . . 41.299999999999997 108.392 -179.759 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 70.7 mt -59.7 -46.11 93.75 Favored 'Isoleucine or valine' 0 C--O 1.272 2.283 0 O-C-N 121.572 -0.705 . . . . 34.450000000000003 110.239 179.801 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -60.27 -47.95 83.8 Favored 'General case' 0 C--O 1.246 0.875 0 CA-C-N 114.659 -1.155 . . . . 19.100000000000001 110.962 -179.979 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 21.2 t -52.91 -49.2 49.48 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.865 0 C-N-CA 120.031 -0.668 . . . . 16.120000000000001 109.648 178.64 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 74.3 mt-10 -75.1 -25.43 58.5 Favored 'General case' 0 CA--C 1.563 1.453 0 N-CA-C 115.089 1.514 . . . . 34.939999999999998 115.089 -178.273 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 99.8 m -77.9 -15.1 59.29 Favored 'General case' 0 C--N 1.32 -0.688 0 O-C-N 121.255 -0.903 . . . . 17.300000000000001 109.128 176.148 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 93.5 m -95.8 107.52 19.76 Favored 'General case' 0 CA--C 1.501 -0.905 0 C-N-CA 119.322 -0.951 . . . . 20.030000000000001 112.82 -177.975 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 3.7 t -71.98 -42.52 68.47 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.148 0 N-CA-C 114.409 1.263 . . . . 22.710000000000001 114.409 -177.962 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' TYR . . . . . . . . . . . . . 60.5 t80 -145.64 117.46 5.1 Favored Pre-proline 0 C--O 1.249 1.032 0 N-CA-C 105.4 -2.074 . . . . 19.170000000000002 105.4 -179.739 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 0.4 OUTLIER -85.4 145.48 39.67 Favored 'Cis proline' 0 C--O 1.214 -0.714 0 C-N-CA 124.165 -1.181 . . . . 16.760000000000002 111.407 0.503 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 1.2 t -95.04 116.25 28.46 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 105.5 -2.037 . . . . 34.340000000000003 105.5 177.275 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 31.1 m-85 -66.72 -3.18 6.04 Favored 'General case' 0 C--O 1.245 0.844 0 N-CA-C 117.341 2.349 . . . . 16.710000000000001 117.341 -177.541 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -89.41 -12.47 40.2 Favored 'General case' 0 C--O 1.217 -0.634 0 CA-C-N 115.011 -0.995 . . . . 33.829999999999998 108.983 178.17 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -53.57 132.48 40.42 Favored 'General case' 0 CA--C 1.502 -0.902 0 CA-C-O 120.984 0.421 . . . . 18.969999999999999 110.725 -178.422 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 46.8 tptt -54.37 -40.57 68.25 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-N 115.033 -0.985 . . . . 46.350000000000001 110.473 178.667 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -59.55 -39.48 84.15 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 119.758 -0.777 . . . . 42.25 110.99 -177.844 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 53.8 mt -76.13 -35.31 59.31 Favored 'General case' 0 CA--C 1.503 -0.842 0 C-N-CA 119.667 -0.813 . . . . 19.260000000000002 111.114 179.458 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 34.6 mtm105 -64.92 -40.02 94.42 Favored 'General case' 0 C--O 1.246 0.9 0 C-N-CA 119.02 -1.072 . . . . 29.440000000000001 109.424 -179.809 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -63.87 -63.18 1.23 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.447 -0.797 . . . . 58.009999999999998 109.8 178.215 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -52.37 -40.44 62.02 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 116.617 2.08 . . . . 27.920000000000002 116.617 -176.775 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 50.9 m-85 -93.1 3.06 56.37 Favored 'General case' 0 N--CA 1.443 -0.776 0 C-N-CA 119.58 -0.848 . . . . 30.109999999999999 111.612 -178.774 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 11.3 mttp 52.82 55.6 8.76 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 118.274 2.694 . . . . 51.340000000000003 118.274 178.624 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 4.3 t -162.5 137.55 6.92 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.646 -0.872 . . . . 28.460000000000001 108.646 175.34 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 75.2 mm-40 -88.6 -3.89 58.7 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 115.845 -0.616 . . . . 32.539999999999999 110.83 -179.244 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 54.8 t0 -88.24 106.53 12.62 Favored Pre-proline 0 C--O 1.243 0.725 0 CA-C-N 115.876 -0.602 . . . . 31.809999999999999 109.67 179.423 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -54.36 -30.57 63.66 Favored 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 123.466 2.777 . . . . 22.23 112.606 -179.574 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 52.6 t -73.15 -31.92 36.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 121.323 0.583 . . . . 20.890000000000001 109.551 178.851 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 21.1 tp10 -75.81 -37.68 58.88 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 106.187 -1.783 . . . . 43.100000000000001 106.187 179.278 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 59.2 t -56.02 -47.05 80.76 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.738 0 N-CA-C 105.924 -1.88 . . . . 19.039999999999999 105.924 177.104 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -58.25 -43.99 88.09 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 119.557 -0.857 . . . . 15.449999999999999 112.073 179.87 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 56.3 mttm -66.21 -33.33 75.52 Favored 'General case' 0 C--O 1.217 -0.652 0 C-N-CA 119.575 -0.85 . . . . 43.789999999999999 112.554 -178.927 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -76.51 -32.72 58.47 Favored 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 118.82 -1.152 . . . . 23.199999999999999 111.065 176.971 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 81.7 t -74.55 -50.78 25.04 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 O-C-N 121.293 -0.879 . . . . 19.07 110.436 178.657 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 29.6 mt -89.11 64.6 7.1 Favored 'General case' 0 CA--C 1.551 0.985 0 N-CA-C 105.308 -2.108 . . . . 19.079999999999998 105.308 179.198 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 27.1 p -72.35 -0.21 11.76 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 119.033 2.975 . . . . 24.030000000000001 119.033 -176.045 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 55.1 t -102.72 120.27 52.27 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.7 0 N-CA-C 104.674 -2.343 . . . . 22.539999999999999 104.674 175.89 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -34.98 -63.21 0.53 Allowed Glycine 0 C--O 1.247 0.956 0 N-CA-C 115.905 1.122 . . . . 28.780000000000001 115.905 -177.343 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . -50.23 -40.34 36.99 Favored Glycine 0 C--O 1.218 -0.865 0 CA-C-O 118.976 -0.902 . . . . 22.149999999999999 113.668 -178.963 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' GLU . . . . . 0.572 ' OE1' ' NH1' ' A' ' 33' ' ' ARG . 89.9 mt-10 -61.91 -46.99 86.94 Favored 'General case' 0 C--O 1.224 -0.259 0 CA-C-N 118.26 1.03 . . . . 27.149999999999999 109.883 -179.524 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 123' ' ' TYR . . . . . . . . . . . . . 71.6 t80 -60.42 -43.23 96.95 Favored 'General case' 0 N--CA 1.433 -1.283 0 C-N-CA 119.083 -1.047 . . . . 22.010000000000002 112.19 -179.311 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -66.86 -39.18 87.48 Favored 'General case' 0 C--O 1.217 -0.656 0 N-CA-C 109.011 -0.736 . . . . 25.949999999999999 109.011 -178.115 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -67.32 -38.95 85.75 Favored 'General case' 0 CA--C 1.507 -0.676 0 CA-C-N 116.348 -0.387 . . . . 38.149999999999999 110.959 -179.179 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 42.2 t90 -61.31 -46.68 89.29 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.109 -0.636 . . . . 21.800000000000001 109.367 179.105 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' LEU . . . . . 0.412 ' O ' HG12 ' A' ' 131' ' ' ILE . 16.9 mt -56.81 -52.89 63.29 Favored 'General case' 0 CA--C 1.494 -1.2 0 CA-C-N 116.087 -0.506 . . . . 26.039999999999999 110.811 -179.618 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 62.5 m-20 -62.9 -40.11 96.56 Favored 'General case' 0 C--O 1.216 -0.683 0 C-N-CA 118.906 -1.118 . . . . 41.759999999999998 113.148 -178.765 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 12.7 tptt -59.01 -41.65 88.24 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 117.72 -1.592 . . . . 39.020000000000003 109.842 179.477 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -60.8 -47.0 88.3 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.902 -0.59 . . . . 29.309999999999999 110.78 -179.222 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' ILE . . . . . 0.412 HG12 ' O ' ' A' ' 127' ' ' LEU . 25.8 mm -60.72 -39.36 81.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 N-CA-C 108.744 -0.836 . . . . 32.57 108.744 -179.847 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -69.64 -44.72 70.01 Favored 'General case' 0 N--CA 1.444 -0.772 0 CA-C-N 115.079 -0.964 . . . . 59.350000000000001 110.232 -179.801 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' ILE . . . . . . . . . . . . . 9.9 mm -57.73 -23.76 21.17 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.416 0 N-CA-C 111.9 0.333 . . . . 37.039999999999999 111.9 178.78 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 52.8 m-80 -94.54 23.71 5.1 Favored 'General case' 0 N--CA 1.446 -0.668 0 O-C-N 121.697 -0.627 . . . . 25.859999999999999 110.824 -179.639 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 67.51 8.11 50.01 Favored Glycine 0 C--O 1.224 -0.518 0 N-CA-C 118.164 2.026 . . . . 34.710000000000001 118.164 -179.631 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 64.3 m-85 -82.93 116.96 22.44 Favored 'General case' 0 C--N 1.321 -0.652 0 O-C-N 120.258 -1.731 . . . . 45.850000000000001 112.467 179.653 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 22.2 t70 . . . . . 0 C--N 1.327 -0.407 0 C-N-CA 120.511 -0.476 . . . . 117.95 111.026 179.588 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 158' ' ' ' MN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 159' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 160' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 161' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 162' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 163' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 164' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 165' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 166' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 167' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 168' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 169' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 170' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 171' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 172' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 173' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 174' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 176' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 177' ' ' HOH . . . . . 0.463 ' O ' ' NH2' ' A' ' 80' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 178' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 179' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 181' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 182' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 183' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 184' ' ' HOH . . . . . 0.434 ' O ' ' NH1' ' A' ' 84' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 185' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 186' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.491 ' O ' ' HG2' ' A' ' 8' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.747 0 CA-C-O 120.529 0.204 . . . . 114.26000000000001 111.205 . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.505 ' O ' HG13 ' A' ' 9' ' ' VAL . 9.9 p 20.74 101.18 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 N-CA-C 114.123 1.157 . . . . 114.45999999999999 114.123 -179.587 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.401 ' CZ ' ' HD3' ' A' ' 8' ' ' LYS . 57.3 m-85 -76.27 138.16 40.38 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 114.968 -1.015 . . . . 55.57 112.77 -179.879 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 63.8 t0 -91.87 100.09 12.83 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 113.694 0.998 . . . . 38.549999999999997 113.694 -178.387 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 69.6 mt -87.9 1.91 52.85 Favored 'General case' 0 N--CA 1.434 -1.247 0 N-CA-C 116.883 2.179 . . . . 22.390000000000001 116.883 -177.521 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 35.3 p -59.07 -30.75 68.29 Favored 'General case' 0 CA--C 1.54 0.582 0 O-C-N 120.787 -1.196 . . . . 29.0 111.313 -179.342 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.496 ' HA ' ' HG2' ' A' ' 19' ' ' GLN . 18.7 m-85 -65.54 -20.61 66.4 Favored 'General case' 0 CA--C 1.508 -0.646 0 N-CA-C 116.113 1.894 . . . . 28.620000000000001 116.113 -178.176 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 70.4 m-85 -102.76 23.54 11.94 Favored 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 120.24 -0.584 . . . . 21.82 110.167 179.623 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' MSE . . . . . 0.642 ' HB3' ' HD2' ' A' ' 17' ' ' PRO . 30.9 mtt -120.67 150.87 53.42 Favored Pre-proline 0 N--CA 1.439 -1.0 0 C-N-CA 118.252 -1.379 . . . . 84.140000000000001 113.022 178.966 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.642 ' HD2' ' HB3' ' A' ' 16' ' ' MSE . 68.6 Cg_endo -37.03 -44.49 1.17 Allowed 'Trans proline' 0 N--CA 1.471 0.196 1 C-N-CA 126.397 4.731 . . . . 57.07 115.477 -179.268 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' GLY . . . . . 0.516 ' O ' ' HB2' ' A' ' 19' ' ' GLN . . . -72.74 53.88 1.66 Allowed Glycine 0 N--CA 1.446 -0.684 0 N-CA-C 105.703 -2.959 . . . . 113.91 105.703 178.23 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.516 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 1.7 tp-100 172.14 -79.06 0.0 OUTLIER 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 117.493 2.405 . . . . 91.670000000000002 117.493 -178.716 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' THR . . . . . 0.494 ' N ' ' HG3' ' A' ' 19' ' ' GLN . 4.3 p -32.71 112.62 0.12 Allowed 'General case' 0 CA--C 1.511 -0.547 0 N-CA-C 112.541 0.571 . . . . 43.140000000000001 112.541 -177.734 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 80.5 mt -47.97 138.44 3.05 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.318 0 O-C-N 124.271 0.982 . . . . 60.350000000000001 108.688 178.573 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -98.35 164.87 12.11 Favored 'General case' 0 N--CA 1.425 -1.702 0 C-N-CA 115.131 -2.628 . . . . 76.849999999999994 114.152 -179.099 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -55.22 137.86 46.27 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 113.445 -1.707 . . . . 55.149999999999999 114.86 179.89 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.697 ' OE1' ' HA ' ' A' ' 47' ' ' LYS . 0.0 OUTLIER -27.93 -127.26 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.964 1 N-CA-C 123.348 4.573 . . . . 138.36000000000001 123.348 178.765 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 137.08 84.28 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.616 1 N-CA-C 94.207 -6.22 . . . . 56.289999999999999 94.207 -177.889 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.637 HG23 ' HB2' ' A' ' 24' ' ' GLU . 72.9 t -98.71 125.05 52.21 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 CA-C-N 113.552 -1.658 . . . . 30.289999999999999 111.896 -177.305 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -89.93 135.21 33.78 Favored 'General case' 0 C--O 1.221 -0.401 0 N-CA-C 108.437 -0.949 . . . . 61.539999999999999 108.437 178.935 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 48.7 t -143.81 125.08 8.07 Favored Pre-proline 0 C--O 1.242 0.66 0 N-CA-C 109.0 -0.741 . . . . 31.91 109.0 -177.965 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -79.67 82.79 2.4 Favored 'Trans proline' 0 CA--C 1.537 0.636 0 C-N-CA 120.904 1.07 . . . . 30.73 110.118 179.601 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 16.6 mm -63.61 -26.04 39.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 114.316 1.228 . . . . 32.509999999999998 114.316 -179.079 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 26.1 t -154.96 140.88 18.25 Favored 'General case' 0 C--O 1.24 0.557 0 N-CA-C 113.365 0.876 . . . . 27.109999999999999 113.365 179.544 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 94.7 mttt -83.05 -3.87 57.73 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-N 115.545 -0.752 . . . . 41.689999999999998 111.962 179.78 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.572 ' NH1' ' OE1' ' A' ' 122' ' ' GLU . 22.7 mtp180 -81.03 -9.44 59.84 Favored 'General case' 0 C--O 1.222 -0.384 0 CA-C-O 119.288 -0.387 . . . . 39.659999999999997 110.208 -179.521 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 -105.3 112.78 26.01 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 118.175 -1.41 . . . . 18.09 109.734 177.713 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 17.6 m -133.84 158.13 42.33 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.328 0 CA-C-O 121.388 0.613 . . . . 29.07 111.84 179.565 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 31.8 p30 -95.01 -176.47 3.85 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 120.091 -0.644 . . . . 39.229999999999997 109.354 -179.902 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.495 ' NZ ' ' HG3' ' A' ' 38' ' ' GLU . 14.3 pttp -50.0 -30.64 11.0 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 113.961 1.097 . . . . 88.900000000000006 113.961 -179.681 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.495 ' HG3' ' NZ ' ' A' ' 37' ' ' LYS . 28.8 mt-10 -93.3 16.67 12.7 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 115.148 1.536 . . . . 60.979999999999997 115.148 -179.308 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 74.18 3.59 65.67 Favored Glycine 0 C--O 1.217 -0.917 0 N-CA-C 118.268 2.067 . . . . 35.100000000000001 118.268 178.775 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 16.6 m120 -87.86 144.15 26.74 Favored 'General case' 0 C--O 1.239 0.515 0 N-CA-C 113.643 0.979 . . . . 36.210000000000001 113.643 178.788 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 59.5 t -60.74 141.72 16.79 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.615 0 CA-C-N 115.001 -1.0 . . . . 27.329999999999998 110.005 -179.825 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 99.3 t -102.95 101.48 21.49 Favored Pre-proline 0 C--N 1.324 -0.521 0 N-CA-C 104.7 -2.333 . . . . 25.43 104.7 178.895 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_endo -71.18 154.84 61.82 Favored 'Trans proline' 0 C--N 1.344 0.328 0 N-CA-C 113.727 0.626 . . . . 21.260000000000002 113.727 -179.658 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -81.83 148.14 29.0 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 105.558 -2.015 . . . . 22.460000000000001 105.558 176.963 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 79.8 mt -111.33 119.44 59.75 Favored 'Isoleucine or valine' 0 C--O 1.264 1.824 0 N-CA-C 107.577 -1.268 . . . . 35.640000000000001 107.577 176.255 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 62.0 m-85 -108.54 156.03 19.97 Favored 'General case' 0 C--O 1.246 0.9 0 CA-C-N 114.686 -1.143 . . . . 23.539999999999999 109.147 179.705 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.697 ' HA ' ' OE1' ' A' ' 24' ' ' GLU . 43.3 tttm -163.3 113.05 1.33 Allowed 'General case' 0 CA--C 1.511 -0.547 0 N-CA-C 106.581 -1.637 . . . . 38.200000000000003 106.581 178.284 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -45.41 143.26 1.86 Allowed 'General case' 0 C--O 1.241 0.634 0 CA-C-O 122.412 1.101 . . . . 27.350000000000001 113.94 179.367 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 39.7 pt -94.58 -175.32 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 N-CA-C 105.387 -2.079 . . . . 36.149999999999999 105.387 177.754 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 44.8 p -88.27 163.08 16.27 Favored 'General case' 0 C--O 1.258 1.544 0 CA-C-O 122.435 1.112 . . . . 18.57 112.619 -177.42 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 95.7 m -66.86 -41.89 86.57 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 114.058 -1.428 . . . . 24.16 107.845 178.684 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 72.6 m-20 -55.5 -43.88 76.06 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 108.614 -0.884 . . . . 43.140000000000001 108.614 178.158 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 29.2 tpt180 -68.2 -34.18 75.79 Favored 'General case' 0 CA--C 1.511 -0.527 0 N-CA-C 114.28 1.215 . . . . 28.59 114.28 -177.16 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 61.1 mt -68.12 -27.07 35.89 Favored 'Isoleucine or valine' 0 C--O 1.245 0.849 0 N-CA-C 106.195 -1.78 . . . . 34.969999999999999 106.195 179.679 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 50.0 m-20 -71.32 -50.46 32.23 Favored 'General case' 0 C--O 1.218 -0.592 0 CA-C-N 115.275 -0.875 . . . . 61.490000000000002 110.812 179.179 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.471 ' O ' ' HB2' ' A' ' 60' ' ' GLU . 2.0 mt-10 -60.33 -30.48 69.54 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 117.734 -1.587 . . . . 48.520000000000003 110.09 179.214 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 61.9 mt -69.37 -37.79 77.74 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 118.33 -1.348 . . . . 29.77 111.078 179.611 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -63.72 -50.44 69.13 Favored 'General case' 0 CA--C 1.509 -0.626 0 C-N-CA 118.658 -1.217 . . . . 62.850000000000001 108.715 -179.064 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 27.6 tttm -51.09 -54.27 26.55 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 108.303 -0.999 . . . . 80.629999999999995 108.303 178.346 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.471 ' HB2' ' O ' ' A' ' 56' ' ' GLU . 5.5 tt0 -52.32 -24.2 7.11 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 114.488 -1.233 . . . . 51.420000000000002 114.019 178.822 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 35.9 m-80 -118.83 28.22 8.42 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 115.089 1.515 . . . . 41.5 115.089 -179.581 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' THR . . . . . 0.744 ' CG2' ' HB2' ' A' ' 76' ' ' LEU . 0.0 OUTLIER -124.73 149.74 46.96 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.126 -0.943 . . . . 62.840000000000003 109.31 178.886 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' THR . . . . . 0.664 HG23 ' O ' ' A' ' 62' ' ' THR . 1.5 p . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 115.426 -0.806 . . . . 76.709999999999994 109.722 -179.577 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.556 ' O ' ' N ' ' A' ' 63' ' ' THR . 7.4 tp10 . . . . . 0 CA--C 1.537 0.463 0 N-CA-C 113.647 0.98 . . . . 98.390000000000001 113.647 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.744 ' HB2' ' CG2' ' A' ' 62' ' ' THR . 3.2 tp -109.87 129.72 55.61 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 116.314 1.968 . . . . 56.509999999999998 116.314 -179.174 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' ASP . . . . . . . . . . . . . 44.9 t0 -81.93 88.82 6.35 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 105.194 -2.15 . . . . 51.829999999999998 105.194 177.125 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 4.2 m -61.43 -51.36 69.04 Favored 'General case' 0 CA--C 1.509 -0.626 0 CA-C-O 121.304 0.573 . . . . 55.32 112.308 -177.921 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 1.7 tp60 -43.61 -54.34 5.04 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.669 -1.151 . . . . 58.920000000000002 109.448 -179.424 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.822 ' O ' ' HG2' ' A' ' 84' ' ' ARG . 25.5 tpt180 -66.85 -43.13 84.46 Favored 'General case' 0 N--CA 1.434 -1.259 0 CA-C-N 113.702 -1.59 . . . . 50.82 111.808 -178.475 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 18.3 t80 -56.46 -52.89 62.99 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 124.298 1.039 . . . . 30.420000000000002 110.174 178.939 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -65.15 -37.76 88.42 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 113.322 0.86 . . . . 53.969999999999999 113.322 -179.316 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -63.17 -45.38 92.06 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 108.217 -1.031 . . . . 28.609999999999999 108.217 -179.085 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.822 ' HG2' ' O ' ' A' ' 80' ' ' ARG . 10.7 mmm-85 -61.15 -39.34 89.72 Favored 'General case' 0 C--O 1.217 -0.655 0 N-CA-C 108.392 -0.966 . . . . 41.299999999999997 108.392 -179.759 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 70.7 mt -59.7 -46.11 93.75 Favored 'Isoleucine or valine' 0 C--O 1.272 2.283 0 O-C-N 121.572 -0.705 . . . . 34.450000000000003 110.239 179.801 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -60.27 -47.95 83.8 Favored 'General case' 0 C--O 1.246 0.875 0 CA-C-N 114.659 -1.155 . . . . 19.100000000000001 110.962 -179.979 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 21.2 t -52.91 -49.2 49.48 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.865 0 C-N-CA 120.031 -0.668 . . . . 16.120000000000001 109.648 178.64 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 74.3 mt-10 -75.1 -25.43 58.5 Favored 'General case' 0 CA--C 1.563 1.453 0 N-CA-C 115.089 1.514 . . . . 34.939999999999998 115.089 -178.273 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 99.8 m -77.9 -15.1 59.29 Favored 'General case' 0 C--N 1.32 -0.688 0 O-C-N 121.255 -0.903 . . . . 17.300000000000001 109.128 176.148 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 93.5 m -95.8 107.52 19.76 Favored 'General case' 0 CA--C 1.501 -0.905 0 C-N-CA 119.322 -0.951 . . . . 20.030000000000001 112.82 -177.975 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 3.7 t -71.98 -42.52 68.47 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.148 0 N-CA-C 114.409 1.263 . . . . 22.710000000000001 114.409 -177.962 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' TYR . . . . . . . . . . . . . 60.5 t80 -145.64 117.46 5.1 Favored Pre-proline 0 C--O 1.249 1.032 0 N-CA-C 105.4 -2.074 . . . . 19.170000000000002 105.4 -179.739 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 0.4 OUTLIER -85.4 145.48 39.67 Favored 'Cis proline' 0 C--O 1.214 -0.714 0 C-N-CA 124.165 -1.181 . . . . 16.760000000000002 111.407 0.503 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 1.2 t -95.04 116.25 28.46 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 105.5 -2.037 . . . . 34.340000000000003 105.5 177.275 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 31.1 m-85 -66.72 -3.18 6.04 Favored 'General case' 0 C--O 1.245 0.844 0 N-CA-C 117.341 2.349 . . . . 16.710000000000001 117.341 -177.541 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 90.6 mttt -89.41 -12.47 40.2 Favored 'General case' 0 C--O 1.217 -0.634 0 CA-C-N 115.011 -0.995 . . . . 33.829999999999998 108.983 178.17 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -53.57 132.48 40.42 Favored 'General case' 0 CA--C 1.502 -0.902 0 CA-C-O 120.984 0.421 . . . . 18.969999999999999 110.725 -178.422 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 46.8 tptt -54.37 -40.57 68.25 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-N 115.033 -0.985 . . . . 46.350000000000001 110.473 178.667 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -59.55 -39.48 84.15 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 119.758 -0.777 . . . . 42.25 110.99 -177.844 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 53.8 mt -76.13 -35.31 59.31 Favored 'General case' 0 CA--C 1.503 -0.842 0 C-N-CA 119.667 -0.813 . . . . 19.260000000000002 111.114 179.458 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 34.6 mtm105 -64.92 -40.02 94.42 Favored 'General case' 0 C--O 1.246 0.9 0 C-N-CA 119.02 -1.072 . . . . 29.440000000000001 109.424 -179.809 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -63.87 -63.18 1.23 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.447 -0.797 . . . . 58.009999999999998 109.8 178.215 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -52.37 -40.44 62.02 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 116.617 2.08 . . . . 27.920000000000002 116.617 -176.775 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 50.9 m-85 -93.1 3.06 56.37 Favored 'General case' 0 N--CA 1.443 -0.776 0 C-N-CA 119.58 -0.848 . . . . 30.109999999999999 111.612 -178.774 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 11.3 mttp 52.82 55.6 8.76 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 118.274 2.694 . . . . 51.340000000000003 118.274 178.624 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 4.3 t -162.5 137.55 6.92 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.646 -0.872 . . . . 28.460000000000001 108.646 175.34 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 75.2 mm-40 -88.6 -3.89 58.7 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 115.845 -0.616 . . . . 32.539999999999999 110.83 -179.244 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 54.8 t0 -88.24 106.53 12.62 Favored Pre-proline 0 C--O 1.243 0.725 0 CA-C-N 115.876 -0.602 . . . . 31.809999999999999 109.67 179.423 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -54.36 -30.57 63.66 Favored 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 123.466 2.777 . . . . 22.23 112.606 -179.574 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 52.6 t -73.15 -31.92 36.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 121.323 0.583 . . . . 20.890000000000001 109.551 178.851 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 21.1 tp10 -75.81 -37.68 58.88 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 106.187 -1.783 . . . . 43.100000000000001 106.187 179.278 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 59.2 t -56.02 -47.05 80.76 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.738 0 N-CA-C 105.924 -1.88 . . . . 19.039999999999999 105.924 177.104 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -58.25 -43.99 88.09 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 119.557 -0.857 . . . . 15.449999999999999 112.073 179.87 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 56.3 mttm -66.21 -33.33 75.52 Favored 'General case' 0 C--O 1.217 -0.652 0 C-N-CA 119.575 -0.85 . . . . 43.789999999999999 112.554 -178.927 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -76.51 -32.72 58.47 Favored 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 118.82 -1.152 . . . . 23.199999999999999 111.065 176.971 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 81.7 t -74.55 -50.78 25.04 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 O-C-N 121.293 -0.879 . . . . 19.07 110.436 178.657 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 29.6 mt -89.11 64.6 7.1 Favored 'General case' 0 CA--C 1.551 0.985 0 N-CA-C 105.308 -2.108 . . . . 19.079999999999998 105.308 179.198 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 27.1 p -72.35 -0.21 11.76 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 119.033 2.975 . . . . 24.030000000000001 119.033 -176.045 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 55.1 t -102.72 120.27 52.27 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.7 0 N-CA-C 104.674 -2.343 . . . . 22.539999999999999 104.674 175.89 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . -34.98 -63.21 0.53 Allowed Glycine 0 C--O 1.247 0.956 0 N-CA-C 115.905 1.122 . . . . 28.780000000000001 115.905 -177.343 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . -50.23 -40.34 36.99 Favored Glycine 0 C--O 1.218 -0.865 0 CA-C-O 118.976 -0.902 . . . . 22.149999999999999 113.668 -178.963 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' GLU . . . . . 0.572 ' OE1' ' NH1' ' A' ' 33' ' ' ARG . 89.9 mt-10 -61.91 -46.99 86.94 Favored 'General case' 0 C--O 1.224 -0.259 0 CA-C-N 118.26 1.03 . . . . 27.149999999999999 109.883 -179.524 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' TYR . . . . . . . . . . . . . 71.6 t80 -60.42 -43.23 96.95 Favored 'General case' 0 N--CA 1.433 -1.283 0 C-N-CA 119.083 -1.047 . . . . 22.010000000000002 112.19 -179.311 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -66.86 -39.18 87.48 Favored 'General case' 0 C--O 1.217 -0.656 0 N-CA-C 109.011 -0.736 . . . . 25.949999999999999 109.011 -178.115 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -67.32 -38.95 85.75 Favored 'General case' 0 CA--C 1.507 -0.676 0 CA-C-N 116.348 -0.387 . . . . 38.149999999999999 110.959 -179.179 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 42.2 t90 -61.31 -46.68 89.29 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.109 -0.636 . . . . 21.800000000000001 109.367 179.105 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.412 ' O ' HG12 ' A' ' 131' ' ' ILE . 16.9 mt -56.81 -52.89 63.29 Favored 'General case' 0 CA--C 1.494 -1.2 0 CA-C-N 116.087 -0.506 . . . . 26.039999999999999 110.811 -179.618 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 62.5 m-20 -62.9 -40.11 96.56 Favored 'General case' 0 C--O 1.216 -0.683 0 C-N-CA 118.906 -1.118 . . . . 41.759999999999998 113.148 -178.765 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 12.7 tptt -59.01 -41.65 88.24 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 117.72 -1.592 . . . . 39.020000000000003 109.842 179.477 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -60.8 -47.0 88.3 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.902 -0.59 . . . . 29.309999999999999 110.78 -179.222 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' ILE . . . . . 0.412 HG12 ' O ' ' A' ' 127' ' ' LEU . 25.8 mm -60.72 -39.36 81.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 N-CA-C 108.744 -0.836 . . . . 32.57 108.744 -179.847 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -69.64 -44.72 70.01 Favored 'General case' 0 N--CA 1.444 -0.772 0 CA-C-N 115.079 -0.964 . . . . 59.350000000000001 110.232 -179.801 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' ILE . . . . . . . . . . . . . 9.9 mm -57.73 -23.76 21.17 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.416 0 N-CA-C 111.9 0.333 . . . . 37.039999999999999 111.9 178.78 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 52.8 m-80 -94.54 23.71 5.1 Favored 'General case' 0 N--CA 1.446 -0.668 0 O-C-N 121.697 -0.627 . . . . 25.859999999999999 110.824 -179.639 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 67.51 8.11 50.01 Favored Glycine 0 C--O 1.224 -0.518 0 N-CA-C 118.164 2.026 . . . . 34.710000000000001 118.164 -179.631 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' PHE . . . . . . . . . . . . . 64.3 m-85 -82.93 116.96 22.44 Favored 'General case' 0 C--N 1.321 -0.652 0 O-C-N 120.258 -1.731 . . . . 45.850000000000001 112.467 179.653 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 22.2 t70 . . . . . 0 C--N 1.327 -0.407 0 C-N-CA 120.511 -0.476 . . . . 117.95 111.026 179.588 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 158' ' ' ' MN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 159' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 160' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 161' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 162' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 163' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 164' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 165' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 166' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 167' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 168' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 169' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 170' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 171' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 172' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 173' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 174' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 176' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 177' ' ' HOH . . . . . 0.463 ' O ' ' NH2' ' A' ' 80' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 178' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 179' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 181' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 182' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 183' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 184' ' ' HOH . . . . . 0.434 ' O ' ' NH1' ' A' ' 84' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 185' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 186' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_