data_2p05_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 2p05 _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 ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.48 1.062 0 CA-C-O 117.297 -1.335 . . . . 43.579999999999998 111.172 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' LYS . . . . . 0.433 ' CE ' ' O ' ' A' ' 68' ' ' LEU . 43.8 tttp -55.5 -45.09 77.1 Favored 'General case' 0 N--CA 1.479 1.009 0 CA-C-N 120.816 1.643 . . . . 41.859999999999999 110.757 176.732 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 2.9 m -59.82 -30.98 69.3 Favored 'General case' 0 C--O 1.212 -0.879 0 N-CA-C 113.479 0.918 . . . . 43.299999999999997 113.479 -179.409 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 11.8 m120 -79.86 -19.98 47.04 Favored 'General case' 0 CA--C 1.5 -0.974 0 C-N-CA 119.629 -0.828 . . . . 50.759999999999998 111.265 178.897 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 57.4 m95 -79.77 -43.25 22.85 Favored 'General case' 0 C--O 1.255 1.386 0 CA-C-N 115.426 -0.806 . . . . 39.340000000000003 110.286 178.263 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 12.1 mt -55.89 -41.65 74.78 Favored 'General case' 0 N--CA 1.438 -1.072 0 O-C-N 124.309 1.006 . . . . 37.859999999999999 111.77 173.495 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.4 -37.88 80.75 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.058 -0.974 . . . . 49.369999999999997 110.571 -179.654 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 8.4 ttm180 -68.48 -53.3 24.23 Favored 'General case' 0 CA--C 1.509 -0.616 0 N-CA-C 106.535 -1.654 . . . . 54.740000000000002 106.535 -176.563 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . 0.326 0.5 OUTLIER -59.45 -38.89 77.47 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.187 0 N-CA-C 112.162 0.43 . . . . 41.439999999999998 112.162 175.751 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 39.2 t80 -60.5 -38.9 85.79 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 116.982 -1.887 . . . . 36.950000000000003 112.498 172.622 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 18.9 mtm180 -76.48 -20.08 57.35 Favored 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 114.664 1.357 . . . . 65.150000000000006 114.664 -176.63 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 33.9 m -94.08 -12.31 8.75 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 N-CA-C 115.304 1.594 . . . . 37.009999999999998 115.304 177.821 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ARG . . . . . 0.495 ' NH2' ' OD2' ' A' ' 65' ' ' ASP 0.317 0.0 OUTLIER -106.72 99.98 28.42 Favored Pre-proline 0 C--O 1.202 -1.399 0 N-CA-C 114.745 1.387 . . . . 35.159999999999997 114.745 174.872 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_exo -68.94 175.73 7.04 Favored 'Trans proline' 0 CA--C 1.535 0.561 0 C-N-CA 123.55 2.833 . . . . 28.57 112.049 174.98 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 53.4 t -57.36 135.43 56.52 Favored 'General case' 0 C--N 1.316 -0.886 0 O-C-N 121.697 -0.627 . . . . 28.640000000000001 110.2 175.599 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 16.7 m -67.29 -27.52 39.27 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 N-CA-C 112.779 0.659 . . . . 28.690000000000001 112.779 177.059 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 34.0 tptt -84.58 -52.46 6.1 Favored 'General case' 0 C--O 1.187 -2.218 0 C-N-CA 119.911 -0.716 . . . . 29.420000000000002 111.432 -179.781 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 23.6 p -99.66 -10.94 21.37 Favored 'General case' 0 C--N 1.316 -0.871 0 O-C-N 120.019 -1.676 . . . . 33.700000000000003 113.111 -172.878 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 15.8 mttm 65.76 1.28 1.75 Allowed 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 115.672 1.73 . . . . 43.340000000000003 115.672 172.479 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 92.0 t -113.05 -65.58 1.51 Allowed 'Isoleucine or valine' 0 CA--C 1.569 1.682 0 CA-C-O 118.528 -0.749 . . . . 31.440000000000001 112.704 178.965 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.25 151.66 93.46 Favored Pre-proline 0 N--CA 1.477 0.91 0 CA-C-N 119.553 1.069 . . . . 27.859999999999999 112.658 -176.455 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -70.25 163.42 38.74 Favored 'Trans proline' 0 C--O 1.208 -0.985 0 CA-C-O 118.37 -0.763 . . . . 24.350000000000001 111.825 172.837 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 3.5 mtp180 -76.68 164.33 25.99 Favored 'General case' 0 CA--C 1.509 -0.621 0 C-N-CA 124.813 1.245 . . . . 27.170000000000002 110.459 -173.017 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 48.6 t30 -89.26 166.34 13.85 Favored 'General case' 0 CA--C 1.476 -1.874 0 N-CA-C 102.374 -3.195 . . . . 31.300000000000001 102.374 176.655 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 45.7 p-90 -156.76 162.79 39.75 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 107.238 -1.393 . . . . 27.550000000000001 107.238 -175.897 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 10.0 ptpt -147.09 147.16 30.31 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.317 -0.623 . . . . 41.039999999999999 109.317 168.556 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 3.4 t -96.17 99.18 8.67 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 CA-C-O 122.527 1.156 . . . . 44.299999999999997 108.019 172.773 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' LYS . . . . . 0.434 ' O ' ' CB ' ' A' ' 37' ' ' ASN . 42.2 tttp -93.09 118.28 31.02 Favored 'General case' 0 C--O 1.26 1.615 0 N-CA-C 100.49 -3.892 . . . . 56.700000000000003 100.49 179.817 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ASN . . . . . 0.434 ' CB ' ' O ' ' A' ' 36' ' ' LYS . 0.9 OUTLIER 71.82 -111.07 0.05 Allowed 'General case' 0 C--O 1.251 1.157 0 C-N-CA 117.79 -1.564 . . . . 64.159999999999997 112.321 164.41 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 4.5 mttt -133.41 27.3 4.1 Favored 'General case' 0 CA--C 1.548 0.879 0 CA-C-N 114.139 -1.391 . . . . 60.640000000000001 107.972 172.736 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 13.0 m-70 -119.12 147.03 44.61 Favored 'General case' 0 CA--C 1.495 -1.158 0 N-CA-C 107.785 -1.191 . . . . 59.549999999999997 107.785 175.563 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.1 tp -107.28 122.78 47.23 Favored 'General case' 0 C--O 1.252 1.193 0 N-CA-C 108.47 -0.937 . . . . 39.850000000000001 108.47 168.283 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 36.3 ttm180 -98.81 119.07 36.94 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 114.497 -1.229 . . . . 35.509999999999998 110.491 176.987 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 83.4 mt -102.83 114.52 42.62 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 N-CA-C 108.131 -1.063 . . . . 28.120000000000001 108.131 173.802 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 64.0 m-85 -75.99 162.63 27.91 Favored 'General case' 0 CA--C 1.484 -1.561 0 N-CA-C 107.426 -1.324 . . . . 27.199999999999999 107.426 -178.563 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ASN . . . . . 0.497 ' ND2' ' C ' ' A' ' 63' ' ' GLY . 70.3 m-80 -68.89 -28.87 67.08 Favored 'General case' 0 CA--C 1.506 -0.718 0 N-CA-C 116.062 1.875 . . . . 32.100000000000001 116.062 178.933 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 76.9 mtm -127.23 153.78 45.67 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 114.837 1.421 . . . . 23.850000000000001 114.837 -171.505 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 14.5 p -54.27 171.19 0.12 Allowed 'General case' 0 C--O 1.213 -0.838 0 C-N-CA 120.556 -0.458 . . . . 28.52 110.704 169.668 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 10.3 tptm -70.37 -31.2 68.35 Favored 'General case' 0 C--N 1.322 -0.617 0 O-C-N 120.189 -1.569 . . . . 33.619999999999997 109.768 178.781 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 7.0 p -77.45 -37.73 50.92 Favored 'General case' 0 N--CA 1.441 -0.899 0 N-CA-C 106.598 -1.63 . . . . 32.619999999999997 106.598 -168.392 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 64.6 m -71.94 -29.69 64.55 Favored 'General case' 0 CA--C 1.48 -1.728 0 CA-C-O 118.584 -0.722 . . . . 26.940000000000001 112.01 178.065 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 86.1 t80 -68.69 -53.51 21.81 Favored 'General case' 0 CA--C 1.501 -0.906 0 CA-C-O 118.41 -0.805 . . . . 26.379999999999999 109.906 179.675 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 97.1 m-20 -50.42 -42.21 53.52 Favored 'General case' 0 CA--C 1.553 1.083 0 N-CA-C 114.369 1.248 . . . . 27.32 114.369 171.95 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -59.72 -43.5 94.15 Favored 'General case' 0 N--CA 1.465 0.293 0 O-C-N 121.656 -0.653 . . . . 28.699999999999999 110.997 174.026 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' SER . . . . . 0.654 ' OG ' ' CE1' ' A' ' 62' ' ' HIS . 0.5 OUTLIER -57.07 -35.48 69.41 Favored 'General case' 0 C--O 1.208 -1.08 0 N-CA-C 110.123 -0.325 . . . . 25.370000000000001 110.123 178.489 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 43.1 mt -70.65 -44.03 76.98 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.398 0 C-N-CA 118.939 -1.104 . . . . 25.350000000000001 110.649 179.525 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 76.6 m-20 -64.72 -35.48 81.2 Favored 'General case' 0 C--O 1.224 -0.266 0 N-CA-C 115.822 1.786 . . . . 35.43 115.822 178.595 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 5.6 pt -90.07 -11.32 10.04 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 CA-C-N 119.304 0.957 . . . . 25.579999999999998 111.988 -176.738 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 92.59 14.16 55.82 Favored Glycine 0 N--CA 1.434 -1.434 0 CA-C-O 119.39 -0.672 . . . . 24.09 114.524 174.791 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 53.1 t0 -106.96 131.17 54.34 Favored 'General case' 0 CA--C 1.469 -2.153 0 CA-C-N 119.12 1.46 . . . . 30.699999999999999 108.231 -176.314 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 44.9 p30 -121.74 20.33 10.97 Favored 'General case' 0 CA--C 1.51 -0.56 0 C-N-CA 119.25 -0.98 . . . . 37.710000000000001 112.456 173.413 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 7.0 p -63.13 -23.88 67.64 Favored 'General case' 0 CA--C 1.503 -0.857 0 C-N-CA 119.926 -0.709 . . . . 35.420000000000002 110.931 -176.118 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 92.5 m-85 -105.95 -1.12 24.42 Favored 'General case' 0 N--CA 1.482 1.146 0 N-CA-C 115.598 1.703 . . . . 37.390000000000001 115.598 -176.834 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' HIS . . . . . 0.654 ' CE1' ' OG ' ' A' ' 53' ' ' SER . 0.5 OUTLIER -51.9 150.89 3.85 Favored 'General case' 0 C--N 1.316 -0.86 0 O-C-N 121.25 -0.906 . . . . 29.27 111.445 168.011 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' GLY . . . . . 0.497 ' C ' ' ND2' ' A' ' 44' ' ' ASN . . . 141.65 -177.1 21.49 Favored Glycine 0 N--CA 1.485 1.918 0 C-N-CA 123.582 0.611 . . . . 30.23 112.158 -178.805 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 16.5 p80 -179.2 164.37 1.38 Allowed 'General case' 0 CA--C 1.499 -1.001 0 CA-C-O 118.654 -0.689 . . . . 31.140000000000001 110.228 -177.047 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ASP . . . . . 0.495 ' OD2' ' NH2' ' A' ' 21' ' ' ARG . 0.5 OUTLIER -124.55 159.21 31.14 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 120.135 -0.626 . . . . 35.630000000000003 112.287 163.289 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 18.5 m-20 -112.87 137.45 51.21 Favored 'General case' 0 CA--C 1.495 -1.145 0 N-CA-C 113.317 0.858 . . . . 36.509999999999998 113.317 178.561 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 17.0 m95 -129.16 133.56 47.65 Favored 'General case' 0 C--O 1.244 0.802 0 N-CA-C 106.56 -1.644 . . . . 39.020000000000003 106.56 177.398 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' LEU . . . . . 0.433 ' O ' ' CE ' ' A' ' 10' ' ' LYS . 2.7 pp -88.99 151.43 22.29 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 119.92 -0.712 . . . . 51.630000000000003 111.094 177.812 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 26.5 mtm -106.08 54.46 0.69 Allowed 'General case' 0 CA--C 1.579 2.079 0 N-CA-C 120.252 3.427 . . . . 60.149999999999999 120.252 -177.33 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -136.6 163.24 31.02 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.829 1.252 . . . . 76.079999999999998 110.493 175.074 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.244 0 C-N-CA 123.976 0.911 . . . . 66.390000000000001 111.318 174.34 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 300' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' ADP . . . . . 0.521 ' O2A' ' O2B' ' A' ' 100' ' ' ADP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 400' ' ' 1PE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.48 1.062 0 CA-C-O 117.297 -1.335 . . . . 43.58 111.172 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' LYS . . . . . 0.769 ' HE2' ' O ' ' A' ' 68' ' ' LEU . 43.8 tttp -55.5 -45.09 77.1 Favored 'General case' 0 N--CA 1.479 1.009 0 CA-C-N 120.816 1.643 . . . . 41.86 110.757 176.732 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 2.9 m -59.82 -30.98 69.3 Favored 'General case' 0 C--O 1.212 -0.879 0 N-CA-C 113.479 0.918 . . . . 43.3 113.479 -179.409 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 11.8 m120 -79.86 -19.98 47.04 Favored 'General case' 0 CA--C 1.5 -0.974 0 C-N-CA 119.629 -0.828 . . . . 50.76 111.265 178.897 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' TRP . . . . . 0.405 ' O ' HG23 ' A' ' 17' ' ' ILE . 57.4 m95 -79.77 -43.25 22.85 Favored 'General case' 0 C--O 1.255 1.386 0 CA-C-N 115.426 -0.806 . . . . 39.34 110.286 178.263 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 14' ' ' LEU . . . . . 0.409 HD23 ' HA ' ' A' ' 14' ' ' LEU . 12.1 mt -55.89 -41.65 74.78 Favored 'General case' 0 N--CA 1.438 -1.072 0 O-C-N 124.309 1.006 . . . . 37.86 111.77 173.495 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.4 -37.88 80.75 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.058 -0.974 . . . . 49.37 110.571 -179.654 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 8.4 ttm180 -68.48 -53.3 24.23 Favored 'General case' 0 CA--C 1.509 -0.616 0 N-CA-C 106.535 -1.654 . . . . 54.74 106.535 -176.563 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ILE . . . . . 0.408 HD12 ' HD3' ' A' ' 21' ' ' ARG 0.326 0.5 OUTLIER -59.45 -38.89 77.47 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.187 0 N-CA-C 112.162 0.43 . . . . 41.44 112.162 175.751 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 39.2 t80 -60.5 -38.9 85.79 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 116.982 -1.887 . . . . 36.95 112.498 172.622 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 18.9 mtm180 -76.48 -20.08 57.35 Favored 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 114.664 1.357 . . . . 65.15 114.664 -176.63 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' VAL . . . . . 0.47 ' O ' ' HD3' ' A' ' 22' ' ' PRO . 33.9 m -94.08 -12.31 8.75 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 N-CA-C 115.304 1.594 . . . . 37.01 115.304 177.821 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ARG . . . . . 0.52 ' HB2' ' NH1' ' A' ' 31' ' ' ARG 0.317 0.0 OUTLIER -106.72 99.98 28.42 Favored Pre-proline 0 C--O 1.202 -1.399 0 N-CA-C 114.745 1.387 . . . . 35.16 114.745 174.872 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 22' ' ' PRO . . . . . 0.47 ' HD3' ' O ' ' A' ' 20' ' ' VAL . 4.4 Cg_exo -68.94 175.73 7.04 Favored 'Trans proline' 0 CA--C 1.535 0.561 0 C-N-CA 123.55 2.833 . . . . 28.57 112.049 174.98 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 53.4 t -57.36 135.43 56.52 Favored 'General case' 0 C--N 1.316 -0.886 0 O-C-N 121.697 -0.627 . . . . 28.64 110.2 175.599 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 16.7 m -67.29 -27.52 39.27 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 N-CA-C 112.779 0.659 . . . . 28.69 112.779 177.059 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 34.0 tptt -84.58 -52.46 6.1 Favored 'General case' 0 C--O 1.187 -2.218 0 C-N-CA 119.911 -0.716 . . . . 29.42 111.432 -179.781 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 23.6 p -99.66 -10.94 21.37 Favored 'General case' 0 C--N 1.316 -0.871 0 O-C-N 120.019 -1.676 . . . . 33.7 113.111 -172.878 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 15.8 mttm 65.76 1.28 1.75 Allowed 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 115.672 1.73 . . . . 43.34 115.672 172.479 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 92.0 t -113.05 -65.58 1.51 Allowed 'Isoleucine or valine' 0 CA--C 1.569 1.682 0 CA-C-O 118.528 -0.749 . . . . 31.44 112.704 178.965 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.25 151.66 93.46 Favored Pre-proline 0 N--CA 1.477 0.91 0 CA-C-N 119.553 1.069 . . . . 27.86 112.658 -176.455 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -70.25 163.42 38.74 Favored 'Trans proline' 0 C--O 1.208 -0.985 0 CA-C-O 118.37 -0.763 . . . . 24.35 111.825 172.837 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ARG . . . . . 0.52 ' NH1' ' HB2' ' A' ' 21' ' ' ARG . 3.5 mtp180 -76.68 164.33 25.99 Favored 'General case' 0 CA--C 1.509 -0.621 0 C-N-CA 124.813 1.245 . . . . 27.17 110.459 -173.017 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 48.6 t30 -89.26 166.34 13.85 Favored 'General case' 0 CA--C 1.476 -1.874 0 N-CA-C 102.374 -3.195 . . . . 31.3 102.374 176.655 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 45.7 p-90 -156.76 162.79 39.75 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 107.238 -1.393 . . . . 27.55 107.238 -175.897 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 10.0 ptpt -147.09 147.16 30.31 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.317 -0.623 . . . . 41.04 109.317 168.556 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 3.4 t -96.17 99.18 8.67 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 CA-C-O 122.527 1.156 . . . . 44.3 108.019 172.773 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' LYS . . . . . 0.434 ' O ' ' CB ' ' A' ' 37' ' ' ASN . 42.2 tttp -93.09 118.28 31.02 Favored 'General case' 0 C--O 1.26 1.615 0 N-CA-C 100.49 -3.892 . . . . 56.7 100.49 179.817 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ASN . . . . . 0.439 ' HB3' ' H ' ' A' ' 38' ' ' LYS . 0.9 OUTLIER 71.82 -111.07 0.05 Allowed 'General case' 0 C--O 1.251 1.157 0 C-N-CA 117.79 -1.564 . . . . 64.16 112.321 164.41 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 38' ' ' LYS . . . . . 0.439 ' H ' ' HB3' ' A' ' 37' ' ' ASN . 4.5 mttt -133.41 27.3 4.1 Favored 'General case' 0 CA--C 1.548 0.879 0 CA-C-N 114.139 -1.391 . . . . 60.64 107.972 172.736 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 13.0 m-70 -119.12 147.03 44.61 Favored 'General case' 0 CA--C 1.495 -1.158 0 N-CA-C 107.785 -1.191 . . . . 59.55 107.785 175.563 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.1 tp -107.28 122.78 47.23 Favored 'General case' 0 C--O 1.252 1.193 0 N-CA-C 108.47 -0.937 . . . . 39.85 108.47 168.283 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 36.3 ttm180 -98.81 119.07 36.94 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 114.497 -1.229 . . . . 35.51 110.491 176.987 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 83.4 mt -102.83 114.52 42.62 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 N-CA-C 108.131 -1.063 . . . . 28.12 108.131 173.802 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' TYR . . . . . 0.4 ' HB3' ' C6 ' ' A' ' 100' ' ' ADP . 64.0 m-85 -75.99 162.63 27.91 Favored 'General case' 0 CA--C 1.484 -1.561 0 N-CA-C 107.426 -1.324 . . . . 27.2 107.426 -178.563 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 32.4 m120 -68.89 -28.87 67.08 Favored 'General case' 0 CA--C 1.506 -0.718 0 N-CA-C 116.062 1.875 . . . . 32.1 116.062 178.933 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 76.9 mtm -127.23 153.78 45.67 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 114.837 1.421 . . . . 23.85 114.837 -171.505 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 14.5 p -54.27 171.19 0.12 Allowed 'General case' 0 C--O 1.213 -0.838 0 C-N-CA 120.556 -0.458 . . . . 28.52 110.704 169.668 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 10.3 tptm -70.37 -31.2 68.35 Favored 'General case' 0 C--N 1.322 -0.617 0 O-C-N 120.189 -1.569 . . . . 33.62 109.768 178.781 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 7.0 p -77.45 -37.73 50.92 Favored 'General case' 0 N--CA 1.441 -0.899 0 N-CA-C 106.598 -1.63 . . . . 32.62 106.598 -168.392 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 64.6 m -71.94 -29.69 64.55 Favored 'General case' 0 CA--C 1.48 -1.728 0 CA-C-O 118.584 -0.722 . . . . 26.94 112.01 178.065 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 86.1 t80 -68.69 -53.51 21.81 Favored 'General case' 0 CA--C 1.501 -0.906 0 CA-C-O 118.41 -0.805 . . . . 26.38 109.906 179.675 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 97.1 m-20 -50.42 -42.21 53.52 Favored 'General case' 0 CA--C 1.553 1.083 0 N-CA-C 114.369 1.248 . . . . 27.32 114.369 171.95 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -59.72 -43.5 94.15 Favored 'General case' 0 N--CA 1.465 0.293 0 O-C-N 121.656 -0.653 . . . . 28.7 110.997 174.026 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -57.07 -35.48 69.41 Favored 'General case' 0 C--O 1.208 -1.08 0 N-CA-C 110.123 -0.325 . . . . 25.37 110.123 178.489 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 43.1 mt -70.65 -44.03 76.98 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.398 0 C-N-CA 118.939 -1.104 . . . . 25.35 110.649 179.525 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 76.6 m-20 -64.72 -35.48 81.2 Favored 'General case' 0 C--O 1.224 -0.266 0 N-CA-C 115.822 1.786 . . . . 35.43 115.822 178.595 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 5.6 pt -90.07 -11.32 10.04 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 CA-C-N 119.304 0.957 . . . . 25.58 111.988 -176.738 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 92.59 14.16 55.82 Favored Glycine 0 N--CA 1.434 -1.434 0 CA-C-O 119.39 -0.672 . . . . 24.09 114.524 174.791 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 53.1 t0 -106.96 131.17 54.34 Favored 'General case' 0 CA--C 1.469 -2.153 0 CA-C-N 119.12 1.46 . . . . 30.7 108.231 -176.314 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 44.9 p30 -121.74 20.33 10.97 Favored 'General case' 0 CA--C 1.51 -0.56 0 C-N-CA 119.25 -0.98 . . . . 37.71 112.456 173.413 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 7.0 p -63.13 -23.88 67.64 Favored 'General case' 0 CA--C 1.503 -0.857 0 C-N-CA 119.926 -0.709 . . . . 35.42 110.931 -176.118 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 92.5 m-85 -105.95 -1.12 24.42 Favored 'General case' 0 N--CA 1.482 1.146 0 N-CA-C 115.598 1.703 . . . . 37.39 115.598 -176.834 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' HIS . . . . . 0.473 ' N ' ' CD2' ' A' ' 62' ' ' HIS . 22.0 m170 -51.9 150.89 3.85 Favored 'General case' 0 C--N 1.316 -0.86 0 O-C-N 121.25 -0.906 . . . . 29.27 111.445 168.011 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 141.65 -177.1 21.49 Favored Glycine 0 N--CA 1.485 1.918 0 C-N-CA 123.582 0.611 . . . . 30.23 112.158 -178.805 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 14.9 p-80 -179.2 164.37 1.38 Allowed 'General case' 0 CA--C 1.499 -1.001 0 CA-C-O 118.654 -0.689 . . . . 31.14 110.228 -177.047 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ASP . . . . . 0.474 ' OD2' ' NH2' ' A' ' 21' ' ' ARG . 0.5 OUTLIER -124.55 159.21 31.14 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 120.135 -0.626 . . . . 35.63 112.287 163.289 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 18.5 m-20 -112.87 137.45 51.21 Favored 'General case' 0 CA--C 1.495 -1.145 0 N-CA-C 113.317 0.858 . . . . 36.51 113.317 178.561 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 17.0 m95 -129.16 133.56 47.65 Favored 'General case' 0 C--O 1.244 0.802 0 N-CA-C 106.56 -1.644 . . . . 39.02 106.56 177.398 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' LEU . . . . . 0.769 ' O ' ' HE2' ' A' ' 10' ' ' LYS . 2.7 pp -88.99 151.43 22.29 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 119.92 -0.712 . . . . 51.63 111.094 177.812 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 26.5 mtm -106.08 54.46 0.69 Allowed 'General case' 0 CA--C 1.579 2.079 0 N-CA-C 120.252 3.427 . . . . 60.15 120.252 -177.33 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' TYR . . . . . 0.419 ' O ' ' HB3' ' A' ' 71' ' ' ALA . 12.5 m-85 -136.6 163.24 31.02 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.829 1.252 . . . . 76.08 110.493 175.074 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 71' ' ' ALA . . . . . 0.419 ' HB3' ' O ' ' A' ' 70' ' ' TYR . . . . . . . . 0 C--O 1.234 0.244 0 C-N-CA 123.976 0.911 . . . . 66.39 111.318 174.34 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 300' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 100' ' ' ADP . . . . . 0.521 ' O2B' ' O2A' ' A' ' 100' ' ' ADP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 400' ' ' 1PE . . . . . 0.507 H142 H122 ' A' ' 400' ' ' 1PE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.48 1.062 0 CA-C-O 117.297 -1.335 . . . . 43.579999999999998 111.172 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.769 ' HE2' ' O ' ' A' ' 68' ' ' LEU . 43.8 tttp -55.5 -45.09 77.1 Favored 'General case' 0 N--CA 1.479 1.009 0 CA-C-N 120.816 1.643 . . . . 41.859999999999999 110.757 176.732 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 2.9 m -59.82 -30.98 69.3 Favored 'General case' 0 C--O 1.212 -0.879 0 N-CA-C 113.479 0.918 . . . . 43.299999999999997 113.479 -179.409 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 11.8 m120 -79.86 -19.98 47.04 Favored 'General case' 0 CA--C 1.5 -0.974 0 C-N-CA 119.629 -0.828 . . . . 50.759999999999998 111.265 178.897 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.405 ' O ' HG23 ' A' ' 17' ' ' ILE . 57.4 m95 -79.77 -43.25 22.85 Favored 'General case' 0 C--O 1.255 1.386 0 CA-C-N 115.426 -0.806 . . . . 39.340000000000003 110.286 178.263 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.409 HD23 ' HA ' ' A' ' 14' ' ' LEU . 12.1 mt -55.89 -41.65 74.78 Favored 'General case' 0 N--CA 1.438 -1.072 0 O-C-N 124.309 1.006 . . . . 37.859999999999999 111.77 173.495 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.4 -37.88 80.75 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.058 -0.974 . . . . 49.369999999999997 110.571 -179.654 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 8.4 ttm180 -68.48 -53.3 24.23 Favored 'General case' 0 CA--C 1.509 -0.616 0 N-CA-C 106.535 -1.654 . . . . 54.740000000000002 106.535 -176.563 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.408 HD12 ' HD3' ' A' ' 21' ' ' ARG 0.326 0.5 OUTLIER -59.45 -38.89 77.47 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.187 0 N-CA-C 112.162 0.43 . . . . 41.439999999999998 112.162 175.751 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 39.2 t80 -60.5 -38.9 85.79 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 116.982 -1.887 . . . . 36.950000000000003 112.498 172.622 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 18.9 mtm180 -76.48 -20.08 57.35 Favored 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 114.664 1.357 . . . . 65.150000000000006 114.664 -176.63 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.47 ' O ' ' HD3' ' A' ' 22' ' ' PRO . 33.9 m -94.08 -12.31 8.75 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 N-CA-C 115.304 1.594 . . . . 37.009999999999998 115.304 177.821 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.52 ' HB2' ' NH1' ' A' ' 31' ' ' ARG 0.317 0.0 OUTLIER -106.72 99.98 28.42 Favored Pre-proline 0 C--O 1.202 -1.399 0 N-CA-C 114.745 1.387 . . . . 35.159999999999997 114.745 174.872 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.47 ' HD3' ' O ' ' A' ' 20' ' ' VAL . 4.4 Cg_exo -68.94 175.73 7.04 Favored 'Trans proline' 0 CA--C 1.535 0.561 0 C-N-CA 123.55 2.833 . . . . 28.57 112.049 174.98 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 53.4 t -57.36 135.43 56.52 Favored 'General case' 0 C--N 1.316 -0.886 0 O-C-N 121.697 -0.627 . . . . 28.640000000000001 110.2 175.599 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 16.7 m -67.29 -27.52 39.27 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 N-CA-C 112.779 0.659 . . . . 28.690000000000001 112.779 177.059 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 34.0 tptt -84.58 -52.46 6.1 Favored 'General case' 0 C--O 1.187 -2.218 0 C-N-CA 119.911 -0.716 . . . . 29.420000000000002 111.432 -179.781 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 23.6 p -99.66 -10.94 21.37 Favored 'General case' 0 C--N 1.316 -0.871 0 O-C-N 120.019 -1.676 . . . . 33.700000000000003 113.111 -172.878 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 15.8 mttm 65.76 1.28 1.75 Allowed 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 115.672 1.73 . . . . 43.340000000000003 115.672 172.479 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 92.0 t -113.05 -65.58 1.51 Allowed 'Isoleucine or valine' 0 CA--C 1.569 1.682 0 CA-C-O 118.528 -0.749 . . . . 31.440000000000001 112.704 178.965 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.25 151.66 93.46 Favored Pre-proline 0 N--CA 1.477 0.91 0 CA-C-N 119.553 1.069 . . . . 27.859999999999999 112.658 -176.455 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -70.25 163.42 38.74 Favored 'Trans proline' 0 C--O 1.208 -0.985 0 CA-C-O 118.37 -0.763 . . . . 24.350000000000001 111.825 172.837 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.52 ' NH1' ' HB2' ' A' ' 21' ' ' ARG . 3.5 mtp180 -76.68 164.33 25.99 Favored 'General case' 0 CA--C 1.509 -0.621 0 C-N-CA 124.813 1.245 . . . . 27.170000000000002 110.459 -173.017 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 48.6 t30 -89.26 166.34 13.85 Favored 'General case' 0 CA--C 1.476 -1.874 0 N-CA-C 102.374 -3.195 . . . . 31.300000000000001 102.374 176.655 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 45.7 p-90 -156.76 162.79 39.75 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 107.238 -1.393 . . . . 27.550000000000001 107.238 -175.897 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 10.0 ptpt -147.09 147.16 30.31 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.317 -0.623 . . . . 41.039999999999999 109.317 168.556 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 3.4 t -96.17 99.18 8.67 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 CA-C-O 122.527 1.156 . . . . 44.299999999999997 108.019 172.773 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.434 ' O ' ' CB ' ' A' ' 37' ' ' ASN . 42.2 tttp -93.09 118.28 31.02 Favored 'General case' 0 C--O 1.26 1.615 0 N-CA-C 100.49 -3.892 . . . . 56.700000000000003 100.49 179.817 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.439 ' HB3' ' H ' ' A' ' 38' ' ' LYS . 0.9 OUTLIER 71.82 -111.07 0.05 Allowed 'General case' 0 C--O 1.251 1.157 0 C-N-CA 117.79 -1.564 . . . . 64.159999999999997 112.321 164.41 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.439 ' H ' ' HB3' ' A' ' 37' ' ' ASN . 4.5 mttt -133.41 27.3 4.1 Favored 'General case' 0 CA--C 1.548 0.879 0 CA-C-N 114.139 -1.391 . . . . 60.640000000000001 107.972 172.736 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 13.0 m-70 -119.12 147.03 44.61 Favored 'General case' 0 CA--C 1.495 -1.158 0 N-CA-C 107.785 -1.191 . . . . 59.549999999999997 107.785 175.563 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.1 tp -107.28 122.78 47.23 Favored 'General case' 0 C--O 1.252 1.193 0 N-CA-C 108.47 -0.937 . . . . 39.850000000000001 108.47 168.283 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 36.3 ttm180 -98.81 119.07 36.94 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 114.497 -1.229 . . . . 35.509999999999998 110.491 176.987 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 83.4 mt -102.83 114.52 42.62 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 N-CA-C 108.131 -1.063 . . . . 28.120000000000001 108.131 173.802 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' TYR . . . . . 0.4 ' HB3' ' C6 ' ' A' ' 100' ' ' ADP . 64.0 m-85 -75.99 162.63 27.91 Favored 'General case' 0 CA--C 1.484 -1.561 0 N-CA-C 107.426 -1.324 . . . . 27.199999999999999 107.426 -178.563 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.497 ' ND2' ' C ' ' A' ' 63' ' ' GLY . 70.3 m-80 -68.89 -28.87 67.08 Favored 'General case' 0 CA--C 1.506 -0.718 0 N-CA-C 116.062 1.875 . . . . 32.100000000000001 116.062 178.933 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 76.9 mtm -127.23 153.78 45.67 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 114.837 1.421 . . . . 23.850000000000001 114.837 -171.505 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 14.5 p -54.27 171.19 0.12 Allowed 'General case' 0 C--O 1.213 -0.838 0 C-N-CA 120.556 -0.458 . . . . 28.52 110.704 169.668 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 10.3 tptm -70.37 -31.2 68.35 Favored 'General case' 0 C--N 1.322 -0.617 0 O-C-N 120.189 -1.569 . . . . 33.619999999999997 109.768 178.781 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 7.0 p -77.45 -37.73 50.92 Favored 'General case' 0 N--CA 1.441 -0.899 0 N-CA-C 106.598 -1.63 . . . . 32.619999999999997 106.598 -168.392 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 64.6 m -71.94 -29.69 64.55 Favored 'General case' 0 CA--C 1.48 -1.728 0 CA-C-O 118.584 -0.722 . . . . 26.940000000000001 112.01 178.065 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 86.1 t80 -68.69 -53.51 21.81 Favored 'General case' 0 CA--C 1.501 -0.906 0 CA-C-O 118.41 -0.805 . . . . 26.379999999999999 109.906 179.675 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 97.1 m-20 -50.42 -42.21 53.52 Favored 'General case' 0 CA--C 1.553 1.083 0 N-CA-C 114.369 1.248 . . . . 27.32 114.369 171.95 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -59.72 -43.5 94.15 Favored 'General case' 0 N--CA 1.465 0.293 0 O-C-N 121.656 -0.653 . . . . 28.699999999999999 110.997 174.026 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' SER . . . . . 0.868 ' OG ' ' HE1' ' A' ' 62' ' ' HIS . 0.5 OUTLIER -57.07 -35.48 69.41 Favored 'General case' 0 C--O 1.208 -1.08 0 N-CA-C 110.123 -0.325 . . . . 25.370000000000001 110.123 178.489 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 43.1 mt -70.65 -44.03 76.98 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.398 0 C-N-CA 118.939 -1.104 . . . . 25.350000000000001 110.649 179.525 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 76.6 m-20 -64.72 -35.48 81.2 Favored 'General case' 0 C--O 1.224 -0.266 0 N-CA-C 115.822 1.786 . . . . 35.43 115.822 178.595 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 5.6 pt -90.07 -11.32 10.04 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 CA-C-N 119.304 0.957 . . . . 25.579999999999998 111.988 -176.738 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 92.59 14.16 55.82 Favored Glycine 0 N--CA 1.434 -1.434 0 CA-C-O 119.39 -0.672 . . . . 24.09 114.524 174.791 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 53.1 t0 -106.96 131.17 54.34 Favored 'General case' 0 CA--C 1.469 -2.153 0 CA-C-N 119.12 1.46 . . . . 30.699999999999999 108.231 -176.314 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 44.9 p30 -121.74 20.33 10.97 Favored 'General case' 0 CA--C 1.51 -0.56 0 C-N-CA 119.25 -0.98 . . . . 37.710000000000001 112.456 173.413 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 7.0 p -63.13 -23.88 67.64 Favored 'General case' 0 CA--C 1.503 -0.857 0 C-N-CA 119.926 -0.709 . . . . 35.420000000000002 110.931 -176.118 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 92.5 m-85 -105.95 -1.12 24.42 Favored 'General case' 0 N--CA 1.482 1.146 0 N-CA-C 115.598 1.703 . . . . 37.390000000000001 115.598 -176.834 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' HIS . . . . . 0.868 ' HE1' ' OG ' ' A' ' 53' ' ' SER . 0.5 OUTLIER -51.9 150.89 3.85 Favored 'General case' 0 C--N 1.316 -0.86 0 O-C-N 121.25 -0.906 . . . . 29.27 111.445 168.011 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.497 ' C ' ' ND2' ' A' ' 44' ' ' ASN . . . 141.65 -177.1 21.49 Favored Glycine 0 N--CA 1.485 1.918 0 C-N-CA 123.582 0.611 . . . . 30.23 112.158 -178.805 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 16.5 p80 -179.2 164.37 1.38 Allowed 'General case' 0 CA--C 1.499 -1.001 0 CA-C-O 118.654 -0.689 . . . . 31.140000000000001 110.228 -177.047 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.474 ' OD2' ' NH2' ' A' ' 21' ' ' ARG . 0.5 OUTLIER -124.55 159.21 31.14 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 120.135 -0.626 . . . . 35.630000000000003 112.287 163.289 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 18.5 m-20 -112.87 137.45 51.21 Favored 'General case' 0 CA--C 1.495 -1.145 0 N-CA-C 113.317 0.858 . . . . 36.509999999999998 113.317 178.561 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 17.0 m95 -129.16 133.56 47.65 Favored 'General case' 0 C--O 1.244 0.802 0 N-CA-C 106.56 -1.644 . . . . 39.020000000000003 106.56 177.398 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.769 ' O ' ' HE2' ' A' ' 10' ' ' LYS . 2.7 pp -88.99 151.43 22.29 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 119.92 -0.712 . . . . 51.630000000000003 111.094 177.812 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 26.5 mtm -106.08 54.46 0.69 Allowed 'General case' 0 CA--C 1.579 2.079 0 N-CA-C 120.252 3.427 . . . . 60.149999999999999 120.252 -177.33 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' TYR . . . . . 0.419 ' O ' ' HB3' ' A' ' 71' ' ' ALA . 12.5 m-85 -136.6 163.24 31.02 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.829 1.252 . . . . 76.079999999999998 110.493 175.074 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' ALA . . . . . 0.419 ' HB3' ' O ' ' A' ' 70' ' ' TYR . . . . . . . . 0 C--O 1.234 0.244 0 C-N-CA 123.976 0.911 . . . . 66.390000000000001 111.318 174.34 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 300' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' ADP . . . . . 0.521 ' O2A' ' O2B' ' A' ' 100' ' ' ADP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 400' ' ' 1PE . . . . . 0.507 H142 H122 ' A' ' 400' ' ' 1PE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 stop_ save_