data_3l47_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 3l47 _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 ' 27' ' ' SER . . . . . 0.434 ' N ' ' O ' ' A' ' 8' ' ' HOH . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.213 0 CA-C-O 121.422 0.63 . . . . 30.440000000000001 109.824 . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 2.8 m -53.1 -52.95 25.2 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 CA-C-N 114.612 -1.176 . . . . 30.059999999999999 111.696 174.657 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 9.3 mt -52.6 -47.59 48.89 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.373 0 C-N-CA 119.1 -1.04 . . . . 29.57 110.102 -179.031 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -70.29 -34.15 72.41 Favored 'General case' 0 CA--C 1.544 0.732 0 CA-C-N 115.365 -0.834 . . . . 37.270000000000003 112.188 -173.791 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 7.7 m -74.71 -32.96 62.3 Favored 'General case' 0 CA--C 1.508 -0.643 0 CA-C-N 116.259 -0.428 . . . . 25.210000000000001 111.676 179.193 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 5.0 m -77.0 -31.83 56.75 Favored 'General case' 0 C--N 1.329 -0.297 0 O-C-N 124.091 0.869 . . . . 22.460000000000001 112.183 -178.065 -86.278 -56.745 -88.634 106.947 2.036 104.994 -86.746 174.14 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 5.9 p -65.28 -20.72 66.54 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 109.947 -0.39 . . . . 28.199999999999999 109.947 172.721 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 25.3 m-20 -98.24 -27.21 14.25 Favored 'General case' 0 C--O 1.215 -0.745 0 C-N-CA 119.9 -0.72 . . . . 30.960000000000001 112.933 177.372 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -78.42 -15.62 58.47 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 112.721 0.637 . . . . 25.489999999999998 112.721 177.914 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 40.9 t -112.0 126.03 69.36 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.226 0 N-CA-C 109.521 -0.548 . . . . 22.890000000000001 109.521 -178.256 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 7.8 mt-30 -63.03 133.18 54.14 Favored 'General case' 0 N--CA 1.441 -0.915 0 C-N-CA 120.277 -0.569 . . . . 47.759999999999998 110.513 179.345 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 85.81 -17.77 34.23 Favored Glycine 0 N--CA 1.443 -0.868 0 CA-C-N 115.876 -0.602 . . . . 24.489999999999998 112.334 -179.352 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -69.85 -20.63 63.41 Favored 'General case' 0 C--O 1.24 0.605 0 C-N-CA 119.766 -0.774 . . . . 22.850000000000001 112.305 -171.916 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -80.99 53.91 2.09 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 122.247 1.022 . . . . 24.420000000000002 111.402 -178.751 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 13.9 t30 -123.84 130.4 52.54 Favored 'General case' 0 CA--C 1.511 -0.544 0 CA-C-N 114.842 -1.072 . . . . 25.050000000000001 109.125 -165.576 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 69.7 m-20 -63.06 -30.67 71.78 Favored 'General case' 0 C--O 1.219 -0.521 0 N-CA-C 113.986 1.106 . . . . 34.009999999999998 113.986 -172.519 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' GLU . . . . . 0.401 ' O ' ' CD2' ' A' ' 47' ' ' HIS . 32.4 tt0 -81.6 -39.32 24.69 Favored 'General case' 0 C--N 1.314 -0.953 0 C-N-CA 119.862 -0.735 . . . . 43.549999999999997 111.72 -175.946 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.49 -48.54 77.22 Favored 'General case' 0 C--O 1.217 -0.634 0 C-N-CA 123.095 0.558 . . . . 27.649999999999999 112.124 174.795 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 13.2 mtpt -58.67 -29.18 66.39 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 123.065 0.546 . . . . 36.299999999999997 111.942 179.831 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -59.93 -50.48 79.97 Favored 'Isoleucine or valine' 0 C--O 1.246 0.876 0 N-CA-C 109.33 -0.619 . . . . 36.060000000000002 109.33 172.767 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' HIS . . . . . 0.401 ' CD2' ' O ' ' A' ' 43' ' ' GLU . 52.1 m-70 -58.2 -55.29 36.9 Favored 'General case' 0 C--O 1.226 -0.172 0 CA-C-N 115.807 -0.633 . . . . 38.07 112.085 174.466 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 11.8 m-30 -48.64 -43.17 36.26 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 115.948 1.833 . . . . 35.439999999999998 115.948 -177.982 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' ARG . . . . . 0.583 ' NH1' ' CG ' ' A' ' 49' ' ' ARG . 0.1 OUTLIER -76.69 -31.48 57.27 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 109.844 -0.428 . . . . 44.159999999999997 109.844 -178.23 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -78.62 9.82 3.75 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 121.279 0.561 . . . . 38.07 110.057 172.177 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.5 m120 52.72 35.61 18.91 Favored 'General case' 0 C--O 1.242 0.684 0 N-CA-C 114.582 1.327 . . . . 41.659999999999997 114.582 179.933 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -103.73 139.31 39.15 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 123.765 0.666 . . . . 44.380000000000003 110.319 168.359 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 94.2 m-85 -136.6 85.01 26.05 Favored Pre-proline 0 C--O 1.245 0.828 0 N-CA-C 113.826 1.047 . . . . 27.41 113.826 -174.15 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -61.91 157.71 42.05 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 124.696 3.597 . . . . 25.449999999999999 111.172 -170.554 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -87.46 84.17 7.19 Favored 'General case' 0 N--CA 1.437 -1.111 0 N-CA-C 107.825 -1.176 . . . . 28.670000000000002 107.825 -174.844 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -149.02 151.34 34.29 Favored Pre-proline 0 C--O 1.226 -0.167 0 CA-C-N 115.636 -0.711 . . . . 21.809999999999999 109.54 -177.491 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -62.29 -32.87 81.87 Favored 'Trans proline' 0 C--O 1.235 0.347 0 C-N-CA 121.624 1.549 . . . . 21.379999999999999 114.339 -168.334 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 24.8 t -63.2 -52.08 63.26 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.264 0 N-CA-C 109.302 -0.629 . . . . 21.010000000000002 109.302 174.267 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 19.2 m -59.97 -39.73 86.65 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-N 116.405 -0.361 . . . . 20.719999999999999 110.806 -178.114 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 61.0 m170 -50.76 -47.87 59.42 Favored 'General case' 0 C--O 1.235 0.318 0 O-C-N 123.919 0.762 . . . . 21.719999999999999 110.405 177.702 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 75.8 m -74.44 -37.3 63.32 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.086 0.47 . . . . 18.510000000000002 111.922 -177.186 -71.153 -47.204 99.54 107.635 2.041 97.756 -163.429 -66.246 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -57.77 -45.43 85.96 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.187 -0.46 . . . . 23.010000000000002 112.177 174.193 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 55.3 t -64.21 -46.01 94.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.075 -0.512 . . . . 19.100000000000001 111.308 177.714 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 53.6 ttt-85 -53.22 -41.59 65.51 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 112.382 0.512 . . . . 20.379999999999999 112.382 173.227 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 36.1 t -69.37 -43.87 72.68 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.08 -0.509 . . . . 18.440000000000001 111.512 -176.925 174.14 -86.746 -88.634 104.994 2.036 106.947 -56.745 -86.278 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 19.5 mm -59.32 -53.63 45.51 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.579 0 N-CA-C 107.815 -1.179 . . . . 22.469999999999999 107.815 177.187 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -48.2 -49.23 25.32 Favored Glycine 0 C--O 1.215 -1.04 0 CA-C-N 114.838 -1.074 . . . . 20.699999999999999 113.414 174.831 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 34.4 mt -68.96 -35.49 76.81 Favored 'General case' 0 C--O 1.22 -0.477 0 CA-C-N 118.452 1.126 . . . . 25.149999999999999 112.547 179.581 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 50.1 mm-40 -72.86 -38.83 66.9 Favored 'General case' 0 CA--C 1.505 -0.752 0 O-C-N 121.715 -0.616 . . . . 30.82 112.084 -174.151 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 76.4 mt -83.9 -5.93 59.32 Favored 'General case' 0 CA--C 1.51 -0.586 0 O-C-N 124.17 0.919 . . . . 25.600000000000001 112.06 178.127 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 67.25 31.7 6.44 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 119.287 -0.965 . . . . 31.91 111.852 179.457 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 28.1 mt -93.16 -4.27 52.46 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 109.53 -0.545 . . . . 22.879999999999999 109.53 175.714 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 89.3 t80 -161.78 160.58 28.49 Favored 'General case' 0 C--O 1.242 0.66 0 CA-C-O 121.407 0.622 . . . . 21.359999999999999 111.213 -167.546 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -158.26 136.62 10.94 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 107.579 -1.267 . . . . 25.109999999999999 107.579 -177.592 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 75.1 m-20 -57.96 -42.74 85.6 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 114.877 1.436 . . . . 23.879999999999999 114.877 -179.337 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 10.3 tttp -81.57 -52.39 7.26 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 116.291 -0.413 . . . . 31.989999999999998 111.047 -176.794 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 61.5 m-85 -89.15 -11.73 43.01 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 116.08 1.882 . . . . 28.289999999999999 116.08 -173.265 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 83.62 -145.66 22.96 Favored Glycine 0 CA--C 1.524 0.652 0 N-CA-C 116.836 1.494 . . . . 22.949999999999999 116.836 174.826 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 60.8 t -80.58 129.31 37.75 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.567 0 CA-C-N 115.435 -0.383 . . . . 21.149999999999999 110.289 -177.208 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -88.09 105.48 17.52 Favored 'General case' 0 N--CA 1.449 -0.524 0 N-CA-C 107.005 -1.48 . . . . 21.5 107.005 173.958 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 63.8 mt -74.83 -33.89 62.25 Favored 'General case' 0 CA--C 1.507 -0.676 0 CA-C-N 115.639 -0.709 . . . . 21.23 110.572 -165.386 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 61.5 tp60 -65.41 -42.21 92.76 Favored 'General case' 0 CA--C 1.55 0.971 0 O-C-N 123.7 0.625 . . . . 20.32 110.838 174.836 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -64.49 -38.16 90.04 Favored 'General case' 0 CA--C 1.508 -0.664 0 CA-C-O 121.102 0.477 . . . . 20.140000000000001 110.521 -178.604 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 20.6 m-80 -68.26 -42.95 78.86 Favored 'General case' 0 C--O 1.222 -0.357 0 CA-C-N 115.246 -0.888 . . . . 21.620000000000001 111.729 177.46 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' TRP . . . . . . . . . . . . . 76.1 t-105 -47.78 -46.73 30.64 Favored 'General case' 0 C--O 1.219 -0.546 0 CA-C-N 116.009 -0.541 . . . . 23.350000000000001 109.877 171.314 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -63.35 -46.33 87.07 Favored 'General case' 0 C--O 1.25 1.131 0 CA-C-O 121.866 0.841 . . . . 29.100000000000001 111.943 177.48 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 40.7 t30 -67.41 -3.94 9.73 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.198 -0.91 . . . . 28.739999999999998 112.566 -176.698 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -104.16 19.26 20.46 Favored 'General case' 0 C--O 1.241 0.654 0 N-CA-C 108.692 -0.855 . . . . 29.600000000000001 108.692 178.767 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 80.61 40.38 12.73 Favored Glycine 0 CA--C 1.521 0.456 0 CA-C-N 115.54 -0.754 . . . . 32.670000000000002 114.206 176.596 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' ASN . . . . . . . . . . . . . 34.5 m120 -131.45 150.86 51.99 Favored 'General case' 0 CA--C 1.506 -0.722 0 N-CA-C 109.12 -0.696 . . . . 28.91 109.12 177.656 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 5.3 p -120.27 -6.99 9.85 Favored 'General case' 0 C--O 1.238 0.487 0 N-CA-C 112.826 0.676 . . . . 28.710000000000001 112.826 178.241 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 46.8 p-10 -89.63 174.61 7.66 Favored 'General case' 0 C--N 1.333 -0.139 0 N-CA-C 112.817 0.673 . . . . 24.120000000000001 112.817 179.856 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 85.1 m-20 -54.67 137.16 44.59 Favored 'General case' 0 C--O 1.225 -0.195 0 N-CA-C 108.264 -1.013 . . . . 25.489999999999998 108.264 166.996 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -58.74 137.13 57.81 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 112.502 0.556 . . . . 19.57 112.502 178.737 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 84.3 m-20 -45.37 140.25 3.18 Favored 'General case' 0 C--O 1.244 0.805 0 O-C-N 123.752 0.658 . . . . 26.329999999999998 110.617 165.406 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -65.04 -35.43 81.14 Favored 'General case' 0 C--O 1.221 -0.4 0 CA-C-O 120.876 0.369 . . . . 24.469999999999999 111.556 -178.885 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -57.99 -45.93 86.0 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 121.457 0.646 . . . . 31.539999999999999 109.772 178.179 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 50.4 t80 -62.69 -46.34 88.58 Favored 'General case' 0 C--O 1.241 0.613 0 CA-C-N 115.006 -0.997 . . . . 22.57 110.211 -175.237 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 89.8 t -64.42 -47.24 90.29 Favored 'Isoleucine or valine' 0 C--O 1.235 0.311 0 CA-C-N 115.506 -0.77 . . . . 20.73 109.504 178.77 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -63.3 -51.05 67.66 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-O 121.208 0.528 . . . . 20.77 111.727 -176.872 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 31.8 tttt -44.76 -68.88 0.16 Allowed 'General case' 0 N--CA 1.409 -2.502 0 N-CA-C 117.394 2.368 . . . . 30.82 117.394 169.762 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' HIS . . . . . 0.583 ' CE1' ' OD2' ' A' ' 131' ' ' ASP . 54.8 m80 -67.16 -30.84 70.93 Favored 'General case' 0 C--N 1.31 -1.145 0 N-CA-C 115.058 1.503 . . . . 23.510000000000002 115.058 -177.094 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 49.4 ttm-85 -64.96 -37.34 87.31 Favored 'General case' 0 CA--C 1.549 0.917 0 N-CA-C 107.957 -1.127 . . . . 43.700000000000003 107.957 174.834 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.56 -53.08 53.43 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 112.84 0.682 . . . . 21.370000000000001 112.84 172.942 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 53.2 t -48.48 -42.99 34.45 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 122.764 0.426 . . . . 20.100000000000001 111.894 174.734 -179.746 -81.847 -96.49 101.882 2.021 96.43 -60.041 -79.262 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 39.2 mt -75.76 -39.26 57.39 Favored 'General case' 0 C--O 1.222 -0.356 0 C-N-CA 120.758 -0.377 . . . . 20.16 110.792 -174.931 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -56.54 -48.33 77.49 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.511 -0.551 . . . . 40.759999999999998 109.511 175.846 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -62.01 -21.49 64.91 Favored 'General case' 0 CA--C 1.551 1.016 0 N-CA-C 115.129 1.529 . . . . 22.98 115.129 -179.058 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 23.0 mttm -78.75 -8.86 59.15 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 114.695 1.369 . . . . 22.289999999999999 114.695 175.838 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 15.5 m120 39.54 61.82 1.31 Allowed 'General case' 0 CA--C 1.514 -0.407 0 CA-C-O 121.219 0.533 . . . . 28.800000000000001 112.148 -176.614 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 31.5 mt -58.73 -31.86 68.69 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.714 -0.675 . . . . 23.940000000000001 111.064 -177.798 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 27.2 mt-10 -66.93 -12.2 58.79 Favored 'General case' 0 C--O 1.212 -0.869 0 N-CA-C 112.758 0.651 . . . . 51.840000000000003 112.758 -174.771 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 18.0 p -99.75 -11.38 20.88 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 122.312 0.245 . . . . 25.359999999999999 111.434 179.648 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 61.1 mt -79.41 114.21 19.87 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.182 0 CA-C-O 122.336 1.065 . . . . 23.489999999999998 108.974 173.094 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -80.38 -47.44 14.43 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.387 -0.824 . . . . 43.159999999999997 110.571 -172.349 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -65.0 120.93 13.53 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 121.501 0.667 . . . . 24.579999999999998 111.098 174.288 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 74.5 mt -67.99 -34.86 77.33 Favored 'General case' 0 C--O 1.238 0.486 0 N-CA-C 114.024 1.12 . . . . 21.359999999999999 114.024 -174.389 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 94.0 m -69.15 -39.23 78.95 Favored 'General case' 0 C--O 1.243 0.722 0 CA-C-O 122.15 0.976 . . . . 20.039999999999999 109.296 179.852 -66.246 -163.429 99.54 97.756 2.041 107.635 -47.204 -71.153 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 -70.64 -34.41 72.03 Favored 'General case' 0 N--CA 1.425 -1.723 0 CA-C-N 114.815 -1.084 . . . . 28.399999999999999 109.972 -179.155 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 34.8 ttm180 -63.92 -45.65 88.3 Favored 'General case' 0 C--O 1.224 -0.287 0 C-N-CA 120.761 -0.376 . . . . 25.039999999999999 111.857 177.025 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -64.52 -38.8 92.26 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 116.09 -0.505 . . . . 18.050000000000001 111.353 179.006 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' TYR . . . . . . . . . . . . . 70.4 t80 -69.0 -37.71 78.86 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 121.431 0.634 . . . . 23.559999999999999 109.953 -177.791 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 27.4 t -68.93 -36.29 77.79 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 114.39 -1.277 . . . . 20.289999999999999 111.792 179.492 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -66.01 -42.42 89.74 Favored 'General case' 0 C--O 1.244 0.809 0 CA-C-O 121.543 0.687 . . . . 19.93 110.215 179.417 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -75.26 -14.41 60.51 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 114.966 -1.015 . . . . 22.23 113.177 -172.853 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -70.84 -21.01 62.49 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 117.602 -1.639 . . . . 26.219999999999999 112.969 174.957 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 25.9 m -59.87 -33.13 71.4 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 122.684 0.394 . . . . 24.510000000000002 111.847 173.464 -79.262 -60.041 -96.49 96.43 2.021 101.882 -81.847 -179.746 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 6.0 mp -99.53 0.73 42.93 Favored 'General case' 0 N--CA 1.467 0.39 0 O-C-N 124.246 0.966 . . . . 27.440000000000001 113.202 -173.547 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 36.9 ttp180 -62.67 -39.11 92.9 Favored 'General case' 0 CA--C 1.553 1.084 0 N-CA-C 113.137 0.792 . . . . 53.890000000000001 113.137 -178.188 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -61.74 -36.19 80.28 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 118.493 -1.283 . . . . 39.859999999999999 109.472 -179.151 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' ASP . . . . . 0.583 ' OD2' ' CE1' ' A' ' 102' ' ' HIS . 47.1 m-20 -66.58 -51.56 55.08 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 114.414 1.265 . . . . 33.920000000000002 114.414 178.492 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' TYR . . . . . . . . . . . . . 32.7 m-85 -58.45 -44.09 89.09 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 116.285 -0.416 . . . . 37.359999999999999 111.291 177.908 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 71.9 mt-10 -65.72 -43.2 89.81 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 114.19 1.181 . . . . 46.840000000000003 114.19 -178.435 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.52 20.16 0.33 Allowed 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 118.1 -1.44 . . . . 50.090000000000003 112.787 178.079 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' TYR . . . . . . . . . . . . . 11.3 t80 . . . . . 0 C--O 1.24 0.57 0 N-CA-C 112.327 0.492 . . . . 42.229999999999997 112.327 179.295 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 1' ' ' ' AU' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' ' AU' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' HOH . . . . . 0.434 ' O ' ' N ' ' A' ' 27' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' HOH . . . . . 0.498 ' O ' ' NH1' ' A' ' 49' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 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 ' 175' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 176' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 177' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 178' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 179' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 180' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 181' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 182' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 27' ' ' SER . . . . . 0.434 ' N ' ' O ' ' A' ' 8' ' ' HOH . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.213 0 CA-C-O 121.422 0.63 . . . . 30.440000000000001 109.824 . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 28' ' ' VAL . . . . . 0.502 HG22 ' O ' ' A' ' 165' ' ' HOH . 2.8 m -53.1 -52.95 25.2 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 CA-C-N 114.612 -1.176 . . . . 30.059999999999999 111.696 174.657 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 9.3 mt -52.6 -47.59 48.89 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.373 0 C-N-CA 119.1 -1.04 . . . . 29.57 110.102 -179.031 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -70.29 -34.15 72.41 Favored 'General case' 0 CA--C 1.544 0.732 0 CA-C-N 115.365 -0.834 . . . . 37.270000000000003 112.188 -173.791 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 7.7 m -74.71 -32.96 62.3 Favored 'General case' 0 CA--C 1.508 -0.643 0 CA-C-N 116.259 -0.428 . . . . 25.210000000000001 111.676 179.193 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 5.0 m -77.0 -31.83 56.75 Favored 'General case' 0 C--N 1.329 -0.297 0 O-C-N 124.091 0.869 . . . . 22.460000000000001 112.183 -178.065 -86.278 -56.745 -88.634 106.947 2.036 104.994 -86.746 174.14 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 5.9 p -65.28 -20.72 66.54 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 109.947 -0.39 . . . . 28.199999999999999 109.947 172.721 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 25.3 m-20 -98.24 -27.21 14.25 Favored 'General case' 0 C--O 1.215 -0.745 0 C-N-CA 119.9 -0.72 . . . . 30.960000000000001 112.933 177.372 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -78.42 -15.62 58.47 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 112.721 0.637 . . . . 25.489999999999998 112.721 177.914 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 40.9 t -112.0 126.03 69.36 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.226 0 N-CA-C 109.521 -0.548 . . . . 22.890000000000001 109.521 -178.256 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 29.6 mt-30 -63.03 133.18 54.14 Favored 'General case' 0 N--CA 1.441 -0.915 0 C-N-CA 120.277 -0.569 . . . . 47.759999999999998 110.513 179.345 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 85.81 -17.77 34.23 Favored Glycine 0 N--CA 1.443 -0.868 0 CA-C-N 115.876 -0.602 . . . . 24.489999999999998 112.334 -179.352 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -69.85 -20.63 63.41 Favored 'General case' 0 C--O 1.24 0.605 0 C-N-CA 119.766 -0.774 . . . . 22.850000000000001 112.305 -171.916 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -80.99 53.91 2.09 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 122.247 1.022 . . . . 24.420000000000002 111.402 -178.751 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -123.84 130.4 52.54 Favored 'General case' 0 CA--C 1.511 -0.544 0 CA-C-N 114.842 -1.072 . . . . 25.050000000000001 109.125 -165.576 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 69.7 m-20 -63.06 -30.67 71.78 Favored 'General case' 0 C--O 1.219 -0.521 0 N-CA-C 113.986 1.106 . . . . 34.009999999999998 113.986 -172.519 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' GLU . . . . . 0.616 ' O ' ' HD2' ' A' ' 47' ' ' HIS . 32.4 tt0 -81.6 -39.32 24.69 Favored 'General case' 0 C--N 1.314 -0.953 0 C-N-CA 119.862 -0.735 . . . . 43.549999999999997 111.72 -175.946 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.49 -48.54 77.22 Favored 'General case' 0 C--O 1.217 -0.634 0 C-N-CA 123.095 0.558 . . . . 27.649999999999999 112.124 174.795 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 13.2 mtpt -58.67 -29.18 66.39 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 123.065 0.546 . . . . 36.299999999999997 111.942 179.831 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -59.93 -50.48 79.97 Favored 'Isoleucine or valine' 0 C--O 1.246 0.876 0 N-CA-C 109.33 -0.619 . . . . 36.060000000000002 109.33 172.767 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 47' ' ' HIS . . . . . 0.662 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 52.1 m-70 -58.2 -55.29 36.9 Favored 'General case' 0 C--O 1.226 -0.172 0 CA-C-N 115.807 -0.633 . . . . 38.07 112.085 174.466 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 11.8 m-30 -48.64 -43.17 36.26 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 115.948 1.833 . . . . 35.439999999999998 115.948 -177.982 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' ARG . . . . . 1.039 HH11 ' HG3' ' A' ' 49' ' ' ARG . 0.1 OUTLIER -76.69 -31.48 57.27 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 109.844 -0.428 . . . . 44.159999999999997 109.844 -178.23 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -78.62 9.82 3.75 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 121.279 0.561 . . . . 38.07 110.057 172.177 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.5 m120 52.72 35.61 18.91 Favored 'General case' 0 C--O 1.242 0.684 0 N-CA-C 114.582 1.327 . . . . 41.659999999999997 114.582 179.933 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' GLU . . . . . 0.662 ' HG3' ' HA ' ' A' ' 47' ' ' HIS . 3.2 pt-20 -103.73 139.31 39.15 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 123.765 0.666 . . . . 44.380000000000003 110.319 168.359 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 94.2 m-85 -136.6 85.01 26.05 Favored Pre-proline 0 C--O 1.245 0.828 0 N-CA-C 113.826 1.047 . . . . 27.41 113.826 -174.15 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -61.91 157.71 42.05 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 124.696 3.597 . . . . 25.449999999999999 111.172 -170.554 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -87.46 84.17 7.19 Favored 'General case' 0 N--CA 1.437 -1.111 0 N-CA-C 107.825 -1.176 . . . . 28.670000000000002 107.825 -174.844 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -149.02 151.34 34.29 Favored Pre-proline 0 C--O 1.226 -0.167 0 CA-C-N 115.636 -0.711 . . . . 21.809999999999999 109.54 -177.491 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -62.29 -32.87 81.87 Favored 'Trans proline' 0 C--O 1.235 0.347 0 C-N-CA 121.624 1.549 . . . . 21.379999999999999 114.339 -168.334 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 24.8 t -63.2 -52.08 63.26 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.264 0 N-CA-C 109.302 -0.629 . . . . 21.010000000000002 109.302 174.267 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 19.2 m -59.97 -39.73 86.65 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-N 116.405 -0.361 . . . . 20.719999999999999 110.806 -178.114 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 61.0 m170 -50.76 -47.87 59.42 Favored 'General case' 0 C--O 1.235 0.318 0 O-C-N 123.919 0.762 . . . . 21.719999999999999 110.405 177.702 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 75.8 m -74.44 -37.3 63.32 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.086 0.47 . . . . 18.510000000000002 111.922 -177.186 -71.153 -47.204 99.54 107.635 2.041 97.756 -163.429 -66.246 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -57.77 -45.43 85.96 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.187 -0.46 . . . . 23.010000000000002 112.177 174.193 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 55.3 t -64.21 -46.01 94.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.075 -0.512 . . . . 19.100000000000001 111.308 177.714 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 53.6 ttt-85 -53.22 -41.59 65.51 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 112.382 0.512 . . . . 20.379999999999999 112.382 173.227 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 36.1 t -69.37 -43.87 72.68 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.08 -0.509 . . . . 18.440000000000001 111.512 -176.925 174.14 -86.746 -88.634 104.994 2.036 106.947 -56.745 -86.278 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 19.5 mm -59.32 -53.63 45.51 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.579 0 N-CA-C 107.815 -1.179 . . . . 22.469999999999999 107.815 177.187 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -48.2 -49.23 25.32 Favored Glycine 0 C--O 1.215 -1.04 0 CA-C-N 114.838 -1.074 . . . . 20.699999999999999 113.414 174.831 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 34.4 mt -68.96 -35.49 76.81 Favored 'General case' 0 C--O 1.22 -0.477 0 CA-C-N 118.452 1.126 . . . . 25.149999999999999 112.547 179.581 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 50.1 mm-40 -72.86 -38.83 66.9 Favored 'General case' 0 CA--C 1.505 -0.752 0 O-C-N 121.715 -0.616 . . . . 30.82 112.084 -174.151 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' LEU . . . . . 0.488 ' O ' ' HB2' ' A' ' 71' ' ' ASN . 76.4 mt -83.9 -5.93 59.32 Favored 'General case' 0 CA--C 1.51 -0.586 0 O-C-N 124.17 0.919 . . . . 25.600000000000001 112.06 178.127 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 71' ' ' ASN . . . . . 0.488 ' HB2' ' O ' ' A' ' 70' ' ' LEU . 5.8 m-80 67.25 31.7 6.44 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 119.287 -0.965 . . . . 31.91 111.852 179.457 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 28.1 mt -93.16 -4.27 52.46 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 109.53 -0.545 . . . . 22.879999999999999 109.53 175.714 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 89.3 t80 -161.78 160.58 28.49 Favored 'General case' 0 C--O 1.242 0.66 0 CA-C-O 121.407 0.622 . . . . 21.359999999999999 111.213 -167.546 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -158.26 136.62 10.94 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 107.579 -1.267 . . . . 25.109999999999999 107.579 -177.592 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 75.1 m-20 -57.96 -42.74 85.6 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 114.877 1.436 . . . . 23.879999999999999 114.877 -179.337 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 10.3 tttp -81.57 -52.39 7.26 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 116.291 -0.413 . . . . 31.989999999999998 111.047 -176.794 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 61.5 m-85 -89.15 -11.73 43.01 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 116.08 1.882 . . . . 28.289999999999999 116.08 -173.265 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 83.62 -145.66 22.96 Favored Glycine 0 CA--C 1.524 0.652 0 N-CA-C 116.836 1.494 . . . . 22.949999999999999 116.836 174.826 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 60.8 t -80.58 129.31 37.75 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.567 0 CA-C-N 115.435 -0.383 . . . . 21.149999999999999 110.289 -177.208 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -88.09 105.48 17.52 Favored 'General case' 0 N--CA 1.449 -0.524 0 N-CA-C 107.005 -1.48 . . . . 21.5 107.005 173.958 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 63.8 mt -74.83 -33.89 62.25 Favored 'General case' 0 CA--C 1.507 -0.676 0 CA-C-N 115.639 -0.709 . . . . 21.23 110.572 -165.386 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' GLN . . . . . 0.635 ' O ' ' HG2' ' A' ' 86' ' ' GLU . 61.5 tp60 -65.41 -42.21 92.76 Favored 'General case' 0 CA--C 1.55 0.971 0 O-C-N 123.7 0.625 . . . . 20.32 110.838 174.836 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -64.49 -38.16 90.04 Favored 'General case' 0 CA--C 1.508 -0.664 0 CA-C-O 121.102 0.477 . . . . 20.140000000000001 110.521 -178.604 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 20.6 m-80 -68.26 -42.95 78.86 Favored 'General case' 0 C--O 1.222 -0.357 0 CA-C-N 115.246 -0.888 . . . . 21.620000000000001 111.729 177.46 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' TRP . . . . . . . . . . . . . 76.1 t-105 -47.78 -46.73 30.64 Favored 'General case' 0 C--O 1.219 -0.546 0 CA-C-N 116.009 -0.541 . . . . 23.350000000000001 109.877 171.314 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' GLU . . . . . 0.635 ' HG2' ' O ' ' A' ' 82' ' ' GLN . 1.3 mm-40 -63.35 -46.33 87.07 Favored 'General case' 0 C--O 1.25 1.131 0 CA-C-O 121.866 0.841 . . . . 29.100000000000001 111.943 177.48 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 40.7 t30 -67.41 -3.94 9.73 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.198 -0.91 . . . . 28.739999999999998 112.566 -176.698 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' LEU . . . . . 0.451 HD13 ' CE1' ' A' ' 132' ' ' TYR . 0.0 OUTLIER -104.16 19.26 20.46 Favored 'General case' 0 C--O 1.241 0.654 0 N-CA-C 108.692 -0.855 . . . . 29.600000000000001 108.692 178.767 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 80.61 40.38 12.73 Favored Glycine 0 CA--C 1.521 0.456 0 CA-C-N 115.54 -0.754 . . . . 32.670000000000002 114.206 176.596 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' ASN . . . . . 0.446 ' O ' ' HA ' ' A' ' 86' ' ' GLU . 34.5 m120 -131.45 150.86 51.99 Favored 'General case' 0 CA--C 1.506 -0.722 0 N-CA-C 109.12 -0.696 . . . . 28.91 109.12 177.656 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 5.3 p -120.27 -6.99 9.85 Favored 'General case' 0 C--O 1.238 0.487 0 N-CA-C 112.826 0.676 . . . . 28.710000000000001 112.826 178.241 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 46.8 p-10 -89.63 174.61 7.66 Favored 'General case' 0 C--N 1.333 -0.139 0 N-CA-C 112.817 0.673 . . . . 24.120000000000001 112.817 179.856 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 85.1 m-20 -54.67 137.16 44.59 Favored 'General case' 0 C--O 1.225 -0.195 0 N-CA-C 108.264 -1.013 . . . . 25.489999999999998 108.264 166.996 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -58.74 137.13 57.81 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 112.502 0.556 . . . . 19.57 112.502 178.737 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 84.3 m-20 -45.37 140.25 3.18 Favored 'General case' 0 C--O 1.244 0.805 0 O-C-N 123.752 0.658 . . . . 26.329999999999998 110.617 165.406 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -65.04 -35.43 81.14 Favored 'General case' 0 C--O 1.221 -0.4 0 CA-C-O 120.876 0.369 . . . . 24.469999999999999 111.556 -178.885 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' GLU . . . . . 0.537 ' O ' ' HB2' ' A' ' 101' ' ' LYS . 3.3 mp0 -57.99 -45.93 86.0 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 121.457 0.646 . . . . 31.539999999999999 109.772 178.179 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 50.4 t80 -62.69 -46.34 88.58 Favored 'General case' 0 C--O 1.241 0.613 0 CA-C-N 115.006 -0.997 . . . . 22.57 110.211 -175.237 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 89.8 t -64.42 -47.24 90.29 Favored 'Isoleucine or valine' 0 C--O 1.235 0.311 0 CA-C-N 115.506 -0.77 . . . . 20.73 109.504 178.77 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -63.3 -51.05 67.66 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-O 121.208 0.528 . . . . 20.77 111.727 -176.872 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' LYS . . . . . 0.537 ' HB2' ' O ' ' A' ' 97' ' ' GLU . 31.8 tttt -44.76 -68.88 0.16 Allowed 'General case' 0 N--CA 1.409 -2.502 0 N-CA-C 117.394 2.368 . . . . 30.82 117.394 169.762 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 102' ' ' HIS . . . . . 0.583 ' CE1' ' OD2' ' A' ' 131' ' ' ASP . 54.8 m80 -67.16 -30.84 70.93 Favored 'General case' 0 C--N 1.31 -1.145 0 N-CA-C 115.058 1.503 . . . . 23.510000000000002 115.058 -177.094 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 49.4 ttm-85 -64.96 -37.34 87.31 Favored 'General case' 0 CA--C 1.549 0.917 0 N-CA-C 107.957 -1.127 . . . . 43.700000000000003 107.957 174.834 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.56 -53.08 53.43 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 112.84 0.682 . . . . 21.370000000000001 112.84 172.942 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' CYS . . . . . 0.424 ' O ' ' HG3' ' A' ' 109' ' ' LYS . 53.2 t -48.48 -42.99 34.45 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 122.764 0.426 . . . . 20.100000000000001 111.894 174.734 -179.746 -81.847 -96.49 101.882 2.021 96.43 -60.041 -79.262 2 2 . 1 . 001 ecloud build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 39.2 mt -75.76 -39.26 57.39 Favored 'General case' 0 C--O 1.222 -0.356 0 C-N-CA 120.758 -0.377 . . . . 20.16 110.792 -174.931 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -56.54 -48.33 77.49 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.511 -0.551 . . . . 40.759999999999998 109.511 175.846 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -62.01 -21.49 64.91 Favored 'General case' 0 CA--C 1.551 1.016 0 N-CA-C 115.129 1.529 . . . . 22.98 115.129 -179.058 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' LYS . . . . . 0.424 ' HG3' ' O ' ' A' ' 105' ' ' CYS . 23.0 mttm -78.75 -8.86 59.15 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 114.695 1.369 . . . . 22.289999999999999 114.695 175.838 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 15.5 m120 39.54 61.82 1.31 Allowed 'General case' 0 CA--C 1.514 -0.407 0 CA-C-O 121.219 0.533 . . . . 28.800000000000001 112.148 -176.614 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 31.5 mt -58.73 -31.86 68.69 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.714 -0.675 . . . . 23.940000000000001 111.064 -177.798 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 27.2 mt-10 -66.93 -12.2 58.79 Favored 'General case' 0 C--O 1.212 -0.869 0 N-CA-C 112.758 0.651 . . . . 51.840000000000003 112.758 -174.771 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 18.0 p -99.75 -11.38 20.88 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 122.312 0.245 . . . . 25.359999999999999 111.434 179.648 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 61.1 mt -79.41 114.21 19.87 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.182 0 CA-C-O 122.336 1.065 . . . . 23.489999999999998 108.974 173.094 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -80.38 -47.44 14.43 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.387 -0.824 . . . . 43.159999999999997 110.571 -172.349 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -65.0 120.93 13.53 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 121.501 0.667 . . . . 24.579999999999998 111.098 174.288 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 74.5 mt -67.99 -34.86 77.33 Favored 'General case' 0 C--O 1.238 0.486 0 N-CA-C 114.024 1.12 . . . . 21.359999999999999 114.024 -174.389 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 94.0 m -69.15 -39.23 78.95 Favored 'General case' 0 C--O 1.243 0.722 0 CA-C-O 122.15 0.976 . . . . 20.039999999999999 109.296 179.852 -66.246 -163.429 99.54 97.756 2.041 107.635 -47.204 -71.153 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 -70.64 -34.41 72.03 Favored 'General case' 0 N--CA 1.425 -1.723 0 CA-C-N 114.815 -1.084 . . . . 28.399999999999999 109.972 -179.155 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 34.8 ttm180 -63.92 -45.65 88.3 Favored 'General case' 0 C--O 1.224 -0.287 0 C-N-CA 120.761 -0.376 . . . . 25.039999999999999 111.857 177.025 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -64.52 -38.8 92.26 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 116.09 -0.505 . . . . 18.050000000000001 111.353 179.006 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' TYR . . . . . . . . . . . . . 70.4 t80 -69.0 -37.71 78.86 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 121.431 0.634 . . . . 23.559999999999999 109.953 -177.791 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' SER . . . . . 0.564 ' O ' ' HG2' ' A' ' 126' ' ' GLN . 27.4 t -68.93 -36.29 77.79 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 114.39 -1.277 . . . . 20.289999999999999 111.792 179.492 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -66.01 -42.42 89.74 Favored 'General case' 0 C--O 1.244 0.809 0 CA-C-O 121.543 0.687 . . . . 19.93 110.215 179.417 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -75.26 -14.41 60.51 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 114.966 -1.015 . . . . 22.23 113.177 -172.853 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' GLN . . . . . 0.564 ' HG2' ' O ' ' A' ' 123' ' ' SER . 9.8 pt20 -70.84 -21.01 62.49 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 117.602 -1.639 . . . . 26.219999999999999 112.969 174.957 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 25.9 m -59.87 -33.13 71.4 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 122.684 0.394 . . . . 24.510000000000002 111.847 173.464 -79.262 -60.041 -96.49 96.43 2.021 101.882 -81.847 -179.746 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 6.0 mp -99.53 0.73 42.93 Favored 'General case' 0 N--CA 1.467 0.39 0 O-C-N 124.246 0.966 . . . . 27.440000000000001 113.202 -173.547 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 36.9 ttp180 -62.67 -39.11 92.9 Favored 'General case' 0 CA--C 1.553 1.084 0 N-CA-C 113.137 0.792 . . . . 53.890000000000001 113.137 -178.188 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -61.74 -36.19 80.28 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 118.493 -1.283 . . . . 39.859999999999999 109.472 -179.151 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' ASP . . . . . 0.583 ' OD2' ' CE1' ' A' ' 102' ' ' HIS . 47.1 m-20 -66.58 -51.56 55.08 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 114.414 1.265 . . . . 33.920000000000002 114.414 178.492 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 132' ' ' TYR . . . . . 0.451 ' CE1' HD13 ' A' ' 88' ' ' LEU . 32.7 m-85 -58.45 -44.09 89.09 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 116.285 -0.416 . . . . 37.359999999999999 111.291 177.908 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 71.9 mt-10 -65.72 -43.2 89.81 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 114.19 1.181 . . . . 46.840000000000003 114.19 -178.435 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 134' ' ' MET . . . . . 0.495 ' HB3' ' O ' ' A' ' 174' ' ' HOH . 0.0 OUTLIER -77.52 20.16 0.33 Allowed 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 118.1 -1.44 . . . . 50.090000000000003 112.787 178.079 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 135' ' ' TYR . . . . . . . . . . . . . 11.3 t80 . . . . . 0 C--O 1.24 0.57 0 N-CA-C 112.327 0.492 . . . . 42.229999999999997 112.327 179.295 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' ' AU' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' ' AU' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 3' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 4' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 5' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 6' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 7' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 8' ' ' HOH . . . . . 0.434 ' O ' ' N ' ' A' ' 27' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 10' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 11' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 12' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 13' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 14' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 15' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 16' ' ' HOH . . . . . 0.498 ' O ' ' NH1' ' A' ' 49' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 18' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 19' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 20' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 21' ' ' 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 . . . . . 0.502 ' O ' HG22 ' A' ' 28' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 . . . . . 0.495 ' O ' ' HB3' ' A' ' 134' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 175' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 176' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 177' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 178' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 179' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 180' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 181' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 182' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' SER . . . . . 0.434 ' N ' ' O ' ' A' ' 8' ' ' HOH . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.213 0 CA-C-O 121.422 0.63 . . . . 30.440000000000001 109.824 . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.502 HG22 ' O ' ' A' ' 165' ' ' HOH . 2.8 m -53.1 -52.95 25.2 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 CA-C-N 114.612 -1.176 . . . . 30.059999999999999 111.696 174.657 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 9.3 mt -52.6 -47.59 48.89 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.373 0 C-N-CA 119.1 -1.04 . . . . 29.57 110.102 -179.031 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -70.29 -34.15 72.41 Favored 'General case' 0 CA--C 1.544 0.732 0 CA-C-N 115.365 -0.834 . . . . 37.270000000000003 112.188 -173.791 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 7.7 m -74.71 -32.96 62.3 Favored 'General case' 0 CA--C 1.508 -0.643 0 CA-C-N 116.259 -0.428 . . . . 25.210000000000001 111.676 179.193 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 5.0 m -77.0 -31.83 56.75 Favored 'General case' 0 C--N 1.329 -0.297 0 O-C-N 124.091 0.869 . . . . 22.460000000000001 112.183 -178.065 -86.278 -56.745 -88.634 106.947 2.036 104.994 -86.746 174.14 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 5.9 p -65.28 -20.72 66.54 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 109.947 -0.39 . . . . 28.199999999999999 109.947 172.721 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 25.3 m-20 -98.24 -27.21 14.25 Favored 'General case' 0 C--O 1.215 -0.745 0 C-N-CA 119.9 -0.72 . . . . 30.960000000000001 112.933 177.372 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -78.42 -15.62 58.47 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 112.721 0.637 . . . . 25.489999999999998 112.721 177.914 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 40.9 t -112.0 126.03 69.36 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.226 0 N-CA-C 109.521 -0.548 . . . . 22.890000000000001 109.521 -178.256 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 7.8 mt-30 -63.03 133.18 54.14 Favored 'General case' 0 N--CA 1.441 -0.915 0 C-N-CA 120.277 -0.569 . . . . 47.759999999999998 110.513 179.345 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 85.81 -17.77 34.23 Favored Glycine 0 N--CA 1.443 -0.868 0 CA-C-N 115.876 -0.602 . . . . 24.489999999999998 112.334 -179.352 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -69.85 -20.63 63.41 Favored 'General case' 0 C--O 1.24 0.605 0 C-N-CA 119.766 -0.774 . . . . 22.850000000000001 112.305 -171.916 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -80.99 53.91 2.09 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 122.247 1.022 . . . . 24.420000000000002 111.402 -178.751 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.581 HD22 ' H ' ' A' ' 44' ' ' LEU . 13.9 t30 -123.84 130.4 52.54 Favored 'General case' 0 CA--C 1.511 -0.544 0 CA-C-N 114.842 -1.072 . . . . 25.050000000000001 109.125 -165.576 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 69.7 m-20 -63.06 -30.67 71.78 Favored 'General case' 0 C--O 1.219 -0.521 0 N-CA-C 113.986 1.106 . . . . 34.009999999999998 113.986 -172.519 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.616 ' O ' ' HD2' ' A' ' 47' ' ' HIS . 32.4 tt0 -81.6 -39.32 24.69 Favored 'General case' 0 C--N 1.314 -0.953 0 C-N-CA 119.862 -0.735 . . . . 43.549999999999997 111.72 -175.946 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.581 ' H ' HD22 ' A' ' 41' ' ' ASN . 0.0 OUTLIER -63.49 -48.54 77.22 Favored 'General case' 0 C--O 1.217 -0.634 0 C-N-CA 123.095 0.558 . . . . 27.649999999999999 112.124 174.795 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 13.2 mtpt -58.67 -29.18 66.39 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 123.065 0.546 . . . . 36.299999999999997 111.942 179.831 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -59.93 -50.48 79.97 Favored 'Isoleucine or valine' 0 C--O 1.246 0.876 0 N-CA-C 109.33 -0.619 . . . . 36.060000000000002 109.33 172.767 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' HIS . . . . . 0.662 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 52.1 m-70 -58.2 -55.29 36.9 Favored 'General case' 0 C--O 1.226 -0.172 0 CA-C-N 115.807 -0.633 . . . . 38.07 112.085 174.466 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 11.8 m-30 -48.64 -43.17 36.26 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 115.948 1.833 . . . . 35.439999999999998 115.948 -177.982 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' ARG . . . . . 1.039 HH11 ' HG3' ' A' ' 49' ' ' ARG . 0.1 OUTLIER -76.69 -31.48 57.27 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 109.844 -0.428 . . . . 44.159999999999997 109.844 -178.23 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -78.62 9.82 3.75 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 121.279 0.561 . . . . 38.07 110.057 172.177 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.5 m120 52.72 35.61 18.91 Favored 'General case' 0 C--O 1.242 0.684 0 N-CA-C 114.582 1.327 . . . . 41.659999999999997 114.582 179.933 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.662 ' HG3' ' HA ' ' A' ' 47' ' ' HIS . 3.2 pt-20 -103.73 139.31 39.15 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 123.765 0.666 . . . . 44.380000000000003 110.319 168.359 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 94.2 m-85 -136.6 85.01 26.05 Favored Pre-proline 0 C--O 1.245 0.828 0 N-CA-C 113.826 1.047 . . . . 27.41 113.826 -174.15 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -61.91 157.71 42.05 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 124.696 3.597 . . . . 25.449999999999999 111.172 -170.554 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -87.46 84.17 7.19 Favored 'General case' 0 N--CA 1.437 -1.111 0 N-CA-C 107.825 -1.176 . . . . 28.670000000000002 107.825 -174.844 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -149.02 151.34 34.29 Favored Pre-proline 0 C--O 1.226 -0.167 0 CA-C-N 115.636 -0.711 . . . . 21.809999999999999 109.54 -177.491 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -62.29 -32.87 81.87 Favored 'Trans proline' 0 C--O 1.235 0.347 0 C-N-CA 121.624 1.549 . . . . 21.379999999999999 114.339 -168.334 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 24.8 t -63.2 -52.08 63.26 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.264 0 N-CA-C 109.302 -0.629 . . . . 21.010000000000002 109.302 174.267 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 19.2 m -59.97 -39.73 86.65 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-N 116.405 -0.361 . . . . 20.719999999999999 110.806 -178.114 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 61.0 m170 -50.76 -47.87 59.42 Favored 'General case' 0 C--O 1.235 0.318 0 O-C-N 123.919 0.762 . . . . 21.719999999999999 110.405 177.702 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 75.8 m -74.44 -37.3 63.32 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.086 0.47 . . . . 18.510000000000002 111.922 -177.186 -71.153 -47.204 99.54 107.635 2.041 97.756 -163.429 -66.246 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -57.77 -45.43 85.96 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.187 -0.46 . . . . 23.010000000000002 112.177 174.193 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 55.3 t -64.21 -46.01 94.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.075 -0.512 . . . . 19.100000000000001 111.308 177.714 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 53.6 ttt-85 -53.22 -41.59 65.51 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 112.382 0.512 . . . . 20.379999999999999 112.382 173.227 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 36.1 t -69.37 -43.87 72.68 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.08 -0.509 . . . . 18.440000000000001 111.512 -176.925 174.14 -86.746 -88.634 104.994 2.036 106.947 -56.745 -86.278 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 19.5 mm -59.32 -53.63 45.51 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.579 0 N-CA-C 107.815 -1.179 . . . . 22.469999999999999 107.815 177.187 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -48.2 -49.23 25.32 Favored Glycine 0 C--O 1.215 -1.04 0 CA-C-N 114.838 -1.074 . . . . 20.699999999999999 113.414 174.831 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 34.4 mt -68.96 -35.49 76.81 Favored 'General case' 0 C--O 1.22 -0.477 0 CA-C-N 118.452 1.126 . . . . 25.149999999999999 112.547 179.581 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 50.1 mm-40 -72.86 -38.83 66.9 Favored 'General case' 0 CA--C 1.505 -0.752 0 O-C-N 121.715 -0.616 . . . . 30.82 112.084 -174.151 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.488 ' O ' ' HB2' ' A' ' 71' ' ' ASN . 76.4 mt -83.9 -5.93 59.32 Favored 'General case' 0 CA--C 1.51 -0.586 0 O-C-N 124.17 0.919 . . . . 25.600000000000001 112.06 178.127 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' ASN . . . . . 0.488 ' HB2' ' O ' ' A' ' 70' ' ' LEU . 5.8 m-80 67.25 31.7 6.44 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 119.287 -0.965 . . . . 31.91 111.852 179.457 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 28.1 mt -93.16 -4.27 52.46 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 109.53 -0.545 . . . . 22.879999999999999 109.53 175.714 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 89.3 t80 -161.78 160.58 28.49 Favored 'General case' 0 C--O 1.242 0.66 0 CA-C-O 121.407 0.622 . . . . 21.359999999999999 111.213 -167.546 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -158.26 136.62 10.94 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 107.579 -1.267 . . . . 25.109999999999999 107.579 -177.592 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 75.1 m-20 -57.96 -42.74 85.6 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 114.877 1.436 . . . . 23.879999999999999 114.877 -179.337 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 10.3 tttp -81.57 -52.39 7.26 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 116.291 -0.413 . . . . 31.989999999999998 111.047 -176.794 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 61.5 m-85 -89.15 -11.73 43.01 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 116.08 1.882 . . . . 28.289999999999999 116.08 -173.265 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 83.62 -145.66 22.96 Favored Glycine 0 CA--C 1.524 0.652 0 N-CA-C 116.836 1.494 . . . . 22.949999999999999 116.836 174.826 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 60.8 t -80.58 129.31 37.75 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.567 0 CA-C-N 115.435 -0.383 . . . . 21.149999999999999 110.289 -177.208 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -88.09 105.48 17.52 Favored 'General case' 0 N--CA 1.449 -0.524 0 N-CA-C 107.005 -1.48 . . . . 21.5 107.005 173.958 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 63.8 mt -74.83 -33.89 62.25 Favored 'General case' 0 CA--C 1.507 -0.676 0 CA-C-N 115.639 -0.709 . . . . 21.23 110.572 -165.386 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' GLN . . . . . 0.635 ' O ' ' HG2' ' A' ' 86' ' ' GLU . 61.5 tp60 -65.41 -42.21 92.76 Favored 'General case' 0 CA--C 1.55 0.971 0 O-C-N 123.7 0.625 . . . . 20.32 110.838 174.836 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -64.49 -38.16 90.04 Favored 'General case' 0 CA--C 1.508 -0.664 0 CA-C-O 121.102 0.477 . . . . 20.140000000000001 110.521 -178.604 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 20.6 m-80 -68.26 -42.95 78.86 Favored 'General case' 0 C--O 1.222 -0.357 0 CA-C-N 115.246 -0.888 . . . . 21.620000000000001 111.729 177.46 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' TRP . . . . . . . . . . . . . 76.1 t-105 -47.78 -46.73 30.64 Favored 'General case' 0 C--O 1.219 -0.546 0 CA-C-N 116.009 -0.541 . . . . 23.350000000000001 109.877 171.314 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.635 ' HG2' ' O ' ' A' ' 82' ' ' GLN . 1.3 mm-40 -63.35 -46.33 87.07 Favored 'General case' 0 C--O 1.25 1.131 0 CA-C-O 121.866 0.841 . . . . 29.100000000000001 111.943 177.48 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 40.7 t30 -67.41 -3.94 9.73 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.198 -0.91 . . . . 28.739999999999998 112.566 -176.698 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.451 HD13 ' CE1' ' A' ' 132' ' ' TYR . 0.0 OUTLIER -104.16 19.26 20.46 Favored 'General case' 0 C--O 1.241 0.654 0 N-CA-C 108.692 -0.855 . . . . 29.600000000000001 108.692 178.767 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 80.61 40.38 12.73 Favored Glycine 0 CA--C 1.521 0.456 0 CA-C-N 115.54 -0.754 . . . . 32.670000000000002 114.206 176.596 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' ASN . . . . . 0.446 ' O ' ' HA ' ' A' ' 86' ' ' GLU . 34.5 m120 -131.45 150.86 51.99 Favored 'General case' 0 CA--C 1.506 -0.722 0 N-CA-C 109.12 -0.696 . . . . 28.91 109.12 177.656 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 5.3 p -120.27 -6.99 9.85 Favored 'General case' 0 C--O 1.238 0.487 0 N-CA-C 112.826 0.676 . . . . 28.710000000000001 112.826 178.241 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 46.8 p-10 -89.63 174.61 7.66 Favored 'General case' 0 C--N 1.333 -0.139 0 N-CA-C 112.817 0.673 . . . . 24.120000000000001 112.817 179.856 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 85.1 m-20 -54.67 137.16 44.59 Favored 'General case' 0 C--O 1.225 -0.195 0 N-CA-C 108.264 -1.013 . . . . 25.489999999999998 108.264 166.996 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -58.74 137.13 57.81 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 112.502 0.556 . . . . 19.57 112.502 178.737 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 84.3 m-20 -45.37 140.25 3.18 Favored 'General case' 0 C--O 1.244 0.805 0 O-C-N 123.752 0.658 . . . . 26.329999999999998 110.617 165.406 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -65.04 -35.43 81.14 Favored 'General case' 0 C--O 1.221 -0.4 0 CA-C-O 120.876 0.369 . . . . 24.469999999999999 111.556 -178.885 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.537 ' O ' ' HB2' ' A' ' 101' ' ' LYS . 3.3 mp0 -57.99 -45.93 86.0 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 121.457 0.646 . . . . 31.539999999999999 109.772 178.179 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 50.4 t80 -62.69 -46.34 88.58 Favored 'General case' 0 C--O 1.241 0.613 0 CA-C-N 115.006 -0.997 . . . . 22.57 110.211 -175.237 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 89.8 t -64.42 -47.24 90.29 Favored 'Isoleucine or valine' 0 C--O 1.235 0.311 0 CA-C-N 115.506 -0.77 . . . . 20.73 109.504 178.77 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -63.3 -51.05 67.66 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-O 121.208 0.528 . . . . 20.77 111.727 -176.872 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.537 ' HB2' ' O ' ' A' ' 97' ' ' GLU . 31.8 tttt -44.76 -68.88 0.16 Allowed 'General case' 0 N--CA 1.409 -2.502 0 N-CA-C 117.394 2.368 . . . . 30.82 117.394 169.762 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' HIS . . . . . 0.583 ' CE1' ' OD2' ' A' ' 131' ' ' ASP . 54.8 m80 -67.16 -30.84 70.93 Favored 'General case' 0 C--N 1.31 -1.145 0 N-CA-C 115.058 1.503 . . . . 23.510000000000002 115.058 -177.094 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 49.4 ttm-85 -64.96 -37.34 87.31 Favored 'General case' 0 CA--C 1.549 0.917 0 N-CA-C 107.957 -1.127 . . . . 43.700000000000003 107.957 174.834 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.56 -53.08 53.43 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 112.84 0.682 . . . . 21.370000000000001 112.84 172.942 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' CYS . . . . . 0.424 ' O ' ' HG3' ' A' ' 109' ' ' LYS . 53.2 t -48.48 -42.99 34.45 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 122.764 0.426 . . . . 20.100000000000001 111.894 174.734 -179.746 -81.847 -96.49 101.882 2.021 96.43 -60.041 -79.262 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 39.2 mt -75.76 -39.26 57.39 Favored 'General case' 0 C--O 1.222 -0.356 0 C-N-CA 120.758 -0.377 . . . . 20.16 110.792 -174.931 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -56.54 -48.33 77.49 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.511 -0.551 . . . . 40.759999999999998 109.511 175.846 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -62.01 -21.49 64.91 Favored 'General case' 0 CA--C 1.551 1.016 0 N-CA-C 115.129 1.529 . . . . 22.98 115.129 -179.058 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' LYS . . . . . 0.424 ' HG3' ' O ' ' A' ' 105' ' ' CYS . 23.0 mttm -78.75 -8.86 59.15 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 114.695 1.369 . . . . 22.289999999999999 114.695 175.838 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 15.5 m120 39.54 61.82 1.31 Allowed 'General case' 0 CA--C 1.514 -0.407 0 CA-C-O 121.219 0.533 . . . . 28.800000000000001 112.148 -176.614 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 31.5 mt -58.73 -31.86 68.69 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.714 -0.675 . . . . 23.940000000000001 111.064 -177.798 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 27.2 mt-10 -66.93 -12.2 58.79 Favored 'General case' 0 C--O 1.212 -0.869 0 N-CA-C 112.758 0.651 . . . . 51.840000000000003 112.758 -174.771 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 18.0 p -99.75 -11.38 20.88 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 122.312 0.245 . . . . 25.359999999999999 111.434 179.648 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 61.1 mt -79.41 114.21 19.87 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.182 0 CA-C-O 122.336 1.065 . . . . 23.489999999999998 108.974 173.094 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -80.38 -47.44 14.43 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.387 -0.824 . . . . 43.159999999999997 110.571 -172.349 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -65.0 120.93 13.53 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 121.501 0.667 . . . . 24.579999999999998 111.098 174.288 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 74.5 mt -67.99 -34.86 77.33 Favored 'General case' 0 C--O 1.238 0.486 0 N-CA-C 114.024 1.12 . . . . 21.359999999999999 114.024 -174.389 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 94.0 m -69.15 -39.23 78.95 Favored 'General case' 0 C--O 1.243 0.722 0 CA-C-O 122.15 0.976 . . . . 20.039999999999999 109.296 179.852 -66.246 -163.429 99.54 97.756 2.041 107.635 -47.204 -71.153 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 -70.64 -34.41 72.03 Favored 'General case' 0 N--CA 1.425 -1.723 0 CA-C-N 114.815 -1.084 . . . . 28.399999999999999 109.972 -179.155 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 34.8 ttm180 -63.92 -45.65 88.3 Favored 'General case' 0 C--O 1.224 -0.287 0 C-N-CA 120.761 -0.376 . . . . 25.039999999999999 111.857 177.025 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' ALA . . . . . . . . . . . . . . . -64.52 -38.8 92.26 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 116.09 -0.505 . . . . 18.050000000000001 111.353 179.006 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' TYR . . . . . . . . . . . . . 70.4 t80 -69.0 -37.71 78.86 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 121.431 0.634 . . . . 23.559999999999999 109.953 -177.791 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' SER . . . . . 0.564 ' O ' ' HG2' ' A' ' 126' ' ' GLN . 27.4 t -68.93 -36.29 77.79 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 114.39 -1.277 . . . . 20.289999999999999 111.792 179.492 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -66.01 -42.42 89.74 Favored 'General case' 0 C--O 1.244 0.809 0 CA-C-O 121.543 0.687 . . . . 19.93 110.215 179.417 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -75.26 -14.41 60.51 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 114.966 -1.015 . . . . 22.23 113.177 -172.853 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' GLN . . . . . 0.564 ' HG2' ' O ' ' A' ' 123' ' ' SER . 9.8 pt20 -70.84 -21.01 62.49 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 117.602 -1.639 . . . . 26.219999999999999 112.969 174.957 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 25.9 m -59.87 -33.13 71.4 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 122.684 0.394 . . . . 24.510000000000002 111.847 173.464 -79.262 -60.041 -96.49 96.43 2.021 101.882 -81.847 -179.746 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 6.0 mp -99.53 0.73 42.93 Favored 'General case' 0 N--CA 1.467 0.39 0 O-C-N 124.246 0.966 . . . . 27.440000000000001 113.202 -173.547 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 36.9 ttp180 -62.67 -39.11 92.9 Favored 'General case' 0 CA--C 1.553 1.084 0 N-CA-C 113.137 0.792 . . . . 53.890000000000001 113.137 -178.188 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -61.74 -36.19 80.28 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 118.493 -1.283 . . . . 39.859999999999999 109.472 -179.151 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' ASP . . . . . 0.583 ' OD2' ' CE1' ' A' ' 102' ' ' HIS . 47.1 m-20 -66.58 -51.56 55.08 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 114.414 1.265 . . . . 33.920000000000002 114.414 178.492 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' TYR . . . . . 0.451 ' CE1' HD13 ' A' ' 88' ' ' LEU . 32.7 m-85 -58.45 -44.09 89.09 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 116.285 -0.416 . . . . 37.359999999999999 111.291 177.908 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 71.9 mt-10 -65.72 -43.2 89.81 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 114.19 1.181 . . . . 46.840000000000003 114.19 -178.435 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' MET . . . . . 0.495 ' HB3' ' O ' ' A' ' 174' ' ' HOH . 0.0 OUTLIER -77.52 20.16 0.33 Allowed 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 118.1 -1.44 . . . . 50.090000000000003 112.787 178.079 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' TYR . . . . . . . . . . . . . 11.3 t80 . . . . . 0 C--O 1.24 0.57 0 N-CA-C 112.327 0.492 . . . . 42.229999999999997 112.327 179.295 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' ' AU' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' ' AU' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' HOH . . . . . 0.434 ' O ' ' N ' ' A' ' 27' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' HOH . . . . . 0.498 ' O ' ' NH1' ' A' ' 49' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' 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 . . . . . 0.502 ' O ' HG22 ' A' ' 28' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 . . . . . 0.495 ' O ' ' HB3' ' A' ' 134' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 175' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 176' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 177' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 178' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 179' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 180' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 181' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 182' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_