data_3ldc_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 3ldc _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 ' 18' ' ' VAL . . . . . . . . . . . . . 44.9 t . . . . . 0 N--CA 1.498 1.97 0 N-CA-C 108.823 -0.806 . . . . 40.380000000000003 108.823 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -56.5 140.87 90.27 Favored 'Trans proline' 0 C--O 1.243 0.728 0 O-C-N 122.77 0.879 . . . . 35.670000000000002 110.833 -179.685 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -57.77 -38.1 74.84 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.217 -0.901 . . . . 30.07 111.279 -175.996 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 94.9 m -67.73 -33.2 74.41 Favored 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 120.373 -0.531 . . . . 27.100000000000001 111.543 -177.342 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 56.2 ttt180 -68.11 -41.56 81.57 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 119.771 -0.771 . . . . 43.100000000000001 110.516 177.609 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 30.9 mm -60.49 -40.6 84.83 Favored 'Isoleucine or valine' 0 C--O 1.243 0.719 0 N-CA-C 108.94 -0.763 . . . . 29.469999999999999 108.94 176.888 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 58.9 tp -55.75 -51.81 66.1 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 120.912 -0.315 . . . . 28.719999999999999 111.321 174.28 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 22.9 mt -58.48 -39.73 80.79 Favored 'General case' 0 C--O 1.244 0.79 0 N-CA-C 113.033 0.753 . . . . 25.780000000000001 113.033 178.364 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 30.4 mt -65.45 -42.12 92.71 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 123.756 0.66 . . . . 28.010000000000002 111.151 -178.005 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 3.5 p -70.45 -35.48 62.16 Favored 'Isoleucine or valine' 0 C--O 1.243 0.717 0 C-N-CA 117.954 -1.498 . . . . 24.789999999999999 110.666 179.781 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 96.9 mt -62.08 -40.47 95.91 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.189 -0.605 . . . . 29.300000000000001 111.451 175.051 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.0 -40.62 98.33 Favored 'General case' 0 C--O 1.21 -0.991 0 C-N-CA 121.228 -0.189 . . . . 23.359999999999999 111.068 178.404 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 15.7 t -62.52 -41.74 93.13 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 CA-C-O 121.402 0.62 . . . . 26.940000000000001 110.525 176.016 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 48.0 mt -62.6 -44.51 99.44 Favored 'Isoleucine or valine' 0 C--O 1.244 0.8 0 CA-C-N 116.15 -0.477 . . . . 29.120000000000001 111.787 179.352 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 80.2 mt -60.71 -47.98 90.7 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.456 0 CA-C-O 121.512 0.672 . . . . 26.02 111.669 175.69 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 83.5 t80 -55.52 -51.04 68.35 Favored 'General case' 0 C--O 1.252 1.222 0 CA-C-N 115.901 -0.59 . . . . 31.420000000000002 112.101 177.093 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -64.97 -41.25 97.43 Favored Glycine 0 C--O 1.242 0.627 0 C-N-CA 119.003 -1.57 . . . . 22.289999999999999 112.763 -178.863 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 87.7 m -69.17 -49.26 58.32 Favored 'General case' 0 C--O 1.244 0.778 0 CA-C-O 121.989 0.9 . . . . 23.23 110.698 -173.904 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.24 -43.76 98.35 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 119.47 -0.892 . . . . 23.219999999999999 112.651 178.116 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -58.82 -49.77 74.46 Favored Glycine 0 C--O 1.236 0.226 0 C-N-CA 121.412 -0.423 . . . . 22.710000000000001 112.875 178.041 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 22.1 t80 -65.2 -40.13 93.75 Favored 'General case' 0 C--O 1.231 0.118 0 C-N-CA 119.129 -1.029 . . . . 22.219999999999999 110.933 -178.528 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 76.8 t60 -59.85 -46.85 87.98 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 121.196 0.522 . . . . 26.699999999999999 111.593 178.313 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 47.4 m-85 -79.04 -37.44 39.03 Favored 'General case' 0 C--N 1.32 -0.705 0 C-N-CA 118.544 -1.263 . . . . 29.920000000000002 113.939 -175.448 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 50.1 mt -79.3 -43.9 23.91 Favored 'Isoleucine or valine' 0 C--O 1.238 0.476 0 N-CA-C 112.186 0.439 . . . . 27.210000000000001 112.186 -177.711 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 75.3 mm-40 -101.41 -13.4 17.99 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 114.488 1.292 . . . . 26.719999999999999 114.488 -175.031 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.47 13.52 81.54 Favored Glycine 0 C--O 1.224 -0.526 0 C-N-CA 121.045 -0.598 . . . . 28.84 114.332 169.653 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 61.3 mm-40 -80.18 159.91 25.83 Favored 'General case' 0 C--O 1.246 0.885 0 CA-C-N 118.014 0.907 . . . . 30.739999999999998 111.189 174.017 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 65.5 p -61.35 161.57 9.01 Favored 'General case' 0 C--O 1.245 0.849 0 CA-C-N 115.867 -0.606 . . . . 24.890000000000001 111.048 -177.799 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 98.4 m95 -58.44 -42.84 88.22 Favored 'General case' 0 CA--C 1.518 -0.258 0 C-N-CA 120.02 -0.672 . . . . 27.91 111.386 177.735 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 48.6 m -64.06 -48.04 77.78 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 120.775 -0.37 . . . . 28.670000000000002 111.983 179.747 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 24.5 t -60.92 -40.09 84.2 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 C-N-CA 119.142 -1.023 . . . . 22.920000000000002 109.945 177.981 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 74.6 m -64.28 -38.44 91.05 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 112.475 0.546 . . . . 20.57 112.475 -178.531 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 59.2 tp -64.95 -48.54 73.72 Favored 'General case' 0 C--O 1.242 0.666 0 CA-C-O 121.957 0.885 . . . . 25.82 110.346 176.633 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 23.9 t80 -56.98 -46.86 81.92 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.143 -0.935 . . . . 20.0 111.512 176.353 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' TRP . . . . . . . . . . . . . 74.4 t90 -60.67 -41.01 94.21 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-O 121.226 0.536 . . . . 21.120000000000001 110.307 179.104 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 54.0 m -60.29 -45.43 93.37 Favored 'General case' 0 C--O 1.239 0.523 0 C-N-CA 119.303 -0.959 . . . . 21.280000000000001 112.181 178.736 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 13.0 m-85 -63.0 -45.8 90.67 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 119.787 -0.765 . . . . 24.239999999999998 111.184 177.688 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 31.5 t -60.35 -33.85 55.48 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 CA-C-O 121.469 0.652 . . . . 19.399999999999999 111.057 -177.979 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 50.6 m -79.75 -53.44 6.8 Favored 'General case' 0 C--O 1.242 0.676 0 CA-C-N 115.508 -0.769 . . . . 19.75 110.882 -177.354 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 17.3 pt -68.95 -21.61 25.72 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 C-N-CA 118.514 -1.274 . . . . 22.789999999999999 113.596 -176.607 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -79.81 -9.09 59.62 Favored 'General case' 0 N--CA 1.472 0.672 0 O-C-N 123.157 0.286 . . . . 20.16 111.514 173.052 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 7.2 p 70.17 20.48 6.3 Favored 'General case' 0 C--O 1.255 1.386 0 C-N-CA 125.4 1.48 . . . . 20.649999999999999 112.755 -177.833 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 92.3 t -68.87 -53.6 25.5 Favored 'Isoleucine or valine' 0 C--O 1.266 1.947 0 CA-C-O 121.305 0.574 . . . . 18.370000000000001 111.377 173.86 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 61.2 49.21 80.43 Favored Glycine 0 N--CA 1.481 1.699 0 N-CA-C 116.462 1.345 . . . . 18.920000000000002 116.462 170.736 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 50.8 m-85 -51.22 -40.29 58.43 Favored 'General case' 0 C--O 1.25 1.106 0 O-C-N 120.822 -1.399 . . . . 17.850000000000001 113.27 178.922 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 87.37 4.51 80.56 Favored Glycine 0 N--CA 1.46 0.252 0 C-N-CA 119.893 -1.146 . . . . 20.449999999999999 113.467 -178.24 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 18.1 p-10 -63.48 -29.92 71.12 Favored 'General case' 0 C--O 1.25 1.083 0 C-N-CA 119.525 -0.87 . . . . 21.530000000000001 110.919 169.481 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 97.6 m-85 -130.25 141.49 50.62 Favored 'General case' 0 C--O 1.213 -0.864 0 N-CA-C 107.673 -1.232 . . . . 25.940000000000001 107.673 172.087 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 78.6 p -164.45 157.54 14.94 Favored Pre-proline 0 CA--C 1.539 0.535 0 N-CA-C 106.685 -1.598 . . . . 23.309999999999999 106.685 -178.963 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -70.26 143.14 47.57 Favored 'Trans proline' 0 C--O 1.244 0.777 0 C-N-CA 116.68 -1.746 . . . . 21.870000000000001 113.916 178.529 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -117.31 4.99 12.57 Favored 'General case' 0 CA--C 1.507 -0.704 0 CA-C-N 115.524 -0.762 . . . . 30.77 112.742 178.609 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 37.5 p -118.52 153.54 52.05 Favored Pre-proline 0 N--CA 1.467 0.385 0 O-C-N 123.741 0.651 . . . . 26.629999999999999 109.751 177.772 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_exo -54.81 -42.42 68.91 Favored 'Trans proline' 0 N--CA 1.459 -0.551 0 N-CA-C 113.736 0.629 . . . . 25.800000000000001 113.736 173.723 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 56.5 tp -61.28 -38.29 86.21 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 118.685 0.675 . . . . 28.25 109.778 178.66 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -68.83 -38.67 85.53 Favored Glycine 0 N--CA 1.473 1.154 0 N-CA-C 109.315 -1.514 . . . . 21.559999999999999 109.315 -177.362 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 67.2 mtt -62.17 -47.18 85.62 Favored 'General case' 0 C--O 1.239 0.525 0 N-CA-C 112.435 0.531 . . . . 24.690000000000001 112.435 175.996 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -59.93 -47.43 85.83 Favored 'General case' 0 C--O 1.24 0.596 0 C-N-CA 120.403 -0.519 . . . . 35.299999999999997 111.631 175.54 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 24.5 t80 -57.1 -42.67 81.22 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 116.412 -0.358 . . . . 29.109999999999999 110.794 178.068 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 54.6 m -63.6 -39.7 95.05 Favored 'General case' 0 C--O 1.243 0.732 0 C-N-CA 120.242 -0.583 . . . . 22.23 110.753 -178.181 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 81.6 m -62.09 -39.68 93.25 Favored 'General case' 0 C--O 1.243 0.734 0 C-N-CA 120.051 -0.66 . . . . 25.32 111.202 176.851 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 10.7 p -63.28 -42.3 99.08 Favored 'General case' 0 C--O 1.238 0.487 0 N-CA-C 112.529 0.566 . . . . 28.260000000000002 112.529 176.039 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 63.0 tp -63.64 -39.06 93.38 Favored 'General case' 0 C--O 1.247 0.949 0 CA-C-O 120.885 0.374 . . . . 22.5 110.954 177.802 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 34.4 mt -59.81 -48.98 85.59 Favored 'Isoleucine or valine' 0 C--O 1.24 0.572 0 N-CA-C 108.944 -0.761 . . . . 25.18 108.944 178.523 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 53.8 t -68.3 -41.79 83.96 Favored 'Isoleucine or valine' 0 C--O 1.242 0.699 0 CA-C-N 116.222 -0.444 . . . . 27.120000000000001 111.785 -176.926 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 96.1 mt -82.24 -25.16 34.37 Favored 'General case' 0 C--O 1.241 0.643 0 CA-C-O 120.838 0.351 . . . . 32.460000000000001 111.659 -176.385 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -103.26 -33.38 4.27 Favored Glycine 0 N--CA 1.462 0.394 0 N-CA-C 117.223 1.649 . . . . 23.670000000000002 117.223 -167.204 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 83.6 mt -64.97 -42.03 93.66 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 O-C-N 121.223 -1.163 . . . . 28.079999999999998 111.821 -174.18 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -69.13 -42.22 77.36 Favored Glycine 0 CA--C 1.522 0.472 0 N-CA-C 110.855 -0.898 . . . . 24.300000000000001 110.855 -179.474 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 39.2 m -61.66 -46.0 91.63 Favored 'General case' 0 C--O 1.223 -0.304 0 CA-C-N 114.842 -0.679 . . . . 28.359999999999999 110.408 179.781 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 42.6 t80 -63.72 -40.65 97.27 Favored 'General case' 0 C--O 1.249 1.038 0 C-N-CA 119.314 -0.954 . . . . 29.120000000000001 111.922 178.018 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -60.09 -44.58 94.71 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 120.689 -0.404 . . . . 26.43 111.169 -179.691 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 89.8 t -66.77 -37.32 79.25 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 N-CA-C 109.893 -0.41 . . . . 29.399999999999999 109.893 179.748 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -64.17 -45.43 88.47 Favored 'General case' 0 C--O 1.239 0.501 0 N-CA-C 113.712 1.004 . . . . 29.5 113.712 178.333 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 28.4 m -65.06 -38.52 82.98 Favored 'Isoleucine or valine' 0 C--O 1.233 0.231 0 C-N-CA 119.17 -1.012 . . . . 36.850000000000001 111.333 179.882 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.89 -37.44 84.39 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 119.335 -0.946 . . . . 50.229999999999997 111.184 -179.612 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 5.5 mmm180 -66.45 -37.27 84.77 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 112.158 0.429 . . . . 52.880000000000003 112.158 175.017 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 53.8 tp -62.41 -44.24 96.92 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 110.68 -0.119 . . . . 47.200000000000003 110.68 176.546 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 11.7 mt -41.74 -50.85 4.26 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 123.67 0.606 . . . . 52.729999999999997 111.719 175.128 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -57.52 -40.47 78.85 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 114.432 1.271 . . . . 60.100000000000001 114.432 -176.797 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 79.6 m-85 -75.35 -37.37 60.71 Favored 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 113.78 1.03 . . . . 61.119999999999997 113.78 -179.968 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 53.4 mt -70.86 -50.85 30.67 Favored 'General case' 0 CA--C 1.534 0.363 0 O-C-N 123.242 0.338 . . . . 59.729999999999997 110.268 173.45 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 77.5 mt . . . . . 0 N--CA 1.463 0.198 0 N-CA-C 109.426 -0.583 . . . . 59.979999999999997 109.426 178.58 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 1' ' ' ' K' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' ' K' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' ' K' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' ' K' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' ' K' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 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 0 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 44.9 t . . . . . 0 N--CA 1.498 1.97 0 N-CA-C 108.823 -0.806 . . . . 40.380000000000003 108.823 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -56.5 140.87 90.27 Favored 'Trans proline' 0 C--O 1.243 0.728 0 O-C-N 122.77 0.879 . . . . 35.670000000000002 110.833 -179.685 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -57.77 -38.1 74.84 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.217 -0.901 . . . . 30.07 111.279 -175.996 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 94.9 m -67.73 -33.2 74.41 Favored 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 120.373 -0.531 . . . . 27.100000000000001 111.543 -177.342 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 56.2 ttt180 -68.11 -41.56 81.57 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 119.771 -0.771 . . . . 43.100000000000001 110.516 177.609 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 30.9 mm -60.49 -40.6 84.83 Favored 'Isoleucine or valine' 0 C--O 1.243 0.719 0 N-CA-C 108.94 -0.763 . . . . 29.469999999999999 108.94 176.888 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 58.9 tp -55.75 -51.81 66.1 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 120.912 -0.315 . . . . 28.719999999999999 111.321 174.28 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 22.9 mt -58.48 -39.73 80.79 Favored 'General case' 0 C--O 1.244 0.79 0 N-CA-C 113.033 0.753 . . . . 25.780000000000001 113.033 178.364 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 30.4 mt -65.45 -42.12 92.71 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 123.756 0.66 . . . . 28.010000000000002 111.151 -178.005 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 3.5 p -70.45 -35.48 62.16 Favored 'Isoleucine or valine' 0 C--O 1.243 0.717 0 C-N-CA 117.954 -1.498 . . . . 24.789999999999999 110.666 179.781 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 96.9 mt -62.08 -40.47 95.91 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.189 -0.605 . . . . 29.300000000000001 111.451 175.051 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.0 -40.62 98.33 Favored 'General case' 0 C--O 1.21 -0.991 0 C-N-CA 121.228 -0.189 . . . . 23.359999999999999 111.068 178.404 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 15.7 t -62.52 -41.74 93.13 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 CA-C-O 121.402 0.62 . . . . 26.940000000000001 110.525 176.016 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 48.0 mt -62.6 -44.51 99.44 Favored 'Isoleucine or valine' 0 C--O 1.244 0.8 0 CA-C-N 116.15 -0.477 . . . . 29.120000000000001 111.787 179.352 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 80.2 mt -60.71 -47.98 90.7 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.456 0 CA-C-O 121.512 0.672 . . . . 26.02 111.669 175.69 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 83.5 t80 -55.52 -51.04 68.35 Favored 'General case' 0 C--O 1.252 1.222 0 CA-C-N 115.901 -0.59 . . . . 31.420000000000002 112.101 177.093 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -64.97 -41.25 97.43 Favored Glycine 0 C--O 1.242 0.627 0 C-N-CA 119.003 -1.57 . . . . 22.289999999999999 112.763 -178.863 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 87.7 m -69.17 -49.26 58.32 Favored 'General case' 0 C--O 1.244 0.778 0 CA-C-O 121.989 0.9 . . . . 23.23 110.698 -173.904 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.24 -43.76 98.35 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 119.47 -0.892 . . . . 23.219999999999999 112.651 178.116 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -58.82 -49.77 74.46 Favored Glycine 0 C--O 1.236 0.226 0 C-N-CA 121.412 -0.423 . . . . 22.710000000000001 112.875 178.041 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 22.1 t80 -65.2 -40.13 93.75 Favored 'General case' 0 C--O 1.231 0.118 0 C-N-CA 119.129 -1.029 . . . . 22.219999999999999 110.933 -178.528 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 76.8 t60 -59.85 -46.85 87.98 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 121.196 0.522 . . . . 26.699999999999999 111.593 178.313 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 47.4 m-85 -79.04 -37.44 39.03 Favored 'General case' 0 C--N 1.32 -0.705 0 C-N-CA 118.544 -1.263 . . . . 29.920000000000002 113.939 -175.448 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 50.1 mt -79.3 -43.9 23.91 Favored 'Isoleucine or valine' 0 C--O 1.238 0.476 0 N-CA-C 112.186 0.439 . . . . 27.210000000000001 112.186 -177.711 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 75.3 mm-40 -101.41 -13.4 17.99 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 114.488 1.292 . . . . 26.719999999999999 114.488 -175.031 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.47 13.52 81.54 Favored Glycine 0 C--O 1.224 -0.526 0 C-N-CA 121.045 -0.598 . . . . 28.84 114.332 169.653 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 61.3 mm-40 -80.18 159.91 25.83 Favored 'General case' 0 C--O 1.246 0.885 0 CA-C-N 118.014 0.907 . . . . 30.739999999999998 111.189 174.017 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 65.5 p -61.35 161.57 9.01 Favored 'General case' 0 C--O 1.245 0.849 0 CA-C-N 115.867 -0.606 . . . . 24.890000000000001 111.048 -177.799 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 98.4 m95 -58.44 -42.84 88.22 Favored 'General case' 0 CA--C 1.518 -0.258 0 C-N-CA 120.02 -0.672 . . . . 27.91 111.386 177.735 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 48.6 m -64.06 -48.04 77.78 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 120.775 -0.37 . . . . 28.670000000000002 111.983 179.747 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 24.5 t -60.92 -40.09 84.2 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 C-N-CA 119.142 -1.023 . . . . 22.920000000000002 109.945 177.981 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 74.6 m -64.28 -38.44 91.05 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 112.475 0.546 . . . . 20.57 112.475 -178.531 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 59.2 tp -64.95 -48.54 73.72 Favored 'General case' 0 C--O 1.242 0.666 0 CA-C-O 121.957 0.885 . . . . 25.82 110.346 176.633 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 23.9 t80 -56.98 -46.86 81.92 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.143 -0.935 . . . . 20.0 111.512 176.353 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' TRP . . . . . . . . . . . . . 74.4 t90 -60.67 -41.01 94.21 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-O 121.226 0.536 . . . . 21.120000000000001 110.307 179.104 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 54.0 m -60.29 -45.43 93.37 Favored 'General case' 0 C--O 1.239 0.523 0 C-N-CA 119.303 -0.959 . . . . 21.280000000000001 112.181 178.736 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 13.0 m-85 -63.0 -45.8 90.67 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 119.787 -0.765 . . . . 24.239999999999998 111.184 177.688 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 31.5 t -60.35 -33.85 55.48 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 CA-C-O 121.469 0.652 . . . . 19.399999999999999 111.057 -177.979 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 50.6 m -79.75 -53.44 6.8 Favored 'General case' 0 C--O 1.242 0.676 0 CA-C-N 115.508 -0.769 . . . . 19.75 110.882 -177.354 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 17.3 pt -68.95 -21.61 25.72 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 C-N-CA 118.514 -1.274 . . . . 22.789999999999999 113.596 -176.607 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -79.81 -9.09 59.62 Favored 'General case' 0 N--CA 1.472 0.672 0 O-C-N 123.157 0.286 . . . . 20.16 111.514 173.052 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 7.2 p 70.17 20.48 6.3 Favored 'General case' 0 C--O 1.255 1.386 0 C-N-CA 125.4 1.48 . . . . 20.649999999999999 112.755 -177.833 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 92.3 t -68.87 -53.6 25.5 Favored 'Isoleucine or valine' 0 C--O 1.266 1.947 0 CA-C-O 121.305 0.574 . . . . 18.370000000000001 111.377 173.86 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 61.2 49.21 80.43 Favored Glycine 0 N--CA 1.481 1.699 0 N-CA-C 116.462 1.345 . . . . 18.920000000000002 116.462 170.736 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 50.8 m-85 -51.22 -40.29 58.43 Favored 'General case' 0 C--O 1.25 1.106 0 O-C-N 120.822 -1.399 . . . . 17.850000000000001 113.27 178.922 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 87.37 4.51 80.56 Favored Glycine 0 N--CA 1.46 0.252 0 C-N-CA 119.893 -1.146 . . . . 20.449999999999999 113.467 -178.24 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 18.1 p-10 -63.48 -29.92 71.12 Favored 'General case' 0 C--O 1.25 1.083 0 C-N-CA 119.525 -0.87 . . . . 21.530000000000001 110.919 169.481 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 97.6 m-85 -130.25 141.49 50.62 Favored 'General case' 0 C--O 1.213 -0.864 0 N-CA-C 107.673 -1.232 . . . . 25.940000000000001 107.673 172.087 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 78.6 p -164.45 157.54 14.94 Favored Pre-proline 0 CA--C 1.539 0.535 0 N-CA-C 106.685 -1.598 . . . . 23.309999999999999 106.685 -178.963 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -70.26 143.14 47.57 Favored 'Trans proline' 0 C--O 1.244 0.777 0 C-N-CA 116.68 -1.746 . . . . 21.870000000000001 113.916 178.529 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' HIS . . . . . 0.504 ' HE1' ' O ' ' A' ' 17' ' ' HOH . 80.0 m80 -117.31 4.99 12.57 Favored 'General case' 0 CA--C 1.507 -0.704 0 CA-C-N 115.524 -0.762 . . . . 30.77 112.742 178.609 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 37.5 p -118.52 153.54 52.05 Favored Pre-proline 0 N--CA 1.467 0.385 0 O-C-N 123.741 0.651 . . . . 26.629999999999999 109.751 177.772 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_exo -54.81 -42.42 68.91 Favored 'Trans proline' 0 N--CA 1.459 -0.551 0 N-CA-C 113.736 0.629 . . . . 25.800000000000001 113.736 173.723 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 56.5 tp -61.28 -38.29 86.21 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 118.685 0.675 . . . . 28.25 109.778 178.66 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -68.83 -38.67 85.53 Favored Glycine 0 N--CA 1.473 1.154 0 N-CA-C 109.315 -1.514 . . . . 21.559999999999999 109.315 -177.362 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 67.2 mtt -62.17 -47.18 85.62 Favored 'General case' 0 C--O 1.239 0.525 0 N-CA-C 112.435 0.531 . . . . 24.690000000000001 112.435 175.996 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -59.93 -47.43 85.83 Favored 'General case' 0 C--O 1.24 0.596 0 C-N-CA 120.403 -0.519 . . . . 35.299999999999997 111.631 175.54 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 24.5 t80 -57.1 -42.67 81.22 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 116.412 -0.358 . . . . 29.109999999999999 110.794 178.068 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 54.6 m -63.6 -39.7 95.05 Favored 'General case' 0 C--O 1.243 0.732 0 C-N-CA 120.242 -0.583 . . . . 22.23 110.753 -178.181 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 81.6 m -62.09 -39.68 93.25 Favored 'General case' 0 C--O 1.243 0.734 0 C-N-CA 120.051 -0.66 . . . . 25.32 111.202 176.851 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 10.7 p -63.28 -42.3 99.08 Favored 'General case' 0 C--O 1.238 0.487 0 N-CA-C 112.529 0.566 . . . . 28.260000000000002 112.529 176.039 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 63.0 tp -63.64 -39.06 93.38 Favored 'General case' 0 C--O 1.247 0.949 0 CA-C-O 120.885 0.374 . . . . 22.5 110.954 177.802 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' ILE . . . . . 0.586 HG23 HD12 ' A' ' 84' ' ' ILE . 34.4 mt -59.81 -48.98 85.59 Favored 'Isoleucine or valine' 0 C--O 1.24 0.572 0 N-CA-C 108.944 -0.761 . . . . 25.18 108.944 178.523 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 53.8 t -68.3 -41.79 83.96 Favored 'Isoleucine or valine' 0 C--O 1.242 0.699 0 CA-C-N 116.222 -0.444 . . . . 27.120000000000001 111.785 -176.926 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 96.1 mt -82.24 -25.16 34.37 Favored 'General case' 0 C--O 1.241 0.643 0 CA-C-O 120.838 0.351 . . . . 32.460000000000001 111.659 -176.385 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -103.26 -33.38 4.27 Favored Glycine 0 N--CA 1.462 0.394 0 N-CA-C 117.223 1.649 . . . . 23.670000000000002 117.223 -167.204 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ILE . . . . . 0.586 HD12 HG23 ' A' ' 80' ' ' ILE . 83.6 mt -64.97 -42.03 93.66 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 O-C-N 121.223 -1.163 . . . . 28.079999999999998 111.821 -174.18 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -69.13 -42.22 77.36 Favored Glycine 0 CA--C 1.522 0.472 0 N-CA-C 110.855 -0.898 . . . . 24.300000000000001 110.855 -179.474 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 39.2 m -61.66 -46.0 91.63 Favored 'General case' 0 C--O 1.223 -0.304 0 CA-C-N 114.842 -0.679 . . . . 28.359999999999999 110.408 179.781 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 42.6 t80 -63.72 -40.65 97.27 Favored 'General case' 0 C--O 1.249 1.038 0 C-N-CA 119.314 -0.954 . . . . 29.120000000000001 111.922 178.018 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -60.09 -44.58 94.71 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 120.689 -0.404 . . . . 26.43 111.169 -179.691 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 89.8 t -66.77 -37.32 79.25 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 N-CA-C 109.893 -0.41 . . . . 29.399999999999999 109.893 179.748 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -64.17 -45.43 88.47 Favored 'General case' 0 C--O 1.239 0.501 0 N-CA-C 113.712 1.004 . . . . 29.5 113.712 178.333 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 28.4 m -65.06 -38.52 82.98 Favored 'Isoleucine or valine' 0 C--O 1.233 0.231 0 C-N-CA 119.17 -1.012 . . . . 36.850000000000001 111.333 179.882 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' GLU . . . . . 0.45 ' HA ' HD12 ' A' ' 95' ' ' LEU . 0.0 OUTLIER -66.89 -37.44 84.39 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 119.335 -0.946 . . . . 50.229999999999997 111.184 -179.612 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 5.5 mmm180 -66.45 -37.27 84.77 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 112.158 0.429 . . . . 52.880000000000003 112.158 175.017 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 53.8 tp -62.41 -44.24 96.92 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 110.68 -0.119 . . . . 47.200000000000003 110.68 176.546 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' LEU . . . . . 0.45 HD12 ' HA ' ' A' ' 92' ' ' GLU . 11.7 mt -41.74 -50.85 4.26 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 123.67 0.606 . . . . 52.729999999999997 111.719 175.128 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -57.52 -40.47 78.85 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 114.432 1.271 . . . . 60.100000000000001 114.432 -176.797 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 79.6 m-85 -75.35 -37.37 60.71 Favored 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 113.78 1.03 . . . . 61.119999999999997 113.78 -179.968 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 53.4 mt -70.86 -50.85 30.67 Favored 'General case' 0 CA--C 1.534 0.363 0 O-C-N 123.242 0.338 . . . . 59.729999999999997 110.268 173.45 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 77.5 mt . . . . . 0 N--CA 1.463 0.198 0 N-CA-C 109.426 -0.583 . . . . 59.979999999999997 109.426 178.58 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' ' K' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' ' K' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 3' ' ' ' K' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 4' ' ' ' K' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 5' ' ' ' K' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 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 0 . 1 . 001 ecloud build full ' A' A ' 9' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 10' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 11' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 12' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 13' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 14' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 15' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 16' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 17' ' ' HOH . . . . . 0.504 ' O ' ' HE1' ' A' ' 68' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 44.9 t . . . . . 0 N--CA 1.498 1.97 0 N-CA-C 108.823 -0.806 . . . . 40.380000000000003 108.823 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -56.5 140.87 90.27 Favored 'Trans proline' 0 C--O 1.243 0.728 0 O-C-N 122.77 0.879 . . . . 35.670000000000002 110.833 -179.685 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -57.77 -38.1 74.84 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.217 -0.901 . . . . 30.07 111.279 -175.996 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 94.9 m -67.73 -33.2 74.41 Favored 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 120.373 -0.531 . . . . 27.100000000000001 111.543 -177.342 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 56.2 ttt180 -68.11 -41.56 81.57 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 119.771 -0.771 . . . . 43.100000000000001 110.516 177.609 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 30.9 mm -60.49 -40.6 84.83 Favored 'Isoleucine or valine' 0 C--O 1.243 0.719 0 N-CA-C 108.94 -0.763 . . . . 29.469999999999999 108.94 176.888 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 58.9 tp -55.75 -51.81 66.1 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 120.912 -0.315 . . . . 28.719999999999999 111.321 174.28 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 22.9 mt -58.48 -39.73 80.79 Favored 'General case' 0 C--O 1.244 0.79 0 N-CA-C 113.033 0.753 . . . . 25.780000000000001 113.033 178.364 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 30.4 mt -65.45 -42.12 92.71 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 123.756 0.66 . . . . 28.010000000000002 111.151 -178.005 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 3.5 p -70.45 -35.48 62.16 Favored 'Isoleucine or valine' 0 C--O 1.243 0.717 0 C-N-CA 117.954 -1.498 . . . . 24.789999999999999 110.666 179.781 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 96.9 mt -62.08 -40.47 95.91 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.189 -0.605 . . . . 29.300000000000001 111.451 175.051 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.0 -40.62 98.33 Favored 'General case' 0 C--O 1.21 -0.991 0 C-N-CA 121.228 -0.189 . . . . 23.359999999999999 111.068 178.404 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 15.7 t -62.52 -41.74 93.13 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 CA-C-O 121.402 0.62 . . . . 26.940000000000001 110.525 176.016 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 48.0 mt -62.6 -44.51 99.44 Favored 'Isoleucine or valine' 0 C--O 1.244 0.8 0 CA-C-N 116.15 -0.477 . . . . 29.120000000000001 111.787 179.352 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 80.2 mt -60.71 -47.98 90.7 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.456 0 CA-C-O 121.512 0.672 . . . . 26.02 111.669 175.69 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 83.5 t80 -55.52 -51.04 68.35 Favored 'General case' 0 C--O 1.252 1.222 0 CA-C-N 115.901 -0.59 . . . . 31.420000000000002 112.101 177.093 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -64.97 -41.25 97.43 Favored Glycine 0 C--O 1.242 0.627 0 C-N-CA 119.003 -1.57 . . . . 22.289999999999999 112.763 -178.863 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 87.7 m -69.17 -49.26 58.32 Favored 'General case' 0 C--O 1.244 0.778 0 CA-C-O 121.989 0.9 . . . . 23.23 110.698 -173.904 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.24 -43.76 98.35 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 119.47 -0.892 . . . . 23.219999999999999 112.651 178.116 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -58.82 -49.77 74.46 Favored Glycine 0 C--O 1.236 0.226 0 C-N-CA 121.412 -0.423 . . . . 22.710000000000001 112.875 178.041 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 22.1 t80 -65.2 -40.13 93.75 Favored 'General case' 0 C--O 1.231 0.118 0 C-N-CA 119.129 -1.029 . . . . 22.219999999999999 110.933 -178.528 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 76.8 t60 -59.85 -46.85 87.98 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 121.196 0.522 . . . . 26.699999999999999 111.593 178.313 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 47.4 m-85 -79.04 -37.44 39.03 Favored 'General case' 0 C--N 1.32 -0.705 0 C-N-CA 118.544 -1.263 . . . . 29.920000000000002 113.939 -175.448 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 50.1 mt -79.3 -43.9 23.91 Favored 'Isoleucine or valine' 0 C--O 1.238 0.476 0 N-CA-C 112.186 0.439 . . . . 27.210000000000001 112.186 -177.711 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 75.3 mm-40 -101.41 -13.4 17.99 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 114.488 1.292 . . . . 26.719999999999999 114.488 -175.031 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 80.47 13.52 81.54 Favored Glycine 0 C--O 1.224 -0.526 0 C-N-CA 121.045 -0.598 . . . . 28.84 114.332 169.653 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 61.3 mm-40 -80.18 159.91 25.83 Favored 'General case' 0 C--O 1.246 0.885 0 CA-C-N 118.014 0.907 . . . . 30.739999999999998 111.189 174.017 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 65.5 p -61.35 161.57 9.01 Favored 'General case' 0 C--O 1.245 0.849 0 CA-C-N 115.867 -0.606 . . . . 24.890000000000001 111.048 -177.799 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 98.4 m95 -58.44 -42.84 88.22 Favored 'General case' 0 CA--C 1.518 -0.258 0 C-N-CA 120.02 -0.672 . . . . 27.91 111.386 177.735 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 48.6 m -64.06 -48.04 77.78 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 120.775 -0.37 . . . . 28.670000000000002 111.983 179.747 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 24.5 t -60.92 -40.09 84.2 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 C-N-CA 119.142 -1.023 . . . . 22.920000000000002 109.945 177.981 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 74.6 m -64.28 -38.44 91.05 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 112.475 0.546 . . . . 20.57 112.475 -178.531 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 59.2 tp -64.95 -48.54 73.72 Favored 'General case' 0 C--O 1.242 0.666 0 CA-C-O 121.957 0.885 . . . . 25.82 110.346 176.633 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 23.9 t80 -56.98 -46.86 81.92 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.143 -0.935 . . . . 20.0 111.512 176.353 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' TRP . . . . . . . . . . . . . 74.4 t90 -60.67 -41.01 94.21 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-O 121.226 0.536 . . . . 21.120000000000001 110.307 179.104 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 54.0 m -60.29 -45.43 93.37 Favored 'General case' 0 C--O 1.239 0.523 0 C-N-CA 119.303 -0.959 . . . . 21.280000000000001 112.181 178.736 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 13.0 m-85 -63.0 -45.8 90.67 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 119.787 -0.765 . . . . 24.239999999999998 111.184 177.688 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 31.5 t -60.35 -33.85 55.48 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 CA-C-O 121.469 0.652 . . . . 19.399999999999999 111.057 -177.979 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 50.6 m -79.75 -53.44 6.8 Favored 'General case' 0 C--O 1.242 0.676 0 CA-C-N 115.508 -0.769 . . . . 19.75 110.882 -177.354 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 17.3 pt -68.95 -21.61 25.72 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 C-N-CA 118.514 -1.274 . . . . 22.789999999999999 113.596 -176.607 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -79.81 -9.09 59.62 Favored 'General case' 0 N--CA 1.472 0.672 0 O-C-N 123.157 0.286 . . . . 20.16 111.514 173.052 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 7.2 p 70.17 20.48 6.3 Favored 'General case' 0 C--O 1.255 1.386 0 C-N-CA 125.4 1.48 . . . . 20.649999999999999 112.755 -177.833 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 92.3 t -68.87 -53.6 25.5 Favored 'Isoleucine or valine' 0 C--O 1.266 1.947 0 CA-C-O 121.305 0.574 . . . . 18.370000000000001 111.377 173.86 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 61.2 49.21 80.43 Favored Glycine 0 N--CA 1.481 1.699 0 N-CA-C 116.462 1.345 . . . . 18.920000000000002 116.462 170.736 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 50.8 m-85 -51.22 -40.29 58.43 Favored 'General case' 0 C--O 1.25 1.106 0 O-C-N 120.822 -1.399 . . . . 17.850000000000001 113.27 178.922 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 87.37 4.51 80.56 Favored Glycine 0 N--CA 1.46 0.252 0 C-N-CA 119.893 -1.146 . . . . 20.449999999999999 113.467 -178.24 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 18.1 p-10 -63.48 -29.92 71.12 Favored 'General case' 0 C--O 1.25 1.083 0 C-N-CA 119.525 -0.87 . . . . 21.530000000000001 110.919 169.481 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 97.6 m-85 -130.25 141.49 50.62 Favored 'General case' 0 C--O 1.213 -0.864 0 N-CA-C 107.673 -1.232 . . . . 25.940000000000001 107.673 172.087 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 78.6 p -164.45 157.54 14.94 Favored Pre-proline 0 CA--C 1.539 0.535 0 N-CA-C 106.685 -1.598 . . . . 23.309999999999999 106.685 -178.963 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -70.26 143.14 47.57 Favored 'Trans proline' 0 C--O 1.244 0.777 0 C-N-CA 116.68 -1.746 . . . . 21.870000000000001 113.916 178.529 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.441 ' HD2' ' O ' ' A' ' 105' ' ' HOH . 92.6 m-70 -117.31 4.99 12.57 Favored 'General case' 0 CA--C 1.507 -0.704 0 CA-C-N 115.524 -0.762 . . . . 30.77 112.742 178.609 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 37.5 p -118.52 153.54 52.05 Favored Pre-proline 0 N--CA 1.467 0.385 0 O-C-N 123.741 0.651 . . . . 26.629999999999999 109.751 177.772 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_exo -54.81 -42.42 68.91 Favored 'Trans proline' 0 N--CA 1.459 -0.551 0 N-CA-C 113.736 0.629 . . . . 25.800000000000001 113.736 173.723 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 56.5 tp -61.28 -38.29 86.21 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 118.685 0.675 . . . . 28.25 109.778 178.66 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -68.83 -38.67 85.53 Favored Glycine 0 N--CA 1.473 1.154 0 N-CA-C 109.315 -1.514 . . . . 21.559999999999999 109.315 -177.362 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 67.2 mtt -62.17 -47.18 85.62 Favored 'General case' 0 C--O 1.239 0.525 0 N-CA-C 112.435 0.531 . . . . 24.690000000000001 112.435 175.996 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -59.93 -47.43 85.83 Favored 'General case' 0 C--O 1.24 0.596 0 C-N-CA 120.403 -0.519 . . . . 35.299999999999997 111.631 175.54 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 24.5 t80 -57.1 -42.67 81.22 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 116.412 -0.358 . . . . 29.109999999999999 110.794 178.068 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 54.6 m -63.6 -39.7 95.05 Favored 'General case' 0 C--O 1.243 0.732 0 C-N-CA 120.242 -0.583 . . . . 22.23 110.753 -178.181 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 81.6 m -62.09 -39.68 93.25 Favored 'General case' 0 C--O 1.243 0.734 0 C-N-CA 120.051 -0.66 . . . . 25.32 111.202 176.851 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 10.7 p -63.28 -42.3 99.08 Favored 'General case' 0 C--O 1.238 0.487 0 N-CA-C 112.529 0.566 . . . . 28.260000000000002 112.529 176.039 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 63.0 tp -63.64 -39.06 93.38 Favored 'General case' 0 C--O 1.247 0.949 0 CA-C-O 120.885 0.374 . . . . 22.5 110.954 177.802 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.586 HG23 HD12 ' A' ' 84' ' ' ILE . 34.4 mt -59.81 -48.98 85.59 Favored 'Isoleucine or valine' 0 C--O 1.24 0.572 0 N-CA-C 108.944 -0.761 . . . . 25.18 108.944 178.523 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 53.8 t -68.3 -41.79 83.96 Favored 'Isoleucine or valine' 0 C--O 1.242 0.699 0 CA-C-N 116.222 -0.444 . . . . 27.120000000000001 111.785 -176.926 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 96.1 mt -82.24 -25.16 34.37 Favored 'General case' 0 C--O 1.241 0.643 0 CA-C-O 120.838 0.351 . . . . 32.460000000000001 111.659 -176.385 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -103.26 -33.38 4.27 Favored Glycine 0 N--CA 1.462 0.394 0 N-CA-C 117.223 1.649 . . . . 23.670000000000002 117.223 -167.204 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.586 HD12 HG23 ' A' ' 80' ' ' ILE . 83.6 mt -64.97 -42.03 93.66 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 O-C-N 121.223 -1.163 . . . . 28.079999999999998 111.821 -174.18 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -69.13 -42.22 77.36 Favored Glycine 0 CA--C 1.522 0.472 0 N-CA-C 110.855 -0.898 . . . . 24.300000000000001 110.855 -179.474 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 39.2 m -61.66 -46.0 91.63 Favored 'General case' 0 C--O 1.223 -0.304 0 CA-C-N 114.842 -0.679 . . . . 28.359999999999999 110.408 179.781 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 42.6 t80 -63.72 -40.65 97.27 Favored 'General case' 0 C--O 1.249 1.038 0 C-N-CA 119.314 -0.954 . . . . 29.120000000000001 111.922 178.018 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -60.09 -44.58 94.71 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 120.689 -0.404 . . . . 26.43 111.169 -179.691 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 89.8 t -66.77 -37.32 79.25 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 N-CA-C 109.893 -0.41 . . . . 29.399999999999999 109.893 179.748 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -64.17 -45.43 88.47 Favored 'General case' 0 C--O 1.239 0.501 0 N-CA-C 113.712 1.004 . . . . 29.5 113.712 178.333 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 28.4 m -65.06 -38.52 82.98 Favored 'Isoleucine or valine' 0 C--O 1.233 0.231 0 C-N-CA 119.17 -1.012 . . . . 36.850000000000001 111.333 179.882 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.45 ' HA ' HD12 ' A' ' 95' ' ' LEU . 0.0 OUTLIER -66.89 -37.44 84.39 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 119.335 -0.946 . . . . 50.229999999999997 111.184 -179.612 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' ARG . . . . . . . . . . . . . 5.5 mmm180 -66.45 -37.27 84.77 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 112.158 0.429 . . . . 52.880000000000003 112.158 175.017 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 53.8 tp -62.41 -44.24 96.92 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 110.68 -0.119 . . . . 47.200000000000003 110.68 176.546 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.45 HD12 ' HA ' ' A' ' 92' ' ' GLU . 11.7 mt -41.74 -50.85 4.26 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 123.67 0.606 . . . . 52.729999999999997 111.719 175.128 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -57.52 -40.47 78.85 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 114.432 1.271 . . . . 60.100000000000001 114.432 -176.797 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' PHE . . . . . . . . . . . . . 79.6 m-85 -75.35 -37.37 60.71 Favored 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 113.78 1.03 . . . . 61.119999999999997 113.78 -179.968 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 53.4 mt -70.86 -50.85 30.67 Favored 'General case' 0 CA--C 1.534 0.363 0 O-C-N 123.242 0.338 . . . . 59.729999999999997 110.268 173.45 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 77.5 mt . . . . . 0 N--CA 1.463 0.198 0 N-CA-C 109.426 -0.583 . . . . 59.979999999999997 109.426 178.58 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' ' K' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' ' K' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' ' K' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' ' K' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' ' K' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 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 0 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' HOH . . . . . 0.441 ' O ' ' HD2' ' A' ' 68' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_