data_2duy_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 2duy _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 ' 11' ' ' PRO . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.446 0 N-CA-C 111.087 -0.389 . . . . 53.509999999999998 111.087 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 1.3 tt -79.13 105.5 3.23 Favored Pre-proline 0 C--N 1.331 -0.232 0 N-CA-C 107.996 -1.113 . . . . 51.600000000000001 107.996 179.415 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -64.57 147.23 90.16 Favored 'Trans proline' 0 C--N 1.342 0.223 0 C-N-CA 121.514 1.476 . . . . 47.969999999999999 113.267 -179.852 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 23.7 mm-40 -60.16 -31.7 70.35 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 113.278 0.844 . . . . 40.530000000000001 113.278 -179.956 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -69.79 -2.28 11.63 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 113.77 1.026 . . . . 41.030000000000001 113.77 -179.201 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 23.5 mt-30 -115.46 6.31 14.71 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.865 0.691 . . . . 53.670000000000002 112.865 -179.4 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 77.0 p -112.94 148.09 38.62 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.28 -0.418 . . . . 35.600000000000001 111.641 -178.983 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_exo -71.02 146.3 84.47 Favored 'Cis proline' 0 C--N 1.348 0.524 0 N-CA-C 109.898 -0.847 . . . . 27.449999999999999 109.898 -0.384 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 89.6 t -83.37 132.24 31.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 N-CA-C 109.872 -0.418 . . . . 25.41 109.872 -179.641 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 21.7 t -81.12 121.65 26.37 Favored 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 112.264 0.468 . . . . 20.289999999999999 112.264 -179.897 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 66.4 mt -62.66 -31.74 72.67 Favored 'General case' 0 C--O 1.221 -0.419 0 C-N-CA 120.94 -0.304 . . . . 19.800000000000001 110.663 179.858 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 -85.68 -27.0 25.63 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 116.737 2.125 . . . . 16.550000000000001 116.737 -178.022 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -113.91 -11.48 12.81 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 119.23 3.048 . . . . 38.630000000000003 119.23 -175.651 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.64 151.7 46.83 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 113.51 0.93 . . . . 20.059999999999999 113.51 -179.84 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 89.4 p -84.0 168.45 15.94 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 105.487 -2.042 . . . . 21.52 105.487 177.895 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 11.9 tp -56.17 -45.53 79.66 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.701 -0.4 . . . . 22.120000000000001 111.624 -179.674 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 29.8 mm-40 -60.77 -40.53 92.87 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 122.823 0.449 . . . . 46.859999999999999 111.949 -179.328 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 81.3 mt-10 -65.29 -39.39 92.47 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.189 -0.459 . . . . 32.159999999999997 110.162 -179.663 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 85.9 mt -68.82 -34.91 76.29 Favored 'General case' 0 C--O 1.237 0.439 0 N-CA-C 109.192 -0.67 . . . . 19.850000000000001 109.192 178.726 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' MSE . . . . . . . . . . . . . 97.1 mtp -69.67 -7.03 35.58 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.861 0.689 . . . . 33.329999999999998 112.861 -179.635 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -85.6 -12.98 50.17 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.458 -0.571 . . . . 23.469999999999999 109.458 178.589 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 44.6 mt -74.79 142.05 76.34 Favored Pre-proline 0 CA--C 1.517 -0.299 0 CA-C-O 121.393 0.616 . . . . 22.309999999999999 111.404 -179.969 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -59.01 123.53 13.7 Favored 'Trans proline' 0 N--CA 1.461 -0.424 0 C-N-CA 120.727 0.951 . . . . 25.23 113.253 -179.989 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 85.58 1.61 87.53 Favored Glycine 0 N--CA 1.451 -0.318 0 N-CA-C 116.05 1.18 . . . . 24.960000000000001 116.05 178.862 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 34.1 mm -106.07 113.24 42.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 117.335 0.568 . . . . 21.949999999999999 111.97 -179.811 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -101.32 -171.6 28.33 Favored Glycine 0 N--CA 1.448 -0.501 0 N-CA-C 110.233 -1.147 . . . . 22.800000000000001 110.233 179.769 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -62.23 -33.56 80.84 Favored 'Trans proline' 0 N--CA 1.464 -0.213 0 N-CA-C 115.279 1.223 . . . . 25.579999999999998 115.279 -179.905 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 68.9 t -71.64 -45.9 64.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 C-N-CA 120.752 -0.379 . . . . 24.620000000000001 111.47 -179.505 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 56.6 mt -68.81 -38.71 80.09 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 120.219 -0.593 . . . . 21.0 110.684 179.305 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.01 -42.09 93.57 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 109.24 -0.652 . . . . 16.949999999999999 109.24 179.844 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 4.5 ttp-105 -62.99 -45.83 90.57 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.151 -0.477 . . . . 40.200000000000003 111.233 179.432 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -64.38 -34.44 78.17 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 120.631 -0.428 . . . . 26.260000000000002 111.358 179.78 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 70.6 mt -63.86 -46.99 92.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 N-CA-C 108.686 -0.857 . . . . 15.33 108.686 179.181 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 98.5 t -61.01 -44.35 98.05 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 C-N-CA 120.08 -0.648 . . . . 14.119999999999999 110.617 179.869 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 95.3 mt-10 -63.85 -25.42 68.15 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 113.236 0.828 . . . . 25.73 113.236 -179.17 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -86.22 -0.35 86.94 Favored Glycine 0 CA--C 1.524 0.613 0 N-CA-C 115.74 1.056 . . . . 16.670000000000002 115.74 -179.976 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -62.95 151.53 85.5 Favored Pre-proline 0 N--CA 1.466 0.363 0 CA-C-N 117.47 0.635 . . . . 15.34 111.869 -179.517 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -87.4 160.86 48.37 Favored 'Cis proline' 0 N--CA 1.463 -0.277 0 N-CA-C 114.509 0.926 . . . . 14.99 114.509 0.12 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 97.9 m-85 -111.91 131.02 55.64 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 106.51 -1.663 . . . . 17.600000000000001 106.51 177.135 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -86.75 -28.16 23.19 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 108.826 -0.805 . . . . 17.5 108.826 178.955 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.26 160.88 43.01 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 107.745 -1.206 . . . . 15.76 107.745 177.878 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 65.6 t -60.28 -30.48 46.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 C-N-CA 120.701 -0.399 . . . . 14.18 111.853 -178.696 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' GLU . . . . . 0.44 ' OE2' ' NH2' ' A' ' 70' ' ' ARG . 2.4 tp10 -65.8 -15.26 62.72 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 119.386 -0.926 . . . . 29.239999999999998 112.449 -179.396 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 83.5 m-20 -70.67 -9.81 57.95 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 119.998 -0.681 . . . . 16.120000000000001 109.931 179.018 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 15.4 tp -62.93 -17.67 62.14 Favored 'General case' 0 C--O 1.239 0.515 0 C-N-CA 120.755 -0.378 . . . . 19.170000000000002 110.007 179.033 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 64.5 mt -66.92 -7.09 19.51 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 120.386 -0.525 . . . . 17.739999999999998 111.505 179.099 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 9.5 pttt -83.83 -10.08 58.3 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 119.472 -0.891 . . . . 24.550000000000001 110.417 177.802 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 60.1 t -85.9 127.12 40.44 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.23 0 N-CA-C 111.502 0.186 . . . . 16.719999999999999 111.502 -178.652 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 61.4 tttm -63.85 129.67 41.02 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 108.915 -0.772 . . . . 30.460000000000001 108.915 -179.294 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 100.34 -8.97 59.05 Favored Glycine 0 N--CA 1.451 -0.361 0 N-CA-C 116.998 1.559 . . . . 24.289999999999999 116.998 179.003 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 62.1 mt -105.08 87.72 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 117.562 0.681 . . . . 27.27 110.098 179.591 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -75.8 170.22 54.67 Favored Glycine 0 N--CA 1.45 -0.414 0 N-CA-C 110.99 -0.844 . . . . 29.77 110.99 -179.969 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_exo -58.19 -33.29 97.36 Favored 'Trans proline' 0 C--O 1.221 -0.347 0 C-N-CA 122.088 1.859 . . . . 31.079999999999998 113.563 179.991 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.14 -34.83 75.63 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.851 -0.796 . . . . 24.920000000000002 108.851 -179.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 62.6 m -68.29 -49.37 60.96 Favored 'General case' 0 CA--C 1.51 -0.585 0 N-CA-C 107.687 -1.227 . . . . 32.950000000000003 107.687 179.717 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 16.3 tp -62.43 -40.31 96.14 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 114.927 -1.033 . . . . 25.850000000000001 111.577 -179.259 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 84.7 tt0 -54.13 -41.6 68.56 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.314 0.578 . . . . 44.799999999999997 111.446 -179.643 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 2.5 mmp_? -71.98 -32.28 67.08 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.899 -0.591 . . . . 49.780000000000001 112.594 -179.288 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.9 mt -82.98 -21.69 33.88 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 117.443 2.386 . . . . 26.77 117.443 -178.163 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' ARG . . . . . 0.44 ' NH2' ' OE2' ' A' ' 53' ' ' GLU . 25.9 mtt85 -48.99 -39.81 38.45 Favored Pre-proline 0 C--N 1.327 -0.387 0 N-CA-C 116.442 2.016 . . . . 30.82 116.442 -177.388 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_exo -64.33 -25.9 63.89 Favored 'Trans proline' 0 CA--C 1.534 0.494 0 C-N-CA 117.534 -1.177 . . . . 19.199999999999999 114.375 -179.934 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 15.1 m-85 -96.84 -3.97 41.15 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 117.193 2.294 . . . . 35.539999999999999 117.193 -177.422 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 57.5 mt -111.89 155.64 23.33 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 120.086 3.365 . . . . 18.23 120.086 -175.302 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 44.7 ptt85 -145.81 162.57 35.37 Favored Pre-proline 0 C--N 1.33 -0.252 0 N-CA-C 104.084 -2.561 . . . . 31.620000000000001 104.084 174.902 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_exo . . . . . 0 C--O 1.244 0.797 0 C-N-CA 117.918 -0.921 . . . . 22.949999999999999 113.064 -179.824 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 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 build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.446 0 N-CA-C 111.087 -0.389 . . . . 53.509999999999998 111.087 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 1.3 tt -79.13 105.5 3.23 Favored Pre-proline 0 C--N 1.331 -0.232 0 N-CA-C 107.996 -1.113 . . . . 51.600000000000001 107.996 179.415 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -64.57 147.23 90.16 Favored 'Trans proline' 0 C--N 1.342 0.223 0 C-N-CA 121.514 1.476 . . . . 47.969999999999999 113.267 -179.852 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 23.7 mm-40 -60.16 -31.7 70.35 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 113.278 0.844 . . . . 40.530000000000001 113.278 -179.956 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -69.79 -2.28 11.63 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 113.77 1.026 . . . . 41.030000000000001 113.77 -179.201 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 81.2 mt-30 -115.46 6.31 14.71 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.865 0.691 . . . . 53.670000000000002 112.865 -179.4 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 77.0 p -112.94 148.09 38.62 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.28 -0.418 . . . . 35.600000000000001 111.641 -178.983 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_exo -71.02 146.3 84.47 Favored 'Cis proline' 0 C--N 1.348 0.524 0 N-CA-C 109.898 -0.847 . . . . 27.449999999999999 109.898 -0.384 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 89.6 t -83.37 132.24 31.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 N-CA-C 109.872 -0.418 . . . . 25.41 109.872 -179.641 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 21.7 t -81.12 121.65 26.37 Favored 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 112.264 0.468 . . . . 20.289999999999999 112.264 -179.897 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 66.4 mt -62.66 -31.74 72.67 Favored 'General case' 0 C--O 1.221 -0.419 0 C-N-CA 120.94 -0.304 . . . . 19.800000000000001 110.663 179.858 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 -85.68 -27.0 25.63 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 116.737 2.125 . . . . 16.550000000000001 116.737 -178.022 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -113.91 -11.48 12.81 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 119.23 3.048 . . . . 38.630000000000003 119.23 -175.651 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.64 151.7 46.83 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 113.51 0.93 . . . . 20.059999999999999 113.51 -179.84 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 89.4 p -84.0 168.45 15.94 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 105.487 -2.042 . . . . 21.52 105.487 177.895 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 11.9 tp -56.17 -45.53 79.66 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.701 -0.4 . . . . 22.120000000000001 111.624 -179.674 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' GLU . . . . . 0.747 ' HG2' ' O ' ' A' ' 118' ' ' HOH . 29.8 mm-40 -60.77 -40.53 92.87 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 122.823 0.449 . . . . 46.859999999999999 111.949 -179.328 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 81.3 mt-10 -65.29 -39.39 92.47 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.189 -0.459 . . . . 32.159999999999997 110.162 -179.663 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 85.9 mt -68.82 -34.91 76.29 Favored 'General case' 0 C--O 1.237 0.439 0 N-CA-C 109.192 -0.67 . . . . 19.850000000000001 109.192 178.726 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' MSE . . . . . 0.533 ' HE3' ' HD3' ' A' ' 37' ' ' PRO . 97.1 mtp -69.67 -7.03 35.58 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.861 0.689 . . . . 33.329999999999998 112.861 -179.635 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -85.6 -12.98 50.17 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.458 -0.571 . . . . 23.469999999999999 109.458 178.589 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 44.6 mt -74.79 142.05 76.34 Favored Pre-proline 0 CA--C 1.517 -0.299 0 CA-C-O 121.393 0.616 . . . . 22.309999999999999 111.404 -179.969 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -59.01 123.53 13.7 Favored 'Trans proline' 0 N--CA 1.461 -0.424 0 C-N-CA 120.727 0.951 . . . . 25.23 113.253 -179.989 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 85.58 1.61 87.53 Favored Glycine 0 N--CA 1.451 -0.318 0 N-CA-C 116.05 1.18 . . . . 24.960000000000001 116.05 178.862 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 34.1 mm -106.07 113.24 42.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 117.335 0.568 . . . . 21.949999999999999 111.97 -179.811 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -101.32 -171.6 28.33 Favored Glycine 0 N--CA 1.448 -0.501 0 N-CA-C 110.233 -1.147 . . . . 22.800000000000001 110.233 179.769 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' PRO . . . . . 0.533 ' HD3' ' HE3' ' A' ' 30' ' ' MSE . 71.6 Cg_endo -62.23 -33.56 80.84 Favored 'Trans proline' 0 N--CA 1.464 -0.213 0 N-CA-C 115.279 1.223 . . . . 25.579999999999998 115.279 -179.905 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 68.9 t -71.64 -45.9 64.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 C-N-CA 120.752 -0.379 . . . . 24.620000000000001 111.47 -179.505 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 56.6 mt -68.81 -38.71 80.09 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 120.219 -0.593 . . . . 21.0 110.684 179.305 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.01 -42.09 93.57 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 109.24 -0.652 . . . . 16.949999999999999 109.24 179.844 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ARG . . . . . 0.472 ' HB3' HH11 ' A' ' 41' ' ' ARG . 4.5 ttp-105 -62.99 -45.83 90.57 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.151 -0.477 . . . . 40.200000000000003 111.233 179.432 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -64.38 -34.44 78.17 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 120.631 -0.428 . . . . 26.260000000000002 111.358 179.78 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 70.6 mt -63.86 -46.99 92.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 N-CA-C 108.686 -0.857 . . . . 15.33 108.686 179.181 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 98.5 t -61.01 -44.35 98.05 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 C-N-CA 120.08 -0.648 . . . . 14.119999999999999 110.617 179.869 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 95.3 mt-10 -63.85 -25.42 68.15 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 113.236 0.828 . . . . 25.73 113.236 -179.17 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -86.22 -0.35 86.94 Favored Glycine 0 CA--C 1.524 0.613 0 N-CA-C 115.74 1.056 . . . . 16.670000000000002 115.74 -179.976 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -62.95 151.53 85.5 Favored Pre-proline 0 N--CA 1.466 0.363 0 CA-C-N 117.47 0.635 . . . . 15.34 111.869 -179.517 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -87.4 160.86 48.37 Favored 'Cis proline' 0 N--CA 1.463 -0.277 0 N-CA-C 114.509 0.926 . . . . 14.99 114.509 0.12 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 97.9 m-85 -111.91 131.02 55.64 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 106.51 -1.663 . . . . 17.600000000000001 106.51 177.135 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -86.75 -28.16 23.19 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 108.826 -0.805 . . . . 17.5 108.826 178.955 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.26 160.88 43.01 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 107.745 -1.206 . . . . 15.76 107.745 177.878 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 65.6 t -60.28 -30.48 46.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 C-N-CA 120.701 -0.399 . . . . 14.18 111.853 -178.696 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -65.8 -15.26 62.72 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 119.386 -0.926 . . . . 29.239999999999998 112.449 -179.396 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 83.5 m-20 -70.67 -9.81 57.95 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 119.998 -0.681 . . . . 16.120000000000001 109.931 179.018 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' LEU . . . . . 0.495 HD23 HD13 ' A' ' 66' ' ' LEU . 15.4 tp -62.93 -17.67 62.14 Favored 'General case' 0 C--O 1.239 0.515 0 C-N-CA 120.755 -0.378 . . . . 19.170000000000002 110.007 179.033 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 64.5 mt -66.92 -7.09 19.51 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 120.386 -0.525 . . . . 17.739999999999998 111.505 179.099 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 9.5 pttt -83.83 -10.08 58.3 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 119.472 -0.891 . . . . 24.550000000000001 110.417 177.802 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 60.1 t -85.9 127.12 40.44 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.23 0 N-CA-C 111.502 0.186 . . . . 16.719999999999999 111.502 -178.652 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 61.4 tttm -63.85 129.67 41.02 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 108.915 -0.772 . . . . 30.460000000000001 108.915 -179.294 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 100.34 -8.97 59.05 Favored Glycine 0 N--CA 1.451 -0.361 0 N-CA-C 116.998 1.559 . . . . 24.289999999999999 116.998 179.003 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 62.1 mt -105.08 87.72 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 117.562 0.681 . . . . 27.27 110.098 179.591 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -75.8 170.22 54.67 Favored Glycine 0 N--CA 1.45 -0.414 0 N-CA-C 110.99 -0.844 . . . . 29.77 110.99 -179.969 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_exo -58.19 -33.29 97.36 Favored 'Trans proline' 0 C--O 1.221 -0.347 0 C-N-CA 122.088 1.859 . . . . 31.079999999999998 113.563 179.991 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.14 -34.83 75.63 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.851 -0.796 . . . . 24.920000000000002 108.851 -179.921 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 62.6 m -68.29 -49.37 60.96 Favored 'General case' 0 CA--C 1.51 -0.585 0 N-CA-C 107.687 -1.227 . . . . 32.950000000000003 107.687 179.717 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' LEU . . . . . 0.495 HD13 HD23 ' A' ' 55' ' ' LEU . 16.3 tp -62.43 -40.31 96.14 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 114.927 -1.033 . . . . 25.850000000000001 111.577 -179.259 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 84.7 tt0 -54.13 -41.6 68.56 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.314 0.578 . . . . 44.799999999999997 111.446 -179.643 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 2.5 mmp_? -71.98 -32.28 67.08 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.899 -0.591 . . . . 49.780000000000001 112.594 -179.288 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.9 mt -82.98 -21.69 33.88 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 117.443 2.386 . . . . 26.77 117.443 -178.163 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 25.9 mtt85 -48.99 -39.81 38.45 Favored Pre-proline 0 C--N 1.327 -0.387 0 N-CA-C 116.442 2.016 . . . . 30.82 116.442 -177.388 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_exo -64.33 -25.9 63.89 Favored 'Trans proline' 0 CA--C 1.534 0.494 0 C-N-CA 117.534 -1.177 . . . . 19.199999999999999 114.375 -179.934 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 15.1 m-85 -96.84 -3.97 41.15 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 117.193 2.294 . . . . 35.539999999999999 117.193 -177.422 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 57.5 mt -111.89 155.64 23.33 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 120.086 3.365 . . . . 18.23 120.086 -175.302 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 44.7 ptt85 -145.81 162.57 35.37 Favored Pre-proline 0 C--N 1.33 -0.252 0 N-CA-C 104.084 -2.561 . . . . 31.620000000000001 104.084 174.902 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_exo . . . . . 0 C--O 1.244 0.797 0 C-N-CA 117.918 -0.921 . . . . 22.949999999999999 113.064 -179.824 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 100' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 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 . . . . . 0.747 ' O ' ' HG2' ' A' ' 27' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.446 0 N-CA-C 111.087 -0.389 . . . . 53.51 111.087 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 1.3 tt -79.13 105.5 3.23 Favored Pre-proline 0 C--N 1.331 -0.232 0 N-CA-C 107.996 -1.113 . . . . 51.6 107.996 179.415 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -64.57 147.23 90.16 Favored 'Trans proline' 0 C--N 1.342 0.223 0 C-N-CA 121.514 1.476 . . . . 47.97 113.267 -179.852 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 23.7 mm-40 -60.16 -31.7 70.35 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 113.278 0.844 . . . . 40.53 113.278 -179.956 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -69.79 -2.28 11.63 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 113.77 1.026 . . . . 41.03 113.77 -179.201 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 23.5 mt-30 -115.46 6.31 14.71 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.865 0.691 . . . . 53.67 112.865 -179.4 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 77.0 p -112.94 148.09 38.62 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.28 -0.418 . . . . 35.6 111.641 -178.983 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_exo -71.02 146.3 84.47 Favored 'Cis proline' 0 C--N 1.348 0.524 0 N-CA-C 109.898 -0.847 . . . . 27.45 109.898 -0.384 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 89.6 t -83.37 132.24 31.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 N-CA-C 109.872 -0.418 . . . . 25.41 109.872 -179.641 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 21.7 t -81.12 121.65 26.37 Favored 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 112.264 0.468 . . . . 20.29 112.264 -179.897 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 66.4 mt -62.66 -31.74 72.67 Favored 'General case' 0 C--O 1.221 -0.419 0 C-N-CA 120.94 -0.304 . . . . 19.8 110.663 179.858 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 -85.68 -27.0 25.63 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 116.737 2.125 . . . . 16.55 116.737 -178.022 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -113.91 -11.48 12.81 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 119.23 3.048 . . . . 38.63 119.23 -175.651 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.64 151.7 46.83 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 113.51 0.93 . . . . 20.06 113.51 -179.84 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 89.4 p -84.0 168.45 15.94 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 105.487 -2.042 . . . . 21.52 105.487 177.895 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 11.9 tp -56.17 -45.53 79.66 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.701 -0.4 . . . . 22.12 111.624 -179.674 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.747 ' HG2' ' O ' ' A' ' 118' ' ' HOH . 29.8 mm-40 -60.77 -40.53 92.87 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 122.823 0.449 . . . . 46.86 111.949 -179.328 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 81.3 mt-10 -65.29 -39.39 92.47 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.189 -0.459 . . . . 32.16 110.162 -179.663 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 85.9 mt -68.82 -34.91 76.29 Favored 'General case' 0 C--O 1.237 0.439 0 N-CA-C 109.192 -0.67 . . . . 19.85 109.192 178.726 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' MSE . . . . . 0.533 ' HE3' ' HD3' ' A' ' 37' ' ' PRO . 97.1 mtp -69.67 -7.03 35.58 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.861 0.689 . . . . 33.33 112.861 -179.635 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -85.6 -12.98 50.17 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.458 -0.571 . . . . 23.47 109.458 178.589 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 44.6 mt -74.79 142.05 76.34 Favored Pre-proline 0 CA--C 1.517 -0.299 0 CA-C-O 121.393 0.616 . . . . 22.31 111.404 -179.969 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -59.01 123.53 13.7 Favored 'Trans proline' 0 N--CA 1.461 -0.424 0 C-N-CA 120.727 0.951 . . . . 25.23 113.253 -179.989 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 85.58 1.61 87.53 Favored Glycine 0 N--CA 1.451 -0.318 0 N-CA-C 116.05 1.18 . . . . 24.96 116.05 178.862 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 34.1 mm -106.07 113.24 42.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 117.335 0.568 . . . . 21.95 111.97 -179.811 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -101.32 -171.6 28.33 Favored Glycine 0 N--CA 1.448 -0.501 0 N-CA-C 110.233 -1.147 . . . . 22.8 110.233 179.769 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.533 ' HD3' ' HE3' ' A' ' 30' ' ' MSE . 71.6 Cg_endo -62.23 -33.56 80.84 Favored 'Trans proline' 0 N--CA 1.464 -0.213 0 N-CA-C 115.279 1.223 . . . . 25.58 115.279 -179.905 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 68.9 t -71.64 -45.9 64.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 C-N-CA 120.752 -0.379 . . . . 24.62 111.47 -179.505 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 56.6 mt -68.81 -38.71 80.09 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 120.219 -0.593 . . . . 21.0 110.684 179.305 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.01 -42.09 93.57 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 109.24 -0.652 . . . . 16.95 109.24 179.844 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.472 HH11 ' HB3' ' A' ' 41' ' ' ARG . 4.5 ttp-105 -62.99 -45.83 90.57 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.151 -0.477 . . . . 40.2 111.233 179.432 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -64.38 -34.44 78.17 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 120.631 -0.428 . . . . 26.26 111.358 179.78 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 70.6 mt -63.86 -46.99 92.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 N-CA-C 108.686 -0.857 . . . . 15.33 108.686 179.181 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 98.5 t -61.01 -44.35 98.05 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 C-N-CA 120.08 -0.648 . . . . 14.12 110.617 179.869 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 95.3 mt-10 -63.85 -25.42 68.15 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 113.236 0.828 . . . . 25.73 113.236 -179.17 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -86.22 -0.35 86.94 Favored Glycine 0 CA--C 1.524 0.613 0 N-CA-C 115.74 1.056 . . . . 16.67 115.74 -179.976 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -62.95 151.53 85.5 Favored Pre-proline 0 N--CA 1.466 0.363 0 CA-C-N 117.47 0.635 . . . . 15.34 111.869 -179.517 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -87.4 160.86 48.37 Favored 'Cis proline' 0 N--CA 1.463 -0.277 0 N-CA-C 114.509 0.926 . . . . 14.99 114.509 0.12 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 97.9 m-85 -111.91 131.02 55.64 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 106.51 -1.663 . . . . 17.6 106.51 177.135 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -86.75 -28.16 23.19 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 108.826 -0.805 . . . . 17.5 108.826 178.955 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.26 160.88 43.01 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 107.745 -1.206 . . . . 15.76 107.745 177.878 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 65.6 t -60.28 -30.48 46.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 C-N-CA 120.701 -0.399 . . . . 14.18 111.853 -178.696 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -65.8 -15.26 62.72 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 119.386 -0.926 . . . . 29.24 112.449 -179.396 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 83.5 m-20 -70.67 -9.81 57.95 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 119.998 -0.681 . . . . 16.12 109.931 179.018 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.495 HD23 HD13 ' A' ' 66' ' ' LEU . 15.4 tp -62.93 -17.67 62.14 Favored 'General case' 0 C--O 1.239 0.515 0 C-N-CA 120.755 -0.378 . . . . 19.17 110.007 179.033 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 64.5 mt -66.92 -7.09 19.51 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 120.386 -0.525 . . . . 17.74 111.505 179.099 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 9.5 pttt -83.83 -10.08 58.3 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 119.472 -0.891 . . . . 24.55 110.417 177.802 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 60.1 t -85.9 127.12 40.44 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.23 0 N-CA-C 111.502 0.186 . . . . 16.72 111.502 -178.652 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 61.4 tttm -63.85 129.67 41.02 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 108.915 -0.772 . . . . 30.46 108.915 -179.294 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 100.34 -8.97 59.05 Favored Glycine 0 N--CA 1.451 -0.361 0 N-CA-C 116.998 1.559 . . . . 24.29 116.998 179.003 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 62.1 mt -105.08 87.72 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 117.562 0.681 . . . . 27.27 110.098 179.591 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -75.8 170.22 54.67 Favored Glycine 0 N--CA 1.45 -0.414 0 N-CA-C 110.99 -0.844 . . . . 29.77 110.99 -179.969 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_exo -58.19 -33.29 97.36 Favored 'Trans proline' 0 C--O 1.221 -0.347 0 C-N-CA 122.088 1.859 . . . . 31.08 113.563 179.991 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.14 -34.83 75.63 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.851 -0.796 . . . . 24.92 108.851 -179.921 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 62.6 m -68.29 -49.37 60.96 Favored 'General case' 0 CA--C 1.51 -0.585 0 N-CA-C 107.687 -1.227 . . . . 32.95 107.687 179.717 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.495 HD13 HD23 ' A' ' 55' ' ' LEU . 16.3 tp -62.43 -40.31 96.14 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 114.927 -1.033 . . . . 25.85 111.577 -179.259 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 84.7 tt0 -54.13 -41.6 68.56 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.314 0.578 . . . . 44.8 111.446 -179.643 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 2.5 mmp_? -71.98 -32.28 67.08 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.899 -0.591 . . . . 49.78 112.594 -179.288 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.9 mt -82.98 -21.69 33.88 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 117.443 2.386 . . . . 26.77 117.443 -178.163 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 25.9 mtt85 -48.99 -39.81 38.45 Favored Pre-proline 0 C--N 1.327 -0.387 0 N-CA-C 116.442 2.016 . . . . 30.82 116.442 -177.388 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_exo -64.33 -25.9 63.89 Favored 'Trans proline' 0 CA--C 1.534 0.494 0 C-N-CA 117.534 -1.177 . . . . 19.2 114.375 -179.934 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 15.1 m-85 -96.84 -3.97 41.15 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 117.193 2.294 . . . . 35.54 117.193 -177.422 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 57.5 mt -111.89 155.64 23.33 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 120.086 3.365 . . . . 18.23 120.086 -175.302 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 44.7 ptt85 -145.81 162.57 35.37 Favored Pre-proline 0 C--N 1.33 -0.252 0 N-CA-C 104.084 -2.561 . . . . 31.62 104.084 174.902 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_exo . . . . . 0 C--O 1.244 0.797 0 C-N-CA 117.918 -0.921 . . . . 22.95 113.064 -179.824 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 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 0 . 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 . . . . . 0.747 ' O ' ' HG2' ' A' ' 27' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 stop_ save_