data_2o7k_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 2o7k _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 ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.285 0 CA-C-O 121.217 0.532 . . . . 73.2 111.63 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 62.3 mt -102.02 115.81 44.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.917 -0.583 . . . . 70.62 111.053 -179.783 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 3.0 p -80.27 139.61 17.94 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.329 0 CA-C-O 121.189 0.518 . . . . 52.99 110.996 179.351 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . . . -82.6 149.54 27.38 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 107.77 -1.196 . . . . 45.28 107.77 178.93 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 11.5 p -135.21 152.91 33.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 106.154 -1.795 . . . . 44.73 106.154 178.767 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 73.1 p -134.07 176.03 8.95 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-O 120.52 0.2 . . . . 38.13 110.82 -178.747 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 -59.62 -32.32 70.31 Favored 'General case' 0 C--O 1.233 0.233 0 C-N-CA 119.765 -0.774 . . . . 41.09 110.401 178.456 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.57 -32.6 74.04 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 116.097 1.888 . . . . 37.89 116.097 -177.678 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 20.3 p-10 -125.91 13.21 7.9 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 115.203 1.557 . . . . 43.06 115.203 -177.641 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 40.9 t80 -56.4 -53.2 60.16 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 112.498 0.555 . . . . 45.53 112.498 -178.897 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . . . -58.1 -28.27 64.45 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 114.72 1.378 . . . . 49.59 114.72 -178.762 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 72.2 p -85.42 -32.63 22.23 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 119.648 -0.821 . . . . 56.74 111.175 179.532 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' LYS . . . . . 0.402 ' O ' ' NE2' ' A' ' 20' ' ' GLN . . . -78.3 -30.99 48.68 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 113.534 0.939 . . . . 58.45 113.534 178.71 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 61.3 t -111.42 82.76 0.64 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 N-CA-C 116.965 2.209 . . . . 49.46 116.965 -178.231 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . . . -143.1 -31.01 0.5 Allowed 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 114.487 1.291 . . . . 57.69 114.487 -179.678 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 50.8 m -135.53 133.05 38.01 Favored 'General case' 0 N--CA 1.464 0.248 0 N-CA-C 117.447 2.388 . . . . 74.91 117.447 -178.259 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 91.06 -164.52 29.86 Favored Glycine 0 C--N 1.331 0.305 0 CA-C-N 115.564 -0.744 . . . . 55.51 112.689 -179.62 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 82.5 t -105.13 129.94 57.07 Favored 'Isoleucine or valine' 0 C--O 1.234 0.288 0 C-N-CA 120.507 -0.477 . . . . 56.06 110.296 179.459 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' GLN . . . . . 0.402 ' NE2' ' O ' ' A' ' 14' ' ' LYS . 16.8 mt-30 -143.36 138.67 29.6 Favored 'General case' 0 CA--C 1.512 -0.507 0 N-CA-C 112.465 0.543 . . . . 64.61 112.465 -179.754 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 51.0 tp -103.97 121.29 42.84 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 106.705 -1.591 . . . . 44.98 106.705 179.013 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 64.6 t -107.84 121.3 60.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 121.171 0.51 . . . . 30.09 111.62 179.787 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 16.4 t0 -95.52 112.82 24.46 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.454 -0.794 . . . . 28.58 110.589 179.692 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -92.64 111.18 22.68 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 105.732 -1.951 . . . . 32.82 105.732 177.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 8.1 p-90 -134.13 -175.47 3.87 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 121.395 0.617 . . . . 42.0 111.738 -177.835 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -162.76 150.03 13.34 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 106.724 -1.584 . . . . 30.5 106.724 179.927 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 42.4 p -59.41 -32.14 69.91 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 114.823 1.416 . . . . 37.31 114.823 -179.282 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 38.4 p-90 -82.59 -0.89 49.0 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 113.94 1.089 . . . . 41.27 113.94 -179.831 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 42.0 t -85.24 110.91 19.38 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 113.807 1.04 . . . . 39.19 113.807 -178.41 178.038 -146.286 74.33 101.402 2.036 103.776 80.836 -59.953 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -66.72 -50.47 48.0 Favored Glycine 0 CA--C 1.522 0.503 0 C-N-CA 120.803 -0.713 . . . . 38.08 114.569 179.744 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_exo -61.3 -26.1 81.33 Favored 'Trans proline' 0 C--N 1.343 0.238 0 C-N-CA 121.39 1.393 . . . . 35.89 112.502 179.874 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 83.3 m -69.07 -38.17 78.89 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 109.551 -0.537 . . . . 35.03 109.551 179.303 -59.953 80.836 74.33 103.776 2.036 101.402 -146.286 178.038 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . . . -64.49 -32.23 73.78 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.04 -0.726 . . . . 40.16 109.04 179.44 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 2.0 tpt -72.34 -40.12 67.62 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.849 -0.614 . . . . 73.36 112.602 -179.473 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 22.3 pt -81.76 -15.32 12.27 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.212 0 N-CA-C 113.616 0.969 . . . . 55.33 113.616 -179.602 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -48.43 -54.78 23.04 Favored Pre-proline 0 CA--C 1.534 0.342 0 N-CA-C 114.013 1.116 . . . . 37.81 114.013 -178.994 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -61.79 -32.56 86.03 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 120.984 1.123 . . . . 47.38 112.548 179.845 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 84.6 t -66.54 -35.1 74.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.548 -0.296 . . . . 41.89 110.848 179.696 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 91.8 mt -72.42 -38.05 68.48 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-N 116.539 -0.3 . . . . 41.55 110.52 179.733 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -60.52 -38.22 83.69 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.503 -0.317 . . . . 74.21 110.557 179.41 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . . . -71.71 -47.64 52.62 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.078 -0.712 . . . . 53.34 109.078 179.315 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 45.7 tp -55.71 -41.11 73.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.846 -0.615 . . . . 55.36 110.296 179.71 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -55.43 -46.91 76.68 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.971 -0.559 . . . . 59.5 110.041 179.84 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -63.04 -42.3 99.72 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.181 -0.463 . . . . 60.38 111.297 179.82 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 66.8 m-20 -64.22 -16.14 61.41 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 113.176 0.806 . . . . 75.68 113.176 -179.909 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 32.9 m-85 -122.89 18.96 10.17 Favored 'General case' 0 CA--C 1.515 -0.378 0 N-CA-C 116.027 1.862 . . . . 60.39 116.027 -179.756 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . . . -52.97 128.89 28.75 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 107.064 -1.458 . . . . 66.12 107.064 178.61 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 84.92 -11.18 60.61 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.066 -1.064 . . . . 65.5 113.778 179.726 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . . . -106.42 -50.06 3.22 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.997 -0.371 . . . . 60.79 109.997 179.244 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -141.9 153.69 44.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.16 0.505 . . . . 55.36 110.769 179.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 25.1 m-20 -102.99 141.06 36.44 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 107.853 -1.166 . . . . 73.4 107.853 178.769 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 56.3 mt -116.15 121.61 67.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 N-CA-C 106.145 -1.798 . . . . 51.03 106.145 177.79 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 13.8 mt -115.91 155.63 27.62 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 115.941 -0.572 . . . . 38.04 109.758 -178.713 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 24.6 mttm -121.43 134.1 55.08 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 108.439 -0.949 . . . . 65.0 108.439 178.118 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.7 tt -132.38 110.1 10.32 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.983 0.421 . . . . 39.51 110.539 178.626 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -68.62 114.63 7.18 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 107.538 -1.282 . . . . 46.69 107.538 179.218 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 14.2 m -66.86 -24.12 32.08 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 N-CA-C 115.096 1.517 . . . . 32.63 115.096 -178.12 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 -70.09 -43.0 72.0 Favored 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 120.085 -0.646 . . . . 41.36 111.874 178.817 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . . . -86.07 -7.38 58.65 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 113.423 0.898 . . . . 43.46 113.423 -179.535 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 63.5 m-80 -139.0 60.36 17.68 Favored Pre-proline 0 N--CA 1.466 0.373 0 N-CA-C 112.413 0.523 . . . . 38.13 112.413 -179.139 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -60.94 -31.96 92.01 Favored 'Trans proline' 0 CA--C 1.533 0.436 0 C-N-CA 122.188 1.925 . . . . 47.13 115.603 -179.767 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 73.0 m -56.98 -53.95 52.23 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.916 0.71 . . . . 58.55 112.916 -179.244 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 87.7 m -63.52 -35.72 81.42 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 120.193 -0.603 . . . . 39.62 111.043 -179.713 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -65.52 -38.4 89.55 Favored 'General case' 0 C--O 1.241 0.635 0 C-N-CA 120.431 -0.508 . . . . 34.71 110.172 179.609 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -69.45 -45.03 70.02 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-N 115.624 -0.716 . . . . 36.73 109.502 -179.559 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -54.02 -42.27 68.95 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 113.924 1.083 . . . . 58.7 113.924 -179.327 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -99.15 24.8 7.45 Favored 'General case' 0 CA--C 1.514 -0.428 0 N-CA-C 114.271 1.211 . . . . 41.72 114.271 -179.361 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 67.1 mm-40 50.54 39.81 22.02 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 115.068 1.507 . . . . 77.85 115.068 177.325 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 84.7 t -78.75 104.71 6.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 N-CA-C 107.913 -1.143 . . . . 48.13 107.913 178.715 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 85.3 mmm -94.11 -53.26 4.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.33 -0.396 . . . . 83.22 112.048 -179.087 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . . . -111.38 153.77 25.57 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 116.115 -0.493 . . . . 48.71 109.909 -179.902 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 33.7 pt -133.79 153.91 80.23 Favored Pre-proline 0 N--CA 1.449 -0.477 0 N-CA-C 107.962 -1.125 . . . . 40.94 107.962 178.678 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -67.26 142.79 64.18 Favored 'Cis proline' 0 CA--C 1.534 0.502 0 N-CA-C 117.412 2.043 . . . . 38.03 117.412 0.595 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 12.7 m -133.16 136.43 45.73 Favored 'General case' 0 CA--C 1.506 -0.732 0 N-CA-C 103.255 -2.869 . . . . 33.05 103.255 175.429 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 37.1 mt -124.52 129.24 50.24 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 106.007 -1.849 . . . . 49.88 106.007 179.616 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 46.3 mt -120.92 132.15 71.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 C-N-CA 120.063 -0.655 . . . . 33.36 109.938 178.917 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 98.8 t -93.29 121.95 44.38 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.402 0 N-CA-C 108.194 -1.039 . . . . 32.9 108.194 178.987 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 55.0 m-85 -103.35 142.14 34.73 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.1 0.476 . . . . 39.98 109.758 178.353 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . . . -130.77 109.97 10.99 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 105.128 -2.175 . . . . 53.03 105.128 -179.335 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 68.5 m-20 47.97 55.55 8.47 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.559 0.577 . . . . 61.39 112.559 -178.761 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 76.53 -2.94 56.6 Favored Glycine 0 N--CA 1.447 -0.617 0 N-CA-C 117.098 1.599 . . . . 41.25 117.098 178.813 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 96.5 mm-40 -116.84 135.55 23.02 Favored Pre-proline 0 N--CA 1.466 0.328 0 CA-C-N 118.244 1.022 . . . . 46.2 113.569 -179.544 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -71.06 126.22 12.24 Favored 'Trans proline' 0 CA--C 1.54 0.821 0 N-CA-C 108.737 -1.294 . . . . 37.33 108.737 179.374 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 33.6 m -117.72 -17.37 7.47 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 N-CA-C 113.847 1.055 . . . . 50.4 113.847 -178.805 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -152.36 158.15 42.3 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 112.116 0.413 . . . . 47.16 112.116 179.212 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . . . -142.55 135.26 28.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.101 -0.5 . . . . 65.89 110.94 -178.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 63.3 t -129.12 132.75 66.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 N-CA-C 107.266 -1.383 . . . . 46.12 107.266 179.385 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 58.4 t -117.63 147.59 20.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 N-CA-C 113.244 0.831 . . . . 58.19 113.244 -179.085 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 73.28 176.44 31.88 Favored Glycine 0 C--N 1.333 0.375 0 N-CA-C 114.751 0.66 . . . . 38.81 114.751 179.498 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 91.7 t80 -58.38 140.45 53.63 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-O 120.814 0.34 . . . . 42.57 111.486 179.637 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 98.2 mm-40 -144.41 141.25 17.68 Favored Pre-proline 0 C--N 1.327 -0.392 0 N-CA-C 109.957 -0.386 . . . . 60.54 109.957 179.095 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_exo -72.34 153.68 56.01 Favored 'Trans proline' 0 CA--C 1.536 0.596 0 C-N-CA 123.633 2.889 . . . . 48.85 108.269 179.371 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . . . -52.85 -38.49 61.54 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.197 0.443 . . . . 51.97 112.197 -179.929 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . . . -57.77 -42.47 84.14 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 111.958 0.355 . . . . 57.46 111.958 -179.635 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 69.3 m-80 -71.08 -31.98 68.52 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 113.457 0.91 . . . . 76.99 113.457 179.998 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 88.6 mt -75.67 -41.23 54.49 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.089 -0.644 . . . . 50.59 110.427 179.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -61.01 -40.19 92.6 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.181 -0.674 . . . . 56.91 109.181 179.708 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . . . -58.53 -51.12 71.24 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 120.004 -0.679 . . . . 62.51 109.88 179.282 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 86.8 t -55.71 -36.7 43.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 N-CA-C 112.491 0.552 . . . . 52.85 112.491 -179.597 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 30.1 mt -71.21 -47.68 55.96 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 120.07 -0.652 . . . . 55.09 111.109 179.486 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 64.1 m-20 -55.61 -31.45 62.26 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.892 0.377 . . . . 73.43 111.247 -179.1 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . . . -67.21 -8.16 29.34 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.108 -0.496 . . . . 62.59 112.053 -179.763 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 98.5 m-70 -127.44 2.56 6.27 Favored 'General case' 0 CA--C 1.515 -0.372 0 N-CA-C 114.088 1.144 . . . . 54.75 114.088 -178.37 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 78.2 mt . . . . . 0 C--O 1.255 1.356 0 CA-C-O 117.955 -1.021 . . . . 77.06 109.935 178.624 . . . . . . . . 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 build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.285 0 CA-C-O 121.217 0.532 . . . . 73.2 111.63 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 62.3 mt -102.02 115.81 44.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.917 -0.583 . . . . 70.62 111.053 -179.783 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' VAL . . . . . 0.588 HG13 HD22 ' A' ' 53' ' ' LEU . 3.0 p -80.27 139.61 17.94 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.329 0 CA-C-O 121.189 0.518 . . . . 52.99 110.996 179.351 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . . . -82.6 149.54 27.38 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 107.77 -1.196 . . . . 45.28 107.77 178.93 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 11.5 p -135.21 152.91 33.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 106.154 -1.795 . . . . 44.73 106.154 178.767 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 73.1 p -134.07 176.03 8.95 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-O 120.52 0.2 . . . . 38.13 110.82 -178.747 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 -59.62 -32.32 70.31 Favored 'General case' 0 C--O 1.233 0.233 0 C-N-CA 119.765 -0.774 . . . . 41.09 110.401 178.456 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.57 -32.6 74.04 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 116.097 1.888 . . . . 37.89 116.097 -177.678 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 20.3 p-10 -125.91 13.21 7.9 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 115.203 1.557 . . . . 43.06 115.203 -177.641 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 40.9 t80 -56.4 -53.2 60.16 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 112.498 0.555 . . . . 45.53 112.498 -178.897 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . . . -58.1 -28.27 64.45 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 114.72 1.378 . . . . 49.59 114.72 -178.762 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 72.2 p -85.42 -32.63 22.23 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 119.648 -0.821 . . . . 56.74 111.175 179.532 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' LYS . . . . . 0.402 ' O ' ' NE2' ' A' ' 20' ' ' GLN . . . -78.3 -30.99 48.68 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 113.534 0.939 . . . . 58.45 113.534 178.71 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 61.3 t -111.42 82.76 0.64 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 N-CA-C 116.965 2.209 . . . . 49.46 116.965 -178.231 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . . . -143.1 -31.01 0.5 Allowed 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 114.487 1.291 . . . . 57.69 114.487 -179.678 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' SER . . . . . 0.551 ' O ' ' HA ' ' A' ' 80' ' ' ASP . 50.8 m -135.53 133.05 38.01 Favored 'General case' 0 N--CA 1.464 0.248 0 N-CA-C 117.447 2.388 . . . . 74.91 117.447 -178.259 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 91.06 -164.52 29.86 Favored Glycine 0 C--N 1.331 0.305 0 CA-C-N 115.564 -0.744 . . . . 55.51 112.689 -179.62 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' VAL . . . . . 0.554 ' C ' ' HG3' ' A' ' 20' ' ' GLN . 82.5 t -105.13 129.94 57.07 Favored 'Isoleucine or valine' 0 C--O 1.234 0.288 0 C-N-CA 120.507 -0.477 . . . . 56.06 110.296 179.459 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 20' ' ' GLN . . . . . 0.621 ' HG2' ' HB2' ' A' ' 51' ' ' ASP . 16.8 mt-30 -143.36 138.67 29.6 Favored 'General case' 0 CA--C 1.512 -0.507 0 N-CA-C 112.465 0.543 . . . . 64.61 112.465 -179.754 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 51.0 tp -103.97 121.29 42.84 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 106.705 -1.591 . . . . 44.98 106.705 179.013 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 64.6 t -107.84 121.3 60.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 121.171 0.51 . . . . 30.09 111.62 179.787 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ASP . . . . . 0.436 ' HA ' HD23 ' A' ' 75' ' ' LEU . 16.4 t0 -95.52 112.82 24.46 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.454 -0.794 . . . . 28.58 110.589 179.692 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -92.64 111.18 22.68 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 105.732 -1.951 . . . . 32.82 105.732 177.995 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 8.1 p-90 -134.13 -175.47 3.87 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 121.395 0.617 . . . . 42.0 111.738 -177.835 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -162.76 150.03 13.34 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 106.724 -1.584 . . . . 30.5 106.724 179.927 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 42.4 p -59.41 -32.14 69.91 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 114.823 1.416 . . . . 37.31 114.823 -179.282 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' TRP . . . . . 0.419 ' CH2' HD11 ' A' ' 72' ' ' ILE . 38.4 p-90 -82.59 -0.89 49.0 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 113.94 1.089 . . . . 41.27 113.94 -179.831 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 42.0 t -85.24 110.91 19.38 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 113.807 1.04 . . . . 39.19 113.807 -178.41 178.038 -146.286 74.33 101.402 2.036 103.776 80.836 -59.953 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -66.72 -50.47 48.0 Favored Glycine 0 CA--C 1.522 0.503 0 C-N-CA 120.803 -0.713 . . . . 38.08 114.569 179.744 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_exo -61.3 -26.1 81.33 Favored 'Trans proline' 0 C--N 1.343 0.238 0 C-N-CA 121.39 1.393 . . . . 35.89 112.502 179.874 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 83.3 m -69.07 -38.17 78.89 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 109.551 -0.537 . . . . 35.03 109.551 179.303 -59.953 80.836 74.33 103.776 2.036 101.402 -146.286 178.038 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . . . -64.49 -32.23 73.78 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.04 -0.726 . . . . 40.16 109.04 179.44 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 2.0 tpt -72.34 -40.12 67.62 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.849 -0.614 . . . . 73.36 112.602 -179.473 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ILE . . . . . 0.626 HG22 ' CD1' ' A' ' 90' ' ' PHE . 22.3 pt -81.76 -15.32 12.27 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.212 0 N-CA-C 113.616 0.969 . . . . 55.33 113.616 -179.602 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -48.43 -54.78 23.04 Favored Pre-proline 0 CA--C 1.534 0.342 0 N-CA-C 114.013 1.116 . . . . 37.81 114.013 -178.994 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -61.79 -32.56 86.03 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 120.984 1.123 . . . . 47.38 112.548 179.845 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 84.6 t -66.54 -35.1 74.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.548 -0.296 . . . . 41.89 110.848 179.696 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 91.8 mt -72.42 -38.05 68.48 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-N 116.539 -0.3 . . . . 41.55 110.52 179.733 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -60.52 -38.22 83.69 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.503 -0.317 . . . . 74.21 110.557 179.41 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . . . -71.71 -47.64 52.62 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.078 -0.712 . . . . 53.34 109.078 179.315 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 45.7 tp -55.71 -41.11 73.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.846 -0.615 . . . . 55.36 110.296 179.71 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ALA . . . . . 0.418 ' CA ' HD12 ' A' ' 52' ' ' ILE . . . -55.43 -46.91 76.68 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.971 -0.559 . . . . 59.5 110.041 179.84 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -63.04 -42.3 99.72 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.181 -0.463 . . . . 60.38 111.297 179.82 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 66.8 m-20 -64.22 -16.14 61.41 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 113.176 0.806 . . . . 75.68 113.176 -179.909 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 32.9 m-85 -122.89 18.96 10.17 Favored 'General case' 0 CA--C 1.515 -0.378 0 N-CA-C 116.027 1.862 . . . . 60.39 116.027 -179.756 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . . . -52.97 128.89 28.75 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 107.064 -1.458 . . . . 66.12 107.064 178.61 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 84.92 -11.18 60.61 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.066 -1.064 . . . . 65.5 113.778 179.726 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . . . -106.42 -50.06 3.22 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.997 -0.371 . . . . 60.79 109.997 179.244 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -141.9 153.69 44.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.16 0.505 . . . . 55.36 110.769 179.924 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' ASP . . . . . 0.621 ' HB2' ' HG2' ' A' ' 20' ' ' GLN . 25.1 m-20 -102.99 141.06 36.44 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 107.853 -1.166 . . . . 73.4 107.853 178.769 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ILE . . . . . 0.418 HD12 ' CA ' ' A' ' 43' ' ' ALA . 56.3 mt -116.15 121.61 67.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 N-CA-C 106.145 -1.798 . . . . 51.03 106.145 177.79 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 53' ' ' LEU . . . . . 0.588 HD22 HG13 ' A' ' 4' ' ' VAL . 13.8 mt -115.91 155.63 27.62 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 115.941 -0.572 . . . . 38.04 109.758 -178.713 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 54' ' ' LYS . . . . . 0.423 ' HE2' ' O ' ' A' ' 110' ' ' HOH . 24.6 mttm -121.43 134.1 55.08 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 108.439 -0.949 . . . . 65.0 108.439 178.118 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.7 tt -132.38 110.1 10.32 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.983 0.421 . . . . 39.51 110.539 178.626 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -68.62 114.63 7.18 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 107.538 -1.282 . . . . 46.69 107.538 179.218 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 14.2 m -66.86 -24.12 32.08 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 N-CA-C 115.096 1.517 . . . . 32.63 115.096 -178.12 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 -70.09 -43.0 72.0 Favored 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 120.085 -0.646 . . . . 41.36 111.874 178.817 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . . . -86.07 -7.38 58.65 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 113.423 0.898 . . . . 43.46 113.423 -179.535 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 63.5 m-80 -139.0 60.36 17.68 Favored Pre-proline 0 N--CA 1.466 0.373 0 N-CA-C 112.413 0.523 . . . . 38.13 112.413 -179.139 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -60.94 -31.96 92.01 Favored 'Trans proline' 0 CA--C 1.533 0.436 0 C-N-CA 122.188 1.925 . . . . 47.13 115.603 -179.767 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 73.0 m -56.98 -53.95 52.23 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.916 0.71 . . . . 58.55 112.916 -179.244 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 87.7 m -63.52 -35.72 81.42 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 120.193 -0.603 . . . . 39.62 111.043 -179.713 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -65.52 -38.4 89.55 Favored 'General case' 0 C--O 1.241 0.635 0 C-N-CA 120.431 -0.508 . . . . 34.71 110.172 179.609 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -69.45 -45.03 70.02 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-N 115.624 -0.716 . . . . 36.73 109.502 -179.559 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -54.02 -42.27 68.95 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 113.924 1.083 . . . . 58.7 113.924 -179.327 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -99.15 24.8 7.45 Favored 'General case' 0 CA--C 1.514 -0.428 0 N-CA-C 114.271 1.211 . . . . 41.72 114.271 -179.361 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 67.1 mm-40 50.54 39.81 22.02 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 115.068 1.507 . . . . 77.85 115.068 177.325 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 84.7 t -78.75 104.71 6.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 N-CA-C 107.913 -1.143 . . . . 48.13 107.913 178.715 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 85.3 mmm -94.11 -53.26 4.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.33 -0.396 . . . . 83.22 112.048 -179.087 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . . . -111.38 153.77 25.57 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 116.115 -0.493 . . . . 48.71 109.909 -179.902 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' ILE . . . . . 0.419 HD11 ' CH2' ' A' ' 28' ' ' TRP . 33.7 pt -133.79 153.91 80.23 Favored Pre-proline 0 N--CA 1.449 -0.477 0 N-CA-C 107.962 -1.125 . . . . 40.94 107.962 178.678 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 73' ' ' PRO . . . . . 0.455 ' HB3' ' O ' ' A' ' 125' ' ' HOH . 42.3 Cg_endo -67.26 142.79 64.18 Favored 'Cis proline' 0 CA--C 1.534 0.502 0 N-CA-C 117.412 2.043 . . . . 38.03 117.412 0.595 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 12.7 m -133.16 136.43 45.73 Favored 'General case' 0 CA--C 1.506 -0.732 0 N-CA-C 103.255 -2.869 . . . . 33.05 103.255 175.429 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' LEU . . . . . 0.436 HD23 ' HA ' ' A' ' 23' ' ' ASP . 37.1 mt -124.52 129.24 50.24 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 106.007 -1.849 . . . . 49.88 106.007 179.616 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 46.3 mt -120.92 132.15 71.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 C-N-CA 120.063 -0.655 . . . . 33.36 109.938 178.917 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 98.8 t -93.29 121.95 44.38 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.402 0 N-CA-C 108.194 -1.039 . . . . 32.9 108.194 178.987 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 55.0 m-85 -103.35 142.14 34.73 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.1 0.476 . . . . 39.98 109.758 178.353 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . . . -130.77 109.97 10.99 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 105.128 -2.175 . . . . 53.03 105.128 -179.335 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' ASP . . . . . 0.551 ' HA ' ' O ' ' A' ' 17' ' ' SER . 68.5 m-20 47.97 55.55 8.47 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.559 0.577 . . . . 61.39 112.559 -178.761 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 76.53 -2.94 56.6 Favored Glycine 0 N--CA 1.447 -0.617 0 N-CA-C 117.098 1.599 . . . . 41.25 117.098 178.813 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 96.5 mm-40 -116.84 135.55 23.02 Favored Pre-proline 0 N--CA 1.466 0.328 0 CA-C-N 118.244 1.022 . . . . 46.2 113.569 -179.544 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -71.06 126.22 12.24 Favored 'Trans proline' 0 CA--C 1.54 0.821 0 N-CA-C 108.737 -1.294 . . . . 37.33 108.737 179.374 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 33.6 m -117.72 -17.37 7.47 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 N-CA-C 113.847 1.055 . . . . 50.4 113.847 -178.805 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -152.36 158.15 42.3 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 112.116 0.413 . . . . 47.16 112.116 179.212 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . . . -142.55 135.26 28.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.101 -0.5 . . . . 65.89 110.94 -178.995 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' VAL . . . . . 0.588 HG11 ' HG3' ' A' ' 91' ' ' GLN . 63.3 t -129.12 132.75 66.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 N-CA-C 107.266 -1.383 . . . . 46.12 107.266 179.385 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 58.4 t -117.63 147.59 20.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 N-CA-C 113.244 0.831 . . . . 58.19 113.244 -179.085 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 73.28 176.44 31.88 Favored Glycine 0 C--N 1.333 0.375 0 N-CA-C 114.751 0.66 . . . . 38.81 114.751 179.498 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' PHE . . . . . 0.626 ' CD1' HG22 ' A' ' 35' ' ' ILE . 91.7 t80 -58.38 140.45 53.63 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-O 120.814 0.34 . . . . 42.57 111.486 179.637 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 91' ' ' GLN . . . . . 0.588 ' HG3' HG11 ' A' ' 87' ' ' VAL . 98.2 mm-40 -144.41 141.25 17.68 Favored Pre-proline 0 C--N 1.327 -0.392 0 N-CA-C 109.957 -0.386 . . . . 60.54 109.957 179.095 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 92' ' ' PRO . . . . . 0.549 ' HD2' ' OD1' ' A' ' 95' ' ' ASN . 43.0 Cg_exo -72.34 153.68 56.01 Favored 'Trans proline' 0 CA--C 1.536 0.596 0 C-N-CA 123.633 2.889 . . . . 48.85 108.269 179.371 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . . . -52.85 -38.49 61.54 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.197 0.443 . . . . 51.97 112.197 -179.929 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . . . -57.77 -42.47 84.14 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 111.958 0.355 . . . . 57.46 111.958 -179.635 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' ASN . . . . . 0.549 ' OD1' ' HD2' ' A' ' 92' ' ' PRO . 28.1 m120 -71.08 -31.98 68.52 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 113.457 0.91 . . . . 76.99 113.457 179.998 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 88.6 mt -75.67 -41.23 54.49 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.089 -0.644 . . . . 50.59 110.427 179.924 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -61.01 -40.19 92.6 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.181 -0.674 . . . . 56.91 109.181 179.708 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . . . -58.53 -51.12 71.24 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 120.004 -0.679 . . . . 62.51 109.88 179.282 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 86.8 t -55.71 -36.7 43.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 N-CA-C 112.491 0.552 . . . . 52.85 112.491 -179.597 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 30.1 mt -71.21 -47.68 55.96 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 120.07 -0.652 . . . . 55.09 111.109 179.486 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 64.1 m-20 -55.61 -31.45 62.26 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.892 0.377 . . . . 73.43 111.247 -179.1 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . . . -67.21 -8.16 29.34 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.108 -0.496 . . . . 62.59 112.053 -179.763 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 98.5 m-70 -127.44 2.56 6.27 Favored 'General case' 0 CA--C 1.515 -0.372 0 N-CA-C 114.088 1.144 . . . . 54.75 114.088 -178.37 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' LEU . . . . . 0.422 HD23 HG21 ' A' ' 19' ' ' VAL . 78.2 mt . . . . . 0 C--O 1.255 1.356 0 CA-C-O 117.955 -1.021 . . . . 77.06 109.935 178.624 . . . . . . . . 1 1 . 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 . . . . . 0.423 ' O ' ' HE2' ' A' ' 54' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 . . . . . 0.491 ' O ' HD11 ' A' ' 35' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.285 0 CA-C-O 121.217 0.532 . . . . 73.200000000000003 111.63 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 62.3 mt -102.02 115.81 44.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.917 -0.583 . . . . 70.620000000000005 111.053 -179.783 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.588 HG13 HD22 ' A' ' 53' ' ' LEU . 3.0 p -80.27 139.61 17.94 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.329 0 CA-C-O 121.189 0.518 . . . . 52.990000000000002 110.996 179.351 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . . . -82.6 149.54 27.38 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 107.77 -1.196 . . . . 45.280000000000001 107.77 178.93 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 11.5 p -135.21 152.91 33.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 106.154 -1.795 . . . . 44.729999999999997 106.154 178.767 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 73.1 p -134.07 176.03 8.95 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-O 120.52 0.2 . . . . 38.130000000000003 110.82 -178.747 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 77.4 m-20 -59.62 -32.32 70.31 Favored 'General case' 0 C--O 1.233 0.233 0 C-N-CA 119.765 -0.774 . . . . 41.090000000000003 110.401 178.456 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.57 -32.6 74.04 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 116.097 1.888 . . . . 37.890000000000001 116.097 -177.678 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 20.3 p-10 -125.91 13.21 7.9 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 115.203 1.557 . . . . 43.060000000000002 115.203 -177.641 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 40.9 t80 -56.4 -53.2 60.16 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 112.498 0.555 . . . . 45.530000000000001 112.498 -178.897 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . . . -58.1 -28.27 64.45 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 114.72 1.378 . . . . 49.590000000000003 114.72 -178.762 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 72.2 p -85.42 -32.63 22.23 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 119.648 -0.821 . . . . 56.740000000000002 111.175 179.532 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.402 ' O ' ' NE2' ' A' ' 20' ' ' GLN . . . -78.3 -30.99 48.68 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 113.534 0.939 . . . . 58.450000000000003 113.534 178.71 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 61.3 t -111.42 82.76 0.64 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 N-CA-C 116.965 2.209 . . . . 49.460000000000001 116.965 -178.231 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . . . -143.1 -31.01 0.5 Allowed 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 114.487 1.291 . . . . 57.689999999999998 114.487 -179.678 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' SER . . . . . 0.551 ' O ' ' HA ' ' A' ' 80' ' ' ASP . 50.8 m -135.53 133.05 38.01 Favored 'General case' 0 N--CA 1.464 0.248 0 N-CA-C 117.447 2.388 . . . . 74.909999999999997 117.447 -178.259 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 91.06 -164.52 29.86 Favored Glycine 0 C--N 1.331 0.305 0 CA-C-N 115.564 -0.744 . . . . 55.509999999999998 112.689 -179.62 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.554 ' C ' ' HG3' ' A' ' 20' ' ' GLN . 82.5 t -105.13 129.94 57.07 Favored 'Isoleucine or valine' 0 C--O 1.234 0.288 0 C-N-CA 120.507 -0.477 . . . . 56.060000000000002 110.296 179.459 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.621 ' HG2' ' HB2' ' A' ' 51' ' ' ASP . 16.8 mt-30 -143.36 138.67 29.6 Favored 'General case' 0 CA--C 1.512 -0.507 0 N-CA-C 112.465 0.543 . . . . 64.609999999999999 112.465 -179.754 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 51.0 tp -103.97 121.29 42.84 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 106.705 -1.591 . . . . 44.979999999999997 106.705 179.013 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 64.6 t -107.84 121.3 60.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 121.171 0.51 . . . . 30.09 111.62 179.787 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.436 ' HA ' HD23 ' A' ' 75' ' ' LEU . 16.4 t0 -95.52 112.82 24.46 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.454 -0.794 . . . . 28.579999999999998 110.589 179.692 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -92.64 111.18 22.68 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 105.732 -1.951 . . . . 32.82 105.732 177.995 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 8.1 p-90 -134.13 -175.47 3.87 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 121.395 0.617 . . . . 42.0 111.738 -177.835 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -162.76 150.03 13.34 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 106.724 -1.584 . . . . 30.5 106.724 179.927 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 42.4 p -59.41 -32.14 69.91 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 114.823 1.416 . . . . 37.310000000000002 114.823 -179.282 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' TRP . . . . . 0.419 ' CH2' HD11 ' A' ' 72' ' ' ILE . 38.4 p-90 -82.59 -0.89 49.0 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 113.94 1.089 . . . . 41.270000000000003 113.94 -179.831 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 42.0 t -85.24 110.91 19.38 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 113.807 1.04 . . . . 39.189999999999998 113.807 -178.41 178.038 -146.286 74.33 101.402 2.036 103.776 80.836 -59.953 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -66.72 -50.47 48.0 Favored Glycine 0 CA--C 1.522 0.503 0 C-N-CA 120.803 -0.713 . . . . 38.079999999999998 114.569 179.744 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_exo -61.3 -26.1 81.33 Favored 'Trans proline' 0 C--N 1.343 0.238 0 C-N-CA 121.39 1.393 . . . . 35.890000000000001 112.502 179.874 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 83.3 m -69.07 -38.17 78.89 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 109.551 -0.537 . . . . 35.030000000000001 109.551 179.303 -59.953 80.836 74.33 103.776 2.036 101.402 -146.286 178.038 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . . . -64.49 -32.23 73.78 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.04 -0.726 . . . . 40.159999999999997 109.04 179.44 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 2.0 tpt -72.34 -40.12 67.62 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.849 -0.614 . . . . 73.359999999999999 112.602 -179.473 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.626 HG22 ' CD1' ' A' ' 90' ' ' PHE . 22.3 pt -81.76 -15.32 12.27 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.212 0 N-CA-C 113.616 0.969 . . . . 55.329999999999998 113.616 -179.602 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -48.43 -54.78 23.04 Favored Pre-proline 0 CA--C 1.534 0.342 0 N-CA-C 114.013 1.116 . . . . 37.810000000000002 114.013 -178.994 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -61.79 -32.56 86.03 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 120.984 1.123 . . . . 47.380000000000003 112.548 179.845 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 84.6 t -66.54 -35.1 74.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.548 -0.296 . . . . 41.890000000000001 110.848 179.696 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 91.8 mt -72.42 -38.05 68.48 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-N 116.539 -0.3 . . . . 41.549999999999997 110.52 179.733 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 98.4 mt-10 -60.52 -38.22 83.69 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.503 -0.317 . . . . 74.209999999999994 110.557 179.41 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . . . -71.71 -47.64 52.62 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.078 -0.712 . . . . 53.340000000000003 109.078 179.315 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 45.7 tp -55.71 -41.11 73.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.846 -0.615 . . . . 55.359999999999999 110.296 179.71 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.418 ' CA ' HD12 ' A' ' 52' ' ' ILE . . . -55.43 -46.91 76.68 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.971 -0.559 . . . . 59.5 110.041 179.84 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -63.04 -42.3 99.72 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.181 -0.463 . . . . 60.380000000000003 111.297 179.82 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 66.8 m-20 -64.22 -16.14 61.41 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 113.176 0.806 . . . . 75.680000000000007 113.176 -179.909 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 32.9 m-85 -122.89 18.96 10.17 Favored 'General case' 0 CA--C 1.515 -0.378 0 N-CA-C 116.027 1.862 . . . . 60.390000000000001 116.027 -179.756 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . . . -52.97 128.89 28.75 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 107.064 -1.458 . . . . 66.120000000000005 107.064 178.61 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 84.92 -11.18 60.61 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.066 -1.064 . . . . 65.5 113.778 179.726 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . . . -106.42 -50.06 3.22 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.997 -0.371 . . . . 60.789999999999999 109.997 179.244 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -141.9 153.69 44.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.16 0.505 . . . . 55.359999999999999 110.769 179.924 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.621 ' HB2' ' HG2' ' A' ' 20' ' ' GLN . 25.1 m-20 -102.99 141.06 36.44 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 107.853 -1.166 . . . . 73.400000000000006 107.853 178.769 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.418 HD12 ' CA ' ' A' ' 43' ' ' ALA . 56.3 mt -116.15 121.61 67.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 N-CA-C 106.145 -1.798 . . . . 51.030000000000001 106.145 177.79 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.588 HD22 HG13 ' A' ' 4' ' ' VAL . 13.8 mt -115.91 155.63 27.62 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 115.941 -0.572 . . . . 38.039999999999999 109.758 -178.713 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.423 ' HE2' ' O ' ' A' ' 110' ' ' HOH . 24.6 mttm -121.43 134.1 55.08 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 108.439 -0.949 . . . . 65.0 108.439 178.118 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.7 tt -132.38 110.1 10.32 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.983 0.421 . . . . 39.509999999999998 110.539 178.626 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -68.62 114.63 7.18 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 107.538 -1.282 . . . . 46.689999999999998 107.538 179.218 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 14.2 m -66.86 -24.12 32.08 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 N-CA-C 115.096 1.517 . . . . 32.630000000000003 115.096 -178.12 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 -70.09 -43.0 72.0 Favored 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 120.085 -0.646 . . . . 41.359999999999999 111.874 178.817 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . . . -86.07 -7.38 58.65 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 113.423 0.898 . . . . 43.460000000000001 113.423 -179.535 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 63.5 m-80 -139.0 60.36 17.68 Favored Pre-proline 0 N--CA 1.466 0.373 0 N-CA-C 112.413 0.523 . . . . 38.130000000000003 112.413 -179.139 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -60.94 -31.96 92.01 Favored 'Trans proline' 0 CA--C 1.533 0.436 0 C-N-CA 122.188 1.925 . . . . 47.130000000000003 115.603 -179.767 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 73.0 m -56.98 -53.95 52.23 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.916 0.71 . . . . 58.549999999999997 112.916 -179.244 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 87.7 m -63.52 -35.72 81.42 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 120.193 -0.603 . . . . 39.619999999999997 111.043 -179.713 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -65.52 -38.4 89.55 Favored 'General case' 0 C--O 1.241 0.635 0 C-N-CA 120.431 -0.508 . . . . 34.710000000000001 110.172 179.609 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -69.45 -45.03 70.02 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-N 115.624 -0.716 . . . . 36.729999999999997 109.502 -179.559 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -54.02 -42.27 68.95 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 113.924 1.083 . . . . 58.700000000000003 113.924 -179.327 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -99.15 24.8 7.45 Favored 'General case' 0 CA--C 1.514 -0.428 0 N-CA-C 114.271 1.211 . . . . 41.719999999999999 114.271 -179.361 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 67.1 mm-40 50.54 39.81 22.02 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 115.068 1.507 . . . . 77.849999999999994 115.068 177.325 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 84.7 t -78.75 104.71 6.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 N-CA-C 107.913 -1.143 . . . . 48.130000000000003 107.913 178.715 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 85.3 mmm -94.11 -53.26 4.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.33 -0.396 . . . . 83.219999999999999 112.048 -179.087 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . . . -111.38 153.77 25.57 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 116.115 -0.493 . . . . 48.710000000000001 109.909 -179.902 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.419 HD11 ' CH2' ' A' ' 28' ' ' TRP . 33.7 pt -133.79 153.91 80.23 Favored Pre-proline 0 N--CA 1.449 -0.477 0 N-CA-C 107.962 -1.125 . . . . 40.939999999999998 107.962 178.678 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.455 ' HB3' ' O ' ' A' ' 125' ' ' HOH . 42.3 Cg_endo -67.26 142.79 64.18 Favored 'Cis proline' 0 CA--C 1.534 0.502 0 N-CA-C 117.412 2.043 . . . . 38.030000000000001 117.412 0.595 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 12.7 m -133.16 136.43 45.73 Favored 'General case' 0 CA--C 1.506 -0.732 0 N-CA-C 103.255 -2.869 . . . . 33.049999999999997 103.255 175.429 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.436 HD23 ' HA ' ' A' ' 23' ' ' ASP . 37.1 mt -124.52 129.24 50.24 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 106.007 -1.849 . . . . 49.880000000000003 106.007 179.616 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 46.3 mt -120.92 132.15 71.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 C-N-CA 120.063 -0.655 . . . . 33.359999999999999 109.938 178.917 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 98.8 t -93.29 121.95 44.38 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.402 0 N-CA-C 108.194 -1.039 . . . . 32.899999999999999 108.194 178.987 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 55.0 m-85 -103.35 142.14 34.73 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.1 0.476 . . . . 39.979999999999997 109.758 178.353 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . . . -130.77 109.97 10.99 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 105.128 -2.175 . . . . 53.030000000000001 105.128 -179.335 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' ASP . . . . . 0.551 ' HA ' ' O ' ' A' ' 17' ' ' SER . 68.5 m-20 47.97 55.55 8.47 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.559 0.577 . . . . 61.390000000000001 112.559 -178.761 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 76.53 -2.94 56.6 Favored Glycine 0 N--CA 1.447 -0.617 0 N-CA-C 117.098 1.599 . . . . 41.25 117.098 178.813 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 96.5 mm-40 -116.84 135.55 23.02 Favored Pre-proline 0 N--CA 1.466 0.328 0 CA-C-N 118.244 1.022 . . . . 46.200000000000003 113.569 -179.544 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -71.06 126.22 12.24 Favored 'Trans proline' 0 CA--C 1.54 0.821 0 N-CA-C 108.737 -1.294 . . . . 37.329999999999998 108.737 179.374 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 33.6 m -117.72 -17.37 7.47 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 N-CA-C 113.847 1.055 . . . . 50.399999999999999 113.847 -178.805 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -152.36 158.15 42.3 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 112.116 0.413 . . . . 47.159999999999997 112.116 179.212 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . . . -142.55 135.26 28.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.101 -0.5 . . . . 65.890000000000001 110.94 -178.995 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.588 HG11 ' HG3' ' A' ' 91' ' ' GLN . 63.3 t -129.12 132.75 66.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 N-CA-C 107.266 -1.383 . . . . 46.119999999999997 107.266 179.385 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 58.4 t -117.63 147.59 20.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 N-CA-C 113.244 0.831 . . . . 58.189999999999998 113.244 -179.085 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 73.28 176.44 31.88 Favored Glycine 0 C--N 1.333 0.375 0 N-CA-C 114.751 0.66 . . . . 38.810000000000002 114.751 179.498 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' PHE . . . . . 0.626 ' CD1' HG22 ' A' ' 35' ' ' ILE . 91.7 t80 -58.38 140.45 53.63 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-O 120.814 0.34 . . . . 42.57 111.486 179.637 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' GLN . . . . . 0.588 ' HG3' HG11 ' A' ' 87' ' ' VAL . 98.2 mm-40 -144.41 141.25 17.68 Favored Pre-proline 0 C--N 1.327 -0.392 0 N-CA-C 109.957 -0.386 . . . . 60.539999999999999 109.957 179.095 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' PRO . . . . . 0.981 ' HD2' HD22 ' A' ' 95' ' ' ASN . 43.0 Cg_exo -72.34 153.68 56.01 Favored 'Trans proline' 0 CA--C 1.536 0.596 0 C-N-CA 123.633 2.889 . . . . 48.850000000000001 108.269 179.371 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . . . -52.85 -38.49 61.54 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.197 0.443 . . . . 51.969999999999999 112.197 -179.929 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . . . -57.77 -42.47 84.14 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 111.958 0.355 . . . . 57.460000000000001 111.958 -179.635 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' ASN . . . . . 0.981 HD22 ' HD2' ' A' ' 92' ' ' PRO . 69.3 m-80 -71.08 -31.98 68.52 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 113.457 0.91 . . . . 76.989999999999995 113.457 179.998 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 88.6 mt -75.67 -41.23 54.49 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.089 -0.644 . . . . 50.590000000000003 110.427 179.924 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -61.01 -40.19 92.6 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.181 -0.674 . . . . 56.909999999999997 109.181 179.708 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . . . -58.53 -51.12 71.24 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 120.004 -0.679 . . . . 62.509999999999998 109.88 179.282 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 86.8 t -55.71 -36.7 43.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 N-CA-C 112.491 0.552 . . . . 52.850000000000001 112.491 -179.597 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 30.1 mt -71.21 -47.68 55.96 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 120.07 -0.652 . . . . 55.090000000000003 111.109 179.486 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 64.1 m-20 -55.61 -31.45 62.26 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.892 0.377 . . . . 73.430000000000007 111.247 -179.1 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . . . -67.21 -8.16 29.34 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.108 -0.496 . . . . 62.590000000000003 112.053 -179.763 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 98.5 m-70 -127.44 2.56 6.27 Favored 'General case' 0 CA--C 1.515 -0.372 0 N-CA-C 114.088 1.144 . . . . 54.75 114.088 -178.37 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.422 HD23 HG21 ' A' ' 19' ' ' VAL . 78.2 mt . . . . . 0 C--O 1.255 1.356 0 CA-C-O 117.955 -1.021 . . . . 77.060000000000002 109.935 178.624 . . . . . . . . 1 1 . 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 . . . . . 0.423 ' O ' ' HE2' ' A' ' 54' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 . . . . . 0.491 ' O ' HD11 ' A' ' 35' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_