data_3dow_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 3dow _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 ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.356 0 N-CA-C 112.755 -0.138 . . . . 75.56 112.755 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.1 m -110.15 143.59 40.01 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.992 0.425 . . . . 75.08 111.879 179.773 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -49.45 105.14 0.08 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.706 -0.679 . . . . 67.05 111.935 -171.812 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . . . -113.77 118.65 34.89 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.215 -0.448 . . . . 63.1 109.829 177.902 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 41.0 m-85 -110.78 143.54 41.14 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.637 0.606 . . . . 58.09 112.637 -178.114 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 73.2 t -78.16 -27.0 14.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.448 -0.796 . . . . 59.31 110.295 178.279 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 74.3 t80 -69.51 -29.93 67.67 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.882 -0.327 . . . . 50.58 110.68 -178.972 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 61.4 mttt -74.15 -25.68 59.88 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.497 -0.32 . . . . 54.33 111.391 177.426 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -90.15 -15.03 32.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.145 -0.479 . . . . 70.71 111.624 -178.63 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 53.4 mt-10 -93.76 -21.46 19.3 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 111.704 0.261 . . . . 69.59 111.704 -178.55 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 47.0 m80 -136.49 131.42 18.4 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.449 -0.342 . . . . 64.87 110.262 -178.067 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 22.5 Cg_exo -69.74 172.6 12.32 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.262 1.975 . . . . 55.42 113.427 -177.245 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 70.0 t80 -76.85 -36.86 56.53 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 113.166 0.802 . . . . 56.04 113.166 -171.067 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -54.86 -47.04 74.7 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 108.304 -0.998 . . . . 66.64 108.304 173.23 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . . . -66.01 -43.64 87.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.591 -0.731 . . . . 49.89 112.065 -172.864 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 63.0 mtm-85 -70.29 -49.42 49.87 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.912 -0.315 . . . . 51.88 110.839 -176.471 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 11.1 ttm-85 -59.35 -28.43 66.83 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-O 120.545 0.212 . . . . 50.13 111.557 -179.198 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 74.2 m -79.0 -36.76 40.72 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.451 -0.341 . . . . 54.17 110.645 -179.925 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 61.8 tt0 -71.11 -33.63 70.31 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.932 0.396 . . . . 53.44 110.665 176.609 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -73.17 -40.4 50.21 Favored Glycine 0 N--CA 1.449 -0.48 0 N-CA-C 111.157 -0.777 . . . . 38.23 111.157 -178.152 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -62.9 -40.74 98.5 Favored 'General case' 0 CA--C 1.516 -0.349 0 N-CA-C 108.56 -0.904 . . . . 50.52 108.56 179.802 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . . . -69.97 -43.06 72.28 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.084 -0.507 . . . . 42.93 112.206 -178.804 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 1.9 tp -73.37 -24.36 20.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.939 0.4 . . . . 41.72 109.951 -174.994 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 21.3 mmm180 -77.62 -34.36 53.34 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.918 -0.771 . . . . 40.79 108.918 172.95 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 64.5 mttt -78.28 -10.04 59.49 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.043 -0.526 . . . . 52.53 110.762 -178.147 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 80.7 tttt -108.01 -44.23 4.23 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 111.93 0.344 . . . . 65.52 111.93 -176.152 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 70.0 m-85 -121.14 67.83 17.2 Favored Pre-proline 0 C--N 1.328 -0.354 0 N-CA-C 109.566 -0.531 . . . . 58.7 109.566 -179.723 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 15.8 Cg_endo -55.12 -36.89 94.08 Favored 'Trans proline' 0 CA--C 1.532 0.408 0 C-N-CA 124.631 3.554 . . . . 48.52 114.753 -175.619 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 23.7 p-10 -74.29 -10.29 59.44 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 113.046 0.758 . . . . 67.34 113.046 -177.51 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 12.3 mmt180 -111.04 154.11 24.66 Favored 'General case' 0 N--CA 1.463 0.199 0 C-N-CA 122.597 0.359 . . . . 66.09 110.606 177.409 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 17.6 m -113.53 133.32 22.2 Favored Pre-proline 0 C--N 1.33 -0.278 0 N-CA-C 109.852 -0.425 . . . . 41.7 109.852 172.893 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -75.31 127.06 10.19 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 121.563 1.509 . . . . 35.35 111.359 -179.901 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 58.3 t -127.91 127.41 68.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 O-C-N 123.553 0.533 . . . . 35.29 111.307 -175.874 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 19.5 mm -97.92 122.81 49.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 N-CA-C 108.796 -0.816 . . . . 34.13 108.796 172.718 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 53.5 t -121.98 118.44 55.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.66 0.266 . . . . 34.38 111.131 -175.613 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 75.6 mt-10 -132.93 151.19 52.09 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.115 -0.493 . . . . 53.08 112.105 -178.974 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 33.6 ttpt -72.59 128.98 37.19 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.879 -0.6 . . . . 40.08 110.046 178.031 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -64.05 155.79 77.04 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 115.978 -0.555 . . . . 40.71 110.067 179.141 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_exo -59.04 144.8 99.21 Favored 'Trans proline' 0 C--O 1.233 0.229 0 C-N-CA 120.636 0.891 . . . . 43.56 111.513 177.284 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . . . 69.6 3.31 4.16 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 114.066 1.135 . . . . 47.37 114.066 177.271 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -72.18 124.1 24.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.191 0.52 . . . . 37.22 111.311 -178.858 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 21.7 mmm180 -94.94 91.47 6.42 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 108.222 -1.029 . . . . 53.89 108.222 177.34 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 20.7 tt -171.45 164.23 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 120.944 0.402 . . . . 40.75 111.614 -169.636 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -62.85 176.04 7.38 Favored Glycine 0 N--CA 1.45 -0.403 0 CA-C-N 116.239 -0.437 . . . . 39.39 113.368 -177.075 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -112.69 155.81 23.85 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.104 0.478 . . . . 48.58 112.233 -175.698 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 22.0 mt -101.05 134.76 43.57 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.414 -0.812 . . . . 49.23 109.146 171.671 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . . . -64.96 -56.45 13.17 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.067 -0.716 . . . . 54.2 109.067 176.254 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . . . -102.11 151.23 22.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.07 -0.513 . . . . 43.99 110.888 -179.387 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -104.27 -15.48 15.46 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.929 -0.578 . . . . 67.45 110.773 177.871 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -103.74 122.15 44.48 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.256 -0.429 . . . . 60.1 111.893 -172.079 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 90.6 m-85 -137.47 125.28 22.51 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 112.51 0.559 . . . . 44.36 112.51 -178.247 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -89.9 108.34 19.65 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.277 -0.638 . . . . 49.66 109.277 168.64 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 3.1 m -113.44 134.6 21.92 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 120.533 0.206 . . . . 51.28 111.349 -176.97 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_endo -55.47 145.36 68.95 Favored 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 121.058 1.172 . . . . 53.63 112.61 -178.213 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 21.2 m -66.23 -23.51 66.43 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.614 -0.721 . . . . 57.88 112.829 -176.135 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -86.91 -15.84 37.73 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 114.107 1.151 . . . . 64.81 114.107 -172.458 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 16.1 mt -64.01 138.06 58.29 Favored 'General case' 0 CA--C 1.518 -0.284 0 C-N-CA 121.47 -0.092 . . . . 60.34 111.16 177.295 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 69.9 p -82.45 170.72 14.95 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.188 -0.671 . . . . 56.97 109.188 174.47 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 54.3 t -66.26 -40.72 87.6 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 N-CA-C 108.871 -0.789 . . . . 51.65 108.871 178.1 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -51.91 -46.16 55.39 Favored Glycine 0 N--CA 1.45 -0.383 0 N-CA-C 111.45 -0.66 . . . . 53.94 111.45 177.105 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -69.35 -26.93 64.92 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.68 0.276 . . . . 53.0 110.507 -178.052 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' PHE . . . . . 0.43 ' C ' ' N ' ' A' ' 64' ' ' PHE . 32.6 t80 -76.73 -43.8 35.88 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 116.236 -0.438 . . . . 49.22 111.18 179.961 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -48.03 -21.37 0.44 Allowed 'General case' 0 CA--C 1.513 -0.454 0 CA-C-O 121.826 0.822 . . . . 52.23 109.824 174.85 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' PHE . . . . . 0.43 ' N ' ' C ' ' A' ' 62' ' ' PHE . 51.6 t80 -100.07 -38.35 8.59 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 114.162 -1.381 . . . . 72.3 111.454 -165.158 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 18.5 mt -72.81 -23.89 60.84 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.354 -0.61 . . . . 62.38 109.354 176.476 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 29.0 mm -83.88 -42.25 17.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.847 -0.615 . . . . 55.27 109.452 176.797 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 15.1 ttt85 -52.23 -32.05 34.94 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.823 -0.626 . . . . 60.61 110.152 178.109 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . . . -73.96 -39.58 63.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.151 -0.477 . . . . 57.19 111.698 178.837 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 11.0 mmt85 -66.33 -36.16 82.22 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 112.463 0.542 . . . . 61.02 112.463 -178.012 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 4.5 mt -91.66 -31.0 4.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 121.305 0.574 . . . . 47.0 109.851 -178.747 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 68.5 t60 52.26 98.45 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.289 -0.869 . . . . 42.84 112.332 -170.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 35.5 mt -75.87 137.96 40.77 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.518 -0.765 . . . . 45.32 111.089 -178.552 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 11.0 mpt_? -81.28 177.35 9.06 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.899 -0.591 . . . . 37.58 109.783 175.595 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -53.59 126.44 21.73 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.641 0.608 . . . . 46.43 112.641 -176.56 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 61.61 22.61 13.06 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 113.069 0.766 . . . . 59.06 113.069 175.413 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -79.96 144.41 33.33 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 106.067 -1.827 . . . . 39.7 106.067 160.96 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -114.91 161.62 18.02 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.022 -1.103 . . . . 41.99 108.022 172.739 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 47.6 tp -133.79 114.7 13.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.67 0.272 . . . . 38.84 111.327 179.672 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 93.2 m-85 -120.61 152.55 38.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.279 -0.419 . . . . 42.99 110.081 179.694 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 10.2 m-30 -110.18 161.4 15.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.266 -0.425 . . . . 46.71 109.857 177.871 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 94.6 m-85 -148.34 128.38 13.63 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.12 -0.491 . . . . 46.6 110.983 -179.855 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 93.2 t -135.18 108.91 10.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 N-CA-C 108.46 -0.941 . . . . 58.32 108.46 175.362 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 22.4 m120 67.23 28.83 7.94 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.252 -0.431 . . . . 65.53 111.716 -175.4 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 78.8 m-20 79.86 27.78 0.32 Allowed 'General case' 0 N--CA 1.462 0.171 0 C-N-CA 123.28 0.632 . . . . 71.09 110.802 173.7 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 16.0 t -138.18 133.77 43.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.783 -0.644 . . . . 63.18 110.578 -177.137 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 8.0 mt -71.8 119.42 74.14 Favored Pre-proline 0 C--N 1.326 -0.449 0 N-CA-C 109.308 -0.627 . . . . 56.87 109.308 175.135 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 15.8 Cg_exo -68.4 129.59 19.4 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 120.585 0.857 . . . . 55.88 111.621 179.764 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_endo -56.89 132.0 48.98 Favored 'Trans proline' 0 C--N 1.342 0.222 0 O-C-N 123.2 1.105 . . . . 65.24 110.743 175.345 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 22.0 p -63.08 -13.41 35.79 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.244 0.461 . . . . 61.77 112.244 -176.736 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 40.5 p -81.17 -29.12 34.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.616 -0.266 . . . . 62.1 111.498 -178.371 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -62.16 155.76 23.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.346 -0.388 . . . . 56.98 110.781 179.442 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 4.7 t -99.0 170.99 8.33 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 108.655 -0.868 . . . . 51.83 108.655 177.293 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 7.9 mmt -75.88 -28.11 57.99 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.758 0.313 . . . . 48.94 110.209 -177.828 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -70.5 -37.87 69.13 Favored Glycine 0 C--O 1.227 -0.337 0 CA-C-N 116.207 -0.452 . . . . 43.37 112.051 177.888 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 64.8 mt-30 -74.49 -36.52 63.26 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.337 -0.616 . . . . 60.46 109.337 178.478 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 12.9 tp -66.21 -41.02 90.73 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.58 -0.736 . . . . 49.24 109.74 178.599 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' TYR . . . . . 0.455 ' O ' ' ND1' ' A' ' 101' ' ' HIS . 57.0 t80 -65.99 -49.14 68.88 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.895 -0.409 . . . . 39.61 109.895 178.76 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 43.2 tt0 -54.41 -43.15 71.25 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.195 0.521 . . . . 55.09 110.007 179.651 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 79.2 tt0 -87.65 -19.87 27.11 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 113.298 0.851 . . . . 53.7 113.298 -169.625 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 90.9 m-70 -135.19 4.68 3.22 Favored 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 115.708 1.744 . . . . 53.88 115.708 -169.734 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' HIS . . . . . 0.455 ' ND1' ' O ' ' A' ' 97' ' ' TYR . 37.2 p-80 -66.87 139.67 57.75 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.171 -0.611 . . . . 37.13 110.112 -178.023 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -74.75 164.13 26.92 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 107.456 -1.312 . . . . 45.57 107.456 171.737 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 59.3 mm-40 -85.0 16.7 3.26 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.388 0.514 . . . . 37.23 112.388 -171.784 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 24.0 p30 -95.45 7.73 45.34 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 108.995 -0.742 . . . . 37.08 108.995 163.945 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 64.1 m-85 72.71 11.63 5.45 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 113.936 1.087 . . . . 38.62 113.936 179.276 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 22.9 m-85 -104.77 150.61 24.63 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.089 0.471 . . . . 36.92 111.084 173.753 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 59.7 tp -100.84 132.81 46.06 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 107.838 -1.171 . . . . 38.56 107.838 173.341 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 82.7 m-85 -112.12 120.1 40.65 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.241 0.543 . . . . 34.3 112.106 -176.447 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 54.3 mt -123.55 122.11 64.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.654 -0.703 . . . . 37.34 111.127 178.657 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -95.0 143.59 26.36 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.04 -0.726 . . . . 39.38 109.04 170.632 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 36.7 p90 -120.48 149.02 43.05 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.064 0.459 . . . . 37.05 110.154 177.554 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 8.0 t -149.27 164.95 33.39 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.871 -0.604 . . . . 36.27 109.452 -176.45 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 12.9 p-10 -92.15 -3.53 55.51 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.492 -0.559 . . . . 36.18 109.492 172.824 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -110.8 149.74 30.11 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 115.953 -0.567 . . . . 40.42 110.898 178.863 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 6.9 p -82.91 2.46 34.38 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 112.562 0.579 . . . . 39.69 112.562 -175.718 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 70.9 t -126.48 132.33 70.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 N-CA-C 108.546 -0.909 . . . . 41.32 108.546 177.98 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 83.4 t80 -65.93 126.89 29.96 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 113.353 0.871 . . . . 51.69 113.353 -173.557 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 77.09 14.14 82.93 Favored Glycine 0 N--CA 1.452 -0.273 0 CA-C-N 115.892 -0.595 . . . . 42.78 114.196 173.735 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 33.9 tp . . . . . 0 C--N 1.328 -0.352 0 N-CA-C 109.551 -0.537 . . . . 42.3 109.551 -179.626 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' ASP . . . . . . . . . . . . . 29.9 t0 . . . . . 0 CA--C 1.527 0.095 0 N-CA-C 110.073 -0.343 . . . . 58.73 110.073 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' TRP . . . . . . . . . . . . . 91.5 m95 -86.02 135.2 33.73 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.076 0.465 . . . . 51.03 111.021 177.588 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -98.65 126.5 44.27 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.16 -0.681 . . . . 59.24 109.16 176.686 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' PHE . . . . . . . . . . . . . 25.8 m-85 -85.33 132.75 34.2 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.795 0.331 . . . . 57.55 110.261 -179.81 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 6.4 tp -140.19 103.43 6.7 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.201 -0.454 . . . . 62.1 111.514 -172.041 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_exo -76.36 157.47 98.0 Favored 'Cis proline' 0 C--N 1.345 0.366 0 O-C-N 122.544 0.76 . . . . 63.03 111.174 -2.422 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -56.08 -34.32 92.36 Favored 'Trans proline' 0 C--O 1.233 0.259 0 C-N-CA 121.321 1.347 . . . . 69.91 112.213 178.587 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.185 0 O-C-N 119.565 -1.96 . . . . 66.95 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.356 0 N-CA-C 112.755 -0.138 . . . . 75.560000000000002 112.755 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.1 m -110.15 143.59 40.01 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.992 0.425 . . . . 75.079999999999998 111.879 179.773 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' MET . . . . . 0.58 ' HG2' ' HE1' ' A' ' 5' ' ' PHE . 0.0 OUTLIER -49.45 105.14 0.08 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.706 -0.679 . . . . 67.049999999999997 111.935 -171.812 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . . . -113.77 118.65 34.89 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.215 -0.448 . . . . 63.100000000000001 109.829 177.902 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' PHE . . . . . 0.58 ' HE1' ' HG2' ' A' ' 3' ' ' MET . 41.0 m-85 -110.78 143.54 41.14 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.637 0.606 . . . . 58.090000000000003 112.637 -178.114 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 73.2 t -78.16 -27.0 14.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.448 -0.796 . . . . 59.310000000000002 110.295 178.279 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 74.3 t80 -69.51 -29.93 67.67 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.882 -0.327 . . . . 50.579999999999998 110.68 -178.972 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 61.4 mttt -74.15 -25.68 59.88 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.497 -0.32 . . . . 54.329999999999998 111.391 177.426 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -90.15 -15.03 32.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.145 -0.479 . . . . 70.709999999999994 111.624 -178.63 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 53.4 mt-10 -93.76 -21.46 19.3 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 111.704 0.261 . . . . 69.590000000000003 111.704 -178.55 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 47.0 m80 -136.49 131.42 18.4 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.449 -0.342 . . . . 64.870000000000005 110.262 -178.067 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' PRO . . . . . 0.599 ' O ' ' HG3' ' A' ' 16' ' ' ARG . 22.5 Cg_exo -69.74 172.6 12.32 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.262 1.975 . . . . 55.420000000000002 113.427 -177.245 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 70.0 t80 -76.85 -36.86 56.53 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 113.166 0.802 . . . . 56.039999999999999 113.166 -171.067 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -54.86 -47.04 74.7 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 108.304 -0.998 . . . . 66.640000000000001 108.304 173.23 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . . . -66.01 -43.64 87.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.591 -0.731 . . . . 49.890000000000001 112.065 -172.864 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ARG . . . . . 0.599 ' HG3' ' O ' ' A' ' 12' ' ' PRO . 63.0 mtm-85 -70.29 -49.42 49.87 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.912 -0.315 . . . . 51.880000000000003 110.839 -176.471 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 11.1 ttm-85 -59.35 -28.43 66.83 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-O 120.545 0.212 . . . . 50.130000000000003 111.557 -179.198 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 74.2 m -79.0 -36.76 40.72 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.451 -0.341 . . . . 54.170000000000002 110.645 -179.925 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 61.8 tt0 -71.11 -33.63 70.31 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.932 0.396 . . . . 53.439999999999998 110.665 176.609 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -73.17 -40.4 50.21 Favored Glycine 0 N--CA 1.449 -0.48 0 N-CA-C 111.157 -0.777 . . . . 38.229999999999997 111.157 -178.152 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -62.9 -40.74 98.5 Favored 'General case' 0 CA--C 1.516 -0.349 0 N-CA-C 108.56 -0.904 . . . . 50.520000000000003 108.56 179.802 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . . . -69.97 -43.06 72.28 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.084 -0.507 . . . . 42.93 112.206 -178.804 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 1.9 tp -73.37 -24.36 20.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.939 0.4 . . . . 41.719999999999999 109.951 -174.994 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 21.3 mmm180 -77.62 -34.36 53.34 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.918 -0.771 . . . . 40.789999999999999 108.918 172.95 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 64.5 mttt -78.28 -10.04 59.49 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.043 -0.526 . . . . 52.530000000000001 110.762 -178.147 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 80.7 tttt -108.01 -44.23 4.23 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 111.93 0.344 . . . . 65.519999999999996 111.93 -176.152 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 70.0 m-85 -121.14 67.83 17.2 Favored Pre-proline 0 C--N 1.328 -0.354 0 N-CA-C 109.566 -0.531 . . . . 58.700000000000003 109.566 -179.723 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 15.8 Cg_endo -55.12 -36.89 94.08 Favored 'Trans proline' 0 CA--C 1.532 0.408 0 C-N-CA 124.631 3.554 . . . . 48.520000000000003 114.753 -175.619 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 23.7 p-10 -74.29 -10.29 59.44 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 113.046 0.758 . . . . 67.340000000000003 113.046 -177.51 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 12.3 mmt180 -111.04 154.11 24.66 Favored 'General case' 0 N--CA 1.463 0.199 0 C-N-CA 122.597 0.359 . . . . 66.090000000000003 110.606 177.409 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 17.6 m -113.53 133.32 22.2 Favored Pre-proline 0 C--N 1.33 -0.278 0 N-CA-C 109.852 -0.425 . . . . 41.700000000000003 109.852 172.893 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -75.31 127.06 10.19 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 121.563 1.509 . . . . 35.350000000000001 111.359 -179.901 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 58.3 t -127.91 127.41 68.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 O-C-N 123.553 0.533 . . . . 35.289999999999999 111.307 -175.874 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 19.5 mm -97.92 122.81 49.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 N-CA-C 108.796 -0.816 . . . . 34.130000000000003 108.796 172.718 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 53.5 t -121.98 118.44 55.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.66 0.266 . . . . 34.380000000000003 111.131 -175.613 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' GLU . . . . . 0.414 ' O ' ' HA ' ' A' ' 110' ' ' ALA . 75.6 mt-10 -132.93 151.19 52.09 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.115 -0.493 . . . . 53.079999999999998 112.105 -178.974 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 33.6 ttpt -72.59 128.98 37.19 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.879 -0.6 . . . . 40.079999999999998 110.046 178.031 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -64.05 155.79 77.04 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 115.978 -0.555 . . . . 40.710000000000001 110.067 179.141 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_exo -59.04 144.8 99.21 Favored 'Trans proline' 0 C--O 1.233 0.229 0 C-N-CA 120.636 0.891 . . . . 43.560000000000002 111.513 177.284 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . . . 69.6 3.31 4.16 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 114.066 1.135 . . . . 47.369999999999997 114.066 177.271 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -72.18 124.1 24.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.191 0.52 . . . . 37.219999999999999 111.311 -178.858 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 21.7 mmm180 -94.94 91.47 6.42 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 108.222 -1.029 . . . . 53.890000000000001 108.222 177.34 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 20.7 tt -171.45 164.23 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 120.944 0.402 . . . . 40.75 111.614 -169.636 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -62.85 176.04 7.38 Favored Glycine 0 N--CA 1.45 -0.403 0 CA-C-N 116.239 -0.437 . . . . 39.390000000000001 113.368 -177.075 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -112.69 155.81 23.85 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.104 0.478 . . . . 48.579999999999998 112.233 -175.698 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 22.0 mt -101.05 134.76 43.57 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.414 -0.812 . . . . 49.229999999999997 109.146 171.671 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . . . -64.96 -56.45 13.17 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.067 -0.716 . . . . 54.200000000000003 109.067 176.254 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . . . -102.11 151.23 22.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.07 -0.513 . . . . 43.990000000000002 110.888 -179.387 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -104.27 -15.48 15.46 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.929 -0.578 . . . . 67.450000000000003 110.773 177.871 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' LYS . . . . . 0.418 ' HB3' ' CE3' ' B' ' 6' ' ' TRP . 93.4 mttt -103.74 122.15 44.48 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.256 -0.429 . . . . 60.100000000000001 111.893 -172.079 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 51' ' ' TYR . . . . . 0.416 ' HA ' ' O ' ' B' ' 7' ' ' ASP . 90.6 m-85 -137.47 125.28 22.51 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 112.51 0.559 . . . . 44.359999999999999 112.51 -178.247 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 52' ' ' LEU . . . . . 0.473 ' CD2' ' HB3' ' B' ' 6' ' ' TRP . 0.5 OUTLIER -89.9 108.34 19.65 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.277 -0.638 . . . . 49.659999999999997 109.277 168.64 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 53' ' ' VAL . . . . . 0.431 HG11 ' CE1' ' A' ' 62' ' ' PHE . 3.1 m -113.44 134.6 21.92 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 120.533 0.206 . . . . 51.280000000000001 111.349 -176.97 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 54' ' ' PRO . . . . . 0.401 ' HG2' ' HG ' ' A' ' 57' ' ' LEU . 15.6 Cg_endo -55.47 145.36 68.95 Favored 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 121.058 1.172 . . . . 53.630000000000003 112.61 -178.213 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 21.2 m -66.23 -23.51 66.43 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.614 -0.721 . . . . 57.880000000000003 112.829 -176.135 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -86.91 -15.84 37.73 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 114.107 1.151 . . . . 64.810000000000002 114.107 -172.458 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' LEU . . . . . 0.401 ' HG ' ' HG2' ' A' ' 54' ' ' PRO . 16.1 mt -64.01 138.06 58.29 Favored 'General case' 0 CA--C 1.518 -0.284 0 C-N-CA 121.47 -0.092 . . . . 60.340000000000003 111.16 177.295 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 58' ' ' THR . . . . . 0.573 ' HA ' ' HA ' ' A' ' 92' ' ' THR . 69.9 p -82.45 170.72 14.95 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.188 -0.671 . . . . 56.969999999999999 109.188 174.47 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 59' ' ' VAL . . . . . 0.402 ' HB ' ' HA ' ' A' ' 89' ' ' THR . 54.3 t -66.26 -40.72 87.6 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 N-CA-C 108.871 -0.789 . . . . 51.649999999999999 108.871 178.1 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -51.91 -46.16 55.39 Favored Glycine 0 N--CA 1.45 -0.383 0 N-CA-C 111.45 -0.66 . . . . 53.939999999999998 111.45 177.105 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' GLN . . . . . 0.532 ' O ' ' HG ' ' A' ' 65' ' ' LEU . 35.3 mt-30 -69.35 -26.93 64.92 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.68 0.276 . . . . 53.0 110.507 -178.052 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 62' ' ' PHE . . . . . 0.462 ' C ' ' H ' ' A' ' 64' ' ' PHE . 32.6 t80 -76.73 -43.8 35.88 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 116.236 -0.438 . . . . 49.219999999999999 111.18 179.961 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 63' ' ' TYR . . . . . 0.48 ' O ' ' HB2' ' A' ' 67' ' ' ARG . 3.6 m-85 -48.03 -21.37 0.44 Allowed 'General case' 0 CA--C 1.513 -0.454 0 CA-C-O 121.826 0.822 . . . . 52.229999999999997 109.824 174.85 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 64' ' ' PHE . . . . . 0.462 ' H ' ' C ' ' A' ' 62' ' ' PHE . 51.6 t80 -100.07 -38.35 8.59 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 114.162 -1.381 . . . . 72.299999999999997 111.454 -165.158 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 65' ' ' LEU . . . . . 0.532 ' HG ' ' O ' ' A' ' 61' ' ' GLN . 18.5 mt -72.81 -23.89 60.84 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.354 -0.61 . . . . 62.380000000000003 109.354 176.476 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 29.0 mm -83.88 -42.25 17.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.847 -0.615 . . . . 55.270000000000003 109.452 176.797 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' ARG . . . . . 0.48 ' HB2' ' O ' ' A' ' 63' ' ' TYR . 15.1 ttt85 -52.23 -32.05 34.94 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.823 -0.626 . . . . 60.609999999999999 110.152 178.109 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . . . -73.96 -39.58 63.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.151 -0.477 . . . . 57.189999999999998 111.698 178.837 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 11.0 mmt85 -66.33 -36.16 82.22 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 112.463 0.542 . . . . 61.020000000000003 112.463 -178.012 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 4.5 mt -91.66 -31.0 4.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 121.305 0.574 . . . . 47.0 109.851 -178.747 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 68.5 t60 52.26 98.45 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.289 -0.869 . . . . 42.840000000000003 112.332 -170.995 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' LEU . . . . . 0.673 HD11 ' HB2' ' A' ' 78' ' ' LEU . 35.5 mt -75.87 137.96 40.77 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.518 -0.765 . . . . 45.32 111.089 -178.552 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 11.0 mpt_? -81.28 177.35 9.06 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.899 -0.591 . . . . 37.579999999999998 109.783 175.595 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -53.59 126.44 21.73 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.641 0.608 . . . . 46.43 112.641 -176.56 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 61.61 22.61 13.06 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 113.069 0.766 . . . . 59.060000000000002 113.069 175.413 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -79.96 144.41 33.33 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 106.067 -1.827 . . . . 39.700000000000003 106.067 160.96 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' ALA . . . . . 0.485 ' O ' ' HA ' ' A' ' 113' ' ' ASP . . . -114.91 161.62 18.02 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.022 -1.103 . . . . 41.990000000000002 108.022 172.739 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 78' ' ' LEU . . . . . 0.673 ' HB2' HD11 ' A' ' 72' ' ' LEU . 47.6 tp -133.79 114.7 13.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.67 0.272 . . . . 38.840000000000003 111.327 179.672 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 93.2 m-85 -120.61 152.55 38.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.279 -0.419 . . . . 42.990000000000002 110.081 179.694 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 10.2 m-30 -110.18 161.4 15.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.266 -0.425 . . . . 46.710000000000001 109.857 177.871 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 94.6 m-85 -148.34 128.38 13.63 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.12 -0.491 . . . . 46.600000000000001 110.983 -179.855 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' VAL . . . . . 0.448 HG11 ' HB3' ' A' ' 100' ' ' HIS . 93.2 t -135.18 108.91 10.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 N-CA-C 108.46 -0.941 . . . . 58.32 108.46 175.362 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 83' ' ' ASN . . . . . 0.458 ' O ' ' HB2' ' A' ' 84' ' ' ASN . 22.4 m120 67.23 28.83 7.94 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.252 -0.431 . . . . 65.530000000000001 111.716 -175.4 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ASN . . . . . 0.458 ' HB2' ' O ' ' A' ' 83' ' ' ASN . 78.8 m-20 79.86 27.78 0.32 Allowed 'General case' 0 N--CA 1.462 0.171 0 C-N-CA 123.28 0.632 . . . . 71.090000000000003 110.802 173.7 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 16.0 t -138.18 133.77 43.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.783 -0.644 . . . . 63.18 110.578 -177.137 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 8.0 mt -71.8 119.42 74.14 Favored Pre-proline 0 C--N 1.326 -0.449 0 N-CA-C 109.308 -0.627 . . . . 56.869999999999997 109.308 175.135 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 15.8 Cg_exo -68.4 129.59 19.4 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 120.585 0.857 . . . . 55.880000000000003 111.621 179.764 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_endo -56.89 132.0 48.98 Favored 'Trans proline' 0 C--N 1.342 0.222 0 O-C-N 123.2 1.105 . . . . 65.239999999999995 110.743 175.345 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' THR . . . . . 0.402 ' HA ' ' HB ' ' A' ' 59' ' ' VAL . 22.0 p -63.08 -13.41 35.79 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.244 0.461 . . . . 61.770000000000003 112.244 -176.736 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 40.5 p -81.17 -29.12 34.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.616 -0.266 . . . . 62.100000000000001 111.498 -178.371 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -62.16 155.76 23.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.346 -0.388 . . . . 56.979999999999997 110.781 179.442 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' THR . . . . . 0.573 ' HA ' ' HA ' ' A' ' 58' ' ' THR . 4.7 t -99.0 170.99 8.33 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 108.655 -0.868 . . . . 51.829999999999998 108.655 177.293 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 7.9 mmt -75.88 -28.11 57.99 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.758 0.313 . . . . 48.939999999999998 110.209 -177.828 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -70.5 -37.87 69.13 Favored Glycine 0 C--O 1.227 -0.337 0 CA-C-N 116.207 -0.452 . . . . 43.369999999999997 112.051 177.888 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' GLN . . . . . 0.488 ' CG ' HG22 ' A' ' 92' ' ' THR . 64.8 mt-30 -74.49 -36.52 63.26 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.337 -0.616 . . . . 60.460000000000001 109.337 178.478 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 12.9 tp -66.21 -41.02 90.73 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.58 -0.736 . . . . 49.240000000000002 109.74 178.599 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 57.0 t80 -65.99 -49.14 68.88 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.895 -0.409 . . . . 39.609999999999999 109.895 178.76 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 43.2 tt0 -54.41 -43.15 71.25 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.195 0.521 . . . . 55.090000000000003 110.007 179.651 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 79.2 tt0 -87.65 -19.87 27.11 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 113.298 0.851 . . . . 53.700000000000003 113.298 -169.625 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' HIS . . . . . 0.448 ' HB3' HG11 ' A' ' 82' ' ' VAL . 90.9 m-70 -135.19 4.68 3.22 Favored 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 115.708 1.744 . . . . 53.880000000000003 115.708 -169.734 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 37.2 p-80 -66.87 139.67 57.75 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.171 -0.611 . . . . 37.130000000000003 110.112 -178.023 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -74.75 164.13 26.92 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 107.456 -1.312 . . . . 45.57 107.456 171.737 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 59.3 mm-40 -85.0 16.7 3.26 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.388 0.514 . . . . 37.229999999999997 112.388 -171.784 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 24.0 p30 -95.45 7.73 45.34 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 108.995 -0.742 . . . . 37.079999999999998 108.995 163.945 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 64.1 m-85 72.71 11.63 5.45 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 113.936 1.087 . . . . 38.619999999999997 113.936 179.276 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 22.9 m-85 -104.77 150.61 24.63 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.089 0.471 . . . . 36.920000000000002 111.084 173.753 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 59.7 tp -100.84 132.81 46.06 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 107.838 -1.171 . . . . 38.560000000000002 107.838 173.341 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 82.7 m-85 -112.12 120.1 40.65 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.241 0.543 . . . . 34.299999999999997 112.106 -176.447 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 54.3 mt -123.55 122.11 64.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.654 -0.703 . . . . 37.340000000000003 111.127 178.657 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' ALA . . . . . 0.414 ' HA ' ' O ' ' A' ' 36' ' ' GLU . . . -95.0 143.59 26.36 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.04 -0.726 . . . . 39.380000000000003 109.04 170.632 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 36.7 p90 -120.48 149.02 43.05 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.064 0.459 . . . . 37.049999999999997 110.154 177.554 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 8.0 t -149.27 164.95 33.39 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.871 -0.604 . . . . 36.270000000000003 109.452 -176.45 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' ASP . . . . . 0.485 ' HA ' ' O ' ' A' ' 77' ' ' ALA . 12.9 p-10 -92.15 -3.53 55.51 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.492 -0.559 . . . . 36.18 109.492 172.824 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -110.8 149.74 30.11 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 115.953 -0.567 . . . . 40.420000000000002 110.898 178.863 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 6.9 p -82.91 2.46 34.38 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 112.562 0.579 . . . . 39.689999999999998 112.562 -175.718 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 70.9 t -126.48 132.33 70.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 N-CA-C 108.546 -0.909 . . . . 41.32 108.546 177.98 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 83.4 t80 -65.93 126.89 29.96 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 113.353 0.871 . . . . 51.689999999999998 113.353 -173.557 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 77.09 14.14 82.93 Favored Glycine 0 N--CA 1.452 -0.273 0 CA-C-N 115.892 -0.595 . . . . 42.780000000000001 114.196 173.735 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 33.9 tp . . . . . 0 C--N 1.328 -0.352 0 N-CA-C 109.551 -0.537 . . . . 42.299999999999997 109.551 -179.626 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 5' ' ' ASP . . . . . . . . . . . . . 29.9 t0 . . . . . 0 CA--C 1.527 0.095 0 N-CA-C 110.073 -0.343 . . . . 58.729999999999997 110.073 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 6' ' ' TRP . . . . . 0.473 ' HB3' ' CD2' ' A' ' 52' ' ' LEU . 91.5 m95 -86.02 135.2 33.73 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.076 0.465 . . . . 51.030000000000001 111.021 177.588 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 7' ' ' ASP . . . . . 0.416 ' O ' ' HA ' ' A' ' 51' ' ' TYR . 5.6 t0 -98.65 126.5 44.27 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.16 -0.681 . . . . 59.240000000000002 109.16 176.686 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 8' ' ' PHE . . . . . . . . . . . . . 25.8 m-85 -85.33 132.75 34.2 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.795 0.331 . . . . 57.549999999999997 110.261 -179.81 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 6.4 tp -140.19 103.43 6.7 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.201 -0.454 . . . . 62.100000000000001 111.514 -172.041 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_exo -76.36 157.47 98.0 Favored 'Cis proline' 0 C--N 1.345 0.366 0 O-C-N 122.544 0.76 . . . . 63.030000000000001 111.174 -2.422 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 11' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -56.08 -34.32 92.36 Favored 'Trans proline' 0 C--O 1.233 0.259 0 C-N-CA 121.321 1.347 . . . . 69.909999999999997 112.213 178.587 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 12' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.185 0 O-C-N 119.565 -1.96 . . . . 66.950000000000003 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.356 0 N-CA-C 112.755 -0.138 . . . . 75.560000000000002 112.755 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.1 m -110.15 143.59 40.01 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.992 0.425 . . . . 75.079999999999998 111.879 179.773 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' MET . . . . . 0.58 ' HG2' ' HE1' ' A' ' 5' ' ' PHE . 0.0 OUTLIER -49.45 105.14 0.08 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.706 -0.679 . . . . 67.049999999999997 111.935 -171.812 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . . . -113.77 118.65 34.89 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.215 -0.448 . . . . 63.100000000000001 109.829 177.902 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' PHE . . . . . 0.58 ' HE1' ' HG2' ' A' ' 3' ' ' MET . 41.0 m-85 -110.78 143.54 41.14 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.637 0.606 . . . . 58.090000000000003 112.637 -178.114 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 73.2 t -78.16 -27.0 14.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.448 -0.796 . . . . 59.310000000000002 110.295 178.279 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 74.3 t80 -69.51 -29.93 67.67 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.882 -0.327 . . . . 50.579999999999998 110.68 -178.972 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 61.4 mttt -74.15 -25.68 59.88 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.497 -0.32 . . . . 54.329999999999998 111.391 177.426 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -90.15 -15.03 32.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.145 -0.479 . . . . 70.709999999999994 111.624 -178.63 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 53.4 mt-10 -93.76 -21.46 19.3 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 111.704 0.261 . . . . 69.590000000000003 111.704 -178.55 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 47.0 m80 -136.49 131.42 18.4 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.449 -0.342 . . . . 64.870000000000005 110.262 -178.067 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.599 ' O ' ' HG3' ' A' ' 16' ' ' ARG . 22.5 Cg_exo -69.74 172.6 12.32 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.262 1.975 . . . . 55.420000000000002 113.427 -177.245 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 70.0 t80 -76.85 -36.86 56.53 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 113.166 0.802 . . . . 56.039999999999999 113.166 -171.067 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -54.86 -47.04 74.7 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 108.304 -0.998 . . . . 66.640000000000001 108.304 173.23 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . . . -66.01 -43.64 87.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.591 -0.731 . . . . 49.890000000000001 112.065 -172.864 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.599 ' HG3' ' O ' ' A' ' 12' ' ' PRO . 63.0 mtm-85 -70.29 -49.42 49.87 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.912 -0.315 . . . . 51.880000000000003 110.839 -176.471 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 11.1 ttm-85 -59.35 -28.43 66.83 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-O 120.545 0.212 . . . . 50.130000000000003 111.557 -179.198 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 74.2 m -79.0 -36.76 40.72 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.451 -0.341 . . . . 54.170000000000002 110.645 -179.925 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 61.8 tt0 -71.11 -33.63 70.31 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.932 0.396 . . . . 53.439999999999998 110.665 176.609 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -73.17 -40.4 50.21 Favored Glycine 0 N--CA 1.449 -0.48 0 N-CA-C 111.157 -0.777 . . . . 38.229999999999997 111.157 -178.152 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -62.9 -40.74 98.5 Favored 'General case' 0 CA--C 1.516 -0.349 0 N-CA-C 108.56 -0.904 . . . . 50.520000000000003 108.56 179.802 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . . . -69.97 -43.06 72.28 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.084 -0.507 . . . . 42.93 112.206 -178.804 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 1.9 tp -73.37 -24.36 20.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.939 0.4 . . . . 41.719999999999999 109.951 -174.994 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 21.3 mmm180 -77.62 -34.36 53.34 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.918 -0.771 . . . . 40.789999999999999 108.918 172.95 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 64.5 mttt -78.28 -10.04 59.49 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.043 -0.526 . . . . 52.530000000000001 110.762 -178.147 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 80.7 tttt -108.01 -44.23 4.23 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 111.93 0.344 . . . . 65.519999999999996 111.93 -176.152 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 70.0 m-85 -121.14 67.83 17.2 Favored Pre-proline 0 C--N 1.328 -0.354 0 N-CA-C 109.566 -0.531 . . . . 58.700000000000003 109.566 -179.723 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 15.8 Cg_endo -55.12 -36.89 94.08 Favored 'Trans proline' 0 CA--C 1.532 0.408 0 C-N-CA 124.631 3.554 . . . . 48.520000000000003 114.753 -175.619 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 23.7 p-10 -74.29 -10.29 59.44 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 113.046 0.758 . . . . 67.340000000000003 113.046 -177.51 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 12.3 mmt180 -111.04 154.11 24.66 Favored 'General case' 0 N--CA 1.463 0.199 0 C-N-CA 122.597 0.359 . . . . 66.090000000000003 110.606 177.409 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 17.6 m -113.53 133.32 22.2 Favored Pre-proline 0 C--N 1.33 -0.278 0 N-CA-C 109.852 -0.425 . . . . 41.700000000000003 109.852 172.893 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -75.31 127.06 10.19 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 121.563 1.509 . . . . 35.350000000000001 111.359 -179.901 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 58.3 t -127.91 127.41 68.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 O-C-N 123.553 0.533 . . . . 35.289999999999999 111.307 -175.874 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 19.5 mm -97.92 122.81 49.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 N-CA-C 108.796 -0.816 . . . . 34.130000000000003 108.796 172.718 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 53.5 t -121.98 118.44 55.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.66 0.266 . . . . 34.380000000000003 111.131 -175.613 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.414 ' O ' ' HA ' ' A' ' 110' ' ' ALA . 75.6 mt-10 -132.93 151.19 52.09 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.115 -0.493 . . . . 53.079999999999998 112.105 -178.974 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 33.6 ttpt -72.59 128.98 37.19 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.879 -0.6 . . . . 40.079999999999998 110.046 178.031 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -64.05 155.79 77.04 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 115.978 -0.555 . . . . 40.710000000000001 110.067 179.141 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_exo -59.04 144.8 99.21 Favored 'Trans proline' 0 C--O 1.233 0.229 0 C-N-CA 120.636 0.891 . . . . 43.560000000000002 111.513 177.284 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . . . 69.6 3.31 4.16 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 114.066 1.135 . . . . 47.369999999999997 114.066 177.271 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -72.18 124.1 24.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.191 0.52 . . . . 37.219999999999999 111.311 -178.858 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 21.7 mmm180 -94.94 91.47 6.42 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 108.222 -1.029 . . . . 53.890000000000001 108.222 177.34 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 20.7 tt -171.45 164.23 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 120.944 0.402 . . . . 40.75 111.614 -169.636 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -62.85 176.04 7.38 Favored Glycine 0 N--CA 1.45 -0.403 0 CA-C-N 116.239 -0.437 . . . . 39.390000000000001 113.368 -177.075 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -112.69 155.81 23.85 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.104 0.478 . . . . 48.579999999999998 112.233 -175.698 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 22.0 mt -101.05 134.76 43.57 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.414 -0.812 . . . . 49.229999999999997 109.146 171.671 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . . . -64.96 -56.45 13.17 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.067 -0.716 . . . . 54.200000000000003 109.067 176.254 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . . . -102.11 151.23 22.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.07 -0.513 . . . . 43.990000000000002 110.888 -179.387 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -104.27 -15.48 15.46 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.929 -0.578 . . . . 67.450000000000003 110.773 177.871 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.418 ' HB3' ' CE3' ' B' ' 6' ' ' TRP . 93.4 mttt -103.74 122.15 44.48 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.256 -0.429 . . . . 60.100000000000001 111.893 -172.079 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.416 ' HA ' ' O ' ' B' ' 7' ' ' ASP . 90.6 m-85 -137.47 125.28 22.51 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 112.51 0.559 . . . . 44.359999999999999 112.51 -178.247 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.473 ' CD2' ' HB3' ' B' ' 6' ' ' TRP . 0.5 OUTLIER -89.9 108.34 19.65 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.277 -0.638 . . . . 49.659999999999997 109.277 168.64 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.431 HG11 ' CE1' ' A' ' 62' ' ' PHE . 3.1 m -113.44 134.6 21.92 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 120.533 0.206 . . . . 51.280000000000001 111.349 -176.97 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.401 ' HG2' ' HG ' ' A' ' 57' ' ' LEU . 15.6 Cg_endo -55.47 145.36 68.95 Favored 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 121.058 1.172 . . . . 53.630000000000003 112.61 -178.213 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 21.2 m -66.23 -23.51 66.43 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.614 -0.721 . . . . 57.880000000000003 112.829 -176.135 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -86.91 -15.84 37.73 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 114.107 1.151 . . . . 64.810000000000002 114.107 -172.458 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.401 ' HG ' ' HG2' ' A' ' 54' ' ' PRO . 16.1 mt -64.01 138.06 58.29 Favored 'General case' 0 CA--C 1.518 -0.284 0 C-N-CA 121.47 -0.092 . . . . 60.340000000000003 111.16 177.295 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' THR . . . . . 0.573 ' HA ' ' HA ' ' A' ' 92' ' ' THR . 69.9 p -82.45 170.72 14.95 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.188 -0.671 . . . . 56.969999999999999 109.188 174.47 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.402 ' HB ' ' HA ' ' A' ' 89' ' ' THR . 54.3 t -66.26 -40.72 87.6 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 N-CA-C 108.871 -0.789 . . . . 51.649999999999999 108.871 178.1 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -51.91 -46.16 55.39 Favored Glycine 0 N--CA 1.45 -0.383 0 N-CA-C 111.45 -0.66 . . . . 53.939999999999998 111.45 177.105 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' GLN . . . . . 0.532 ' O ' ' HG ' ' A' ' 65' ' ' LEU . 35.3 mt-30 -69.35 -26.93 64.92 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.68 0.276 . . . . 53.0 110.507 -178.052 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.462 ' C ' ' H ' ' A' ' 64' ' ' PHE . 32.6 t80 -76.73 -43.8 35.88 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 116.236 -0.438 . . . . 49.219999999999999 111.18 179.961 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' TYR . . . . . 0.48 ' O ' ' HB2' ' A' ' 67' ' ' ARG . 3.6 m-85 -48.03 -21.37 0.44 Allowed 'General case' 0 CA--C 1.513 -0.454 0 CA-C-O 121.826 0.822 . . . . 52.229999999999997 109.824 174.85 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.462 ' H ' ' C ' ' A' ' 62' ' ' PHE . 51.6 t80 -100.07 -38.35 8.59 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 114.162 -1.381 . . . . 72.299999999999997 111.454 -165.158 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.532 ' HG ' ' O ' ' A' ' 61' ' ' GLN . 18.5 mt -72.81 -23.89 60.84 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.354 -0.61 . . . . 62.380000000000003 109.354 176.476 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 29.0 mm -83.88 -42.25 17.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.847 -0.615 . . . . 55.270000000000003 109.452 176.797 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.48 ' HB2' ' O ' ' A' ' 63' ' ' TYR . 15.1 ttt85 -52.23 -32.05 34.94 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.823 -0.626 . . . . 60.609999999999999 110.152 178.109 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . . . -73.96 -39.58 63.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.151 -0.477 . . . . 57.189999999999998 111.698 178.837 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 11.0 mmt85 -66.33 -36.16 82.22 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 112.463 0.542 . . . . 61.020000000000003 112.463 -178.012 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 4.5 mt -91.66 -31.0 4.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 121.305 0.574 . . . . 47.0 109.851 -178.747 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 68.5 t60 52.26 98.45 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.289 -0.869 . . . . 42.840000000000003 112.332 -170.995 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.673 HD11 ' HB2' ' A' ' 78' ' ' LEU . 35.5 mt -75.87 137.96 40.77 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.518 -0.765 . . . . 45.32 111.089 -178.552 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 11.0 mpt_? -81.28 177.35 9.06 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.899 -0.591 . . . . 37.579999999999998 109.783 175.595 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -53.59 126.44 21.73 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.641 0.608 . . . . 46.43 112.641 -176.56 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 61.61 22.61 13.06 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 113.069 0.766 . . . . 59.060000000000002 113.069 175.413 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -79.96 144.41 33.33 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 106.067 -1.827 . . . . 39.700000000000003 106.067 160.96 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.485 ' O ' ' HA ' ' A' ' 113' ' ' ASP . . . -114.91 161.62 18.02 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.022 -1.103 . . . . 41.990000000000002 108.022 172.739 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.673 ' HB2' HD11 ' A' ' 72' ' ' LEU . 47.6 tp -133.79 114.7 13.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.67 0.272 . . . . 38.840000000000003 111.327 179.672 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 93.2 m-85 -120.61 152.55 38.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.279 -0.419 . . . . 42.990000000000002 110.081 179.694 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 10.2 m-30 -110.18 161.4 15.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.266 -0.425 . . . . 46.710000000000001 109.857 177.871 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 94.6 m-85 -148.34 128.38 13.63 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.12 -0.491 . . . . 46.600000000000001 110.983 -179.855 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.448 HG11 ' HB3' ' A' ' 100' ' ' HIS . 93.2 t -135.18 108.91 10.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 N-CA-C 108.46 -0.941 . . . . 58.32 108.46 175.362 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' ASN . . . . . 0.458 ' O ' ' HB2' ' A' ' 84' ' ' ASN . 22.4 m120 67.23 28.83 7.94 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.252 -0.431 . . . . 65.530000000000001 111.716 -175.4 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ASN . . . . . 0.458 ' HB2' ' O ' ' A' ' 83' ' ' ASN . 78.8 m-20 79.86 27.78 0.32 Allowed 'General case' 0 N--CA 1.462 0.171 0 C-N-CA 123.28 0.632 . . . . 71.090000000000003 110.802 173.7 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 16.0 t -138.18 133.77 43.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.783 -0.644 . . . . 63.18 110.578 -177.137 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 8.0 mt -71.8 119.42 74.14 Favored Pre-proline 0 C--N 1.326 -0.449 0 N-CA-C 109.308 -0.627 . . . . 56.869999999999997 109.308 175.135 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 15.8 Cg_exo -68.4 129.59 19.4 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 120.585 0.857 . . . . 55.880000000000003 111.621 179.764 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_endo -56.89 132.0 48.98 Favored 'Trans proline' 0 C--N 1.342 0.222 0 O-C-N 123.2 1.105 . . . . 65.239999999999995 110.743 175.345 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' THR . . . . . 0.402 ' HA ' ' HB ' ' A' ' 59' ' ' VAL . 22.0 p -63.08 -13.41 35.79 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.244 0.461 . . . . 61.770000000000003 112.244 -176.736 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 40.5 p -81.17 -29.12 34.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.616 -0.266 . . . . 62.100000000000001 111.498 -178.371 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -62.16 155.76 23.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.346 -0.388 . . . . 56.979999999999997 110.781 179.442 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' THR . . . . . 0.573 ' HA ' ' HA ' ' A' ' 58' ' ' THR . 4.7 t -99.0 170.99 8.33 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 108.655 -0.868 . . . . 51.829999999999998 108.655 177.293 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 7.9 mmt -75.88 -28.11 57.99 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.758 0.313 . . . . 48.939999999999998 110.209 -177.828 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -70.5 -37.87 69.13 Favored Glycine 0 C--O 1.227 -0.337 0 CA-C-N 116.207 -0.452 . . . . 43.369999999999997 112.051 177.888 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.488 ' CG ' HG22 ' A' ' 92' ' ' THR . 64.8 mt-30 -74.49 -36.52 63.26 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.337 -0.616 . . . . 60.460000000000001 109.337 178.478 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 12.9 tp -66.21 -41.02 90.73 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.58 -0.736 . . . . 49.240000000000002 109.74 178.599 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 57.0 t80 -65.99 -49.14 68.88 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.895 -0.409 . . . . 39.609999999999999 109.895 178.76 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 43.2 tt0 -54.41 -43.15 71.25 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.195 0.521 . . . . 55.090000000000003 110.007 179.651 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 79.2 tt0 -87.65 -19.87 27.11 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 113.298 0.851 . . . . 53.700000000000003 113.298 -169.625 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' HIS . . . . . 0.448 ' HB3' HG11 ' A' ' 82' ' ' VAL . 90.9 m-70 -135.19 4.68 3.22 Favored 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 115.708 1.744 . . . . 53.880000000000003 115.708 -169.734 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 37.2 p-80 -66.87 139.67 57.75 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.171 -0.611 . . . . 37.130000000000003 110.112 -178.023 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -74.75 164.13 26.92 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 107.456 -1.312 . . . . 45.57 107.456 171.737 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 59.3 mm-40 -85.0 16.7 3.26 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.388 0.514 . . . . 37.229999999999997 112.388 -171.784 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 24.0 p30 -95.45 7.73 45.34 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 108.995 -0.742 . . . . 37.079999999999998 108.995 163.945 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 64.1 m-85 72.71 11.63 5.45 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 113.936 1.087 . . . . 38.619999999999997 113.936 179.276 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 22.9 m-85 -104.77 150.61 24.63 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.089 0.471 . . . . 36.920000000000002 111.084 173.753 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' LEU . . . . . . . . . . . . . 59.7 tp -100.84 132.81 46.06 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 107.838 -1.171 . . . . 38.560000000000002 107.838 173.341 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 82.7 m-85 -112.12 120.1 40.65 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.241 0.543 . . . . 34.299999999999997 112.106 -176.447 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 54.3 mt -123.55 122.11 64.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.654 -0.703 . . . . 37.340000000000003 111.127 178.657 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' ALA . . . . . 0.414 ' HA ' ' O ' ' A' ' 36' ' ' GLU . . . -95.0 143.59 26.36 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.04 -0.726 . . . . 39.380000000000003 109.04 170.632 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 36.7 p90 -120.48 149.02 43.05 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.064 0.459 . . . . 37.049999999999997 110.154 177.554 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 8.0 t -149.27 164.95 33.39 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.871 -0.604 . . . . 36.270000000000003 109.452 -176.45 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' ASP . . . . . 0.485 ' HA ' ' O ' ' A' ' 77' ' ' ALA . 12.9 p-10 -92.15 -3.53 55.51 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.492 -0.559 . . . . 36.18 109.492 172.824 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -110.8 149.74 30.11 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 115.953 -0.567 . . . . 40.420000000000002 110.898 178.863 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 6.9 p -82.91 2.46 34.38 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 112.562 0.579 . . . . 39.689999999999998 112.562 -175.718 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 70.9 t -126.48 132.33 70.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 N-CA-C 108.546 -0.909 . . . . 41.32 108.546 177.98 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 83.4 t80 -65.93 126.89 29.96 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 113.353 0.871 . . . . 51.689999999999998 113.353 -173.557 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 77.09 14.14 82.93 Favored Glycine 0 N--CA 1.452 -0.273 0 CA-C-N 115.892 -0.595 . . . . 42.780000000000001 114.196 173.735 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 33.9 tp . . . . . 0 C--N 1.328 -0.352 0 N-CA-C 109.551 -0.537 . . . . 42.299999999999997 109.551 -179.626 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' ASP . . . . . . . . . . . . . 29.9 t0 . . . . . 0 CA--C 1.527 0.095 0 N-CA-C 110.073 -0.343 . . . . 58.729999999999997 110.073 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' TRP . . . . . 0.473 ' HB3' ' CD2' ' A' ' 52' ' ' LEU . 91.5 m95 -86.02 135.2 33.73 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.076 0.465 . . . . 51.030000000000001 111.021 177.588 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' ASP . . . . . 0.416 ' O ' ' HA ' ' A' ' 51' ' ' TYR . 5.6 t0 -98.65 126.5 44.27 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.16 -0.681 . . . . 59.240000000000002 109.16 176.686 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' PHE . . . . . . . . . . . . . 25.8 m-85 -85.33 132.75 34.2 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.795 0.331 . . . . 57.549999999999997 110.261 -179.81 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 6.4 tp -140.19 103.43 6.7 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.201 -0.454 . . . . 62.100000000000001 111.514 -172.041 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_exo -76.36 157.47 98.0 Favored 'Cis proline' 0 C--N 1.345 0.366 0 O-C-N 122.544 0.76 . . . . 63.030000000000001 111.174 -2.422 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -56.08 -34.32 92.36 Favored 'Trans proline' 0 C--O 1.233 0.259 0 C-N-CA 121.321 1.347 . . . . 69.909999999999997 112.213 178.587 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.185 0 O-C-N 119.565 -1.96 . . . . 66.950000000000003 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_