data_5z4y_residue ############################ # Computer software used # ############################ 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 5z4y _Structure_validation_residue.Date_analyzed 2019-01-18 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 ' 0' ' ' SER . . . . . . . . . . . . . 91.8 p . . . . . 0 N--CA 1.45 -0.428 0 N-CA-C 113.408 0.892 . . . . 67.5 113.408 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.6 ptp -66.32 153.96 41.26 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 115.232 -0.895 . . . . 60.39 110.524 174.292 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -122.09 153.89 38.07 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.703 -0.68 . . . . 64.92 109.308 -175.101 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 45.1 mt -57.4 -34.56 69.01 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 115.347 -0.842 . . . . 33.61 112.148 177.168 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 18.1 tt0 -61.67 -42.51 99.02 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 119.335 -0.946 . . . . 51.56 110.465 -178.532 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -67.04 -33.1 74.79 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 119.359 -0.936 . . . . 39.75 111.056 179.845 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.4 -41.44 89.32 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 119.68 -0.808 . . . . 34.68 111.31 175.294 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 21.9 tpp180 -62.33 -36.71 83.04 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 120.469 -0.492 . . . . 39.4 111.432 176.186 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 9.7 m-30 -66.41 -47.01 74.63 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 112.122 0.416 . . . . 45.4 112.122 -177.448 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 45.0 pt -70.4 -32.72 51.17 Favored 'Isoleucine or valine' 0 C--O 1.242 0.678 0 C-N-CA 117.832 -1.547 . . . . 26.98 110.001 -176.27 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 72.2 t-105 -62.13 -47.74 83.21 Favored 'General case' 0 C--O 1.237 0.436 0 O-C-N 121.853 -0.53 . . . . 29.39 110.485 174.136 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -67.64 -43.94 79.12 Favored 'General case' 0 C--O 1.238 0.467 0 C-N-CA 120.593 -0.443 . . . . 33.64 111.687 -177.886 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 15.8 t -58.12 -39.48 73.09 Favored 'Isoleucine or valine' 0 C--O 1.238 0.486 0 C-N-CA 120.508 -0.477 . . . . 30.99 110.424 176.01 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.62 -28.81 66.24 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 119.024 -1.07 . . . . 23.54 111.172 179.317 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 42.1 m80 -93.51 5.27 52.16 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 113.188 0.81 . . . . 36.62 113.188 -178.944 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 75.6 m80 -114.25 41.19 2.33 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 123.898 0.879 . . . . 29.59 110.687 166.21 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 46.23 39.68 6.49 Favored 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 123.697 0.799 . . . . 40.06 112.702 178.775 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 27.7 mt 66.97 15.41 10.14 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.792 0.664 . . . . 27.51 112.792 177.346 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 47.2 t-20 -91.83 101.15 13.73 Favored 'General case' 0 C--O 1.232 0.167 0 N-CA-C 106.029 -1.841 . . . . 44.8 106.029 -179.583 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 86.2 t -68.49 -30.44 47.45 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 CA-C-N 115.899 -0.591 . . . . 41.8 110.546 -175.027 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.7 t -64.69 -48.8 73.36 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-O 120.935 0.398 . . . . 49.81 111.083 177.315 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.48 -34.03 76.88 Favored 'General case' 0 C--O 1.235 0.331 0 O-C-N 122.275 -0.266 . . . . 38.64 111.628 177.886 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 12.2 m -68.02 -45.28 74.46 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.667 -0.413 . . . . 29.48 110.852 179.346 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -54.37 -43.5 71.41 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.733 -0.387 . . . . 36.3 110.932 179.106 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 21.8 tt0 -71.67 -32.47 67.91 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 117.607 -1.637 . . . . 69.07 111.749 179.94 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.8 m -58.24 -43.3 87.74 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 120.414 -0.514 . . . . 42.37 110.968 173.68 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 72.0 mt -89.98 6.15 43.39 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 112.863 0.69 . . . . 37.51 112.863 -176.21 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 93.6 m-85 47.83 60.65 3.41 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 122.06 0.933 . . . . 52.44 110.872 -177.39 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 5.2 t -150.72 176.35 11.11 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 107.535 -1.283 . . . . 58.4 107.535 178.917 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 43.4 p -87.92 149.45 24.06 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 109.066 -0.716 . . . . 60.19 109.066 -177.606 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -66.58 -43.08 50.01 Favored Pre-proline 0 C--O 1.245 0.833 0 CA-C-O 118.497 -0.763 . . . . 69.19 113.02 -179.61 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -58.18 -30.56 90.97 Favored 'Trans proline' 0 C--O 1.239 0.539 0 CA-C-N 121.202 1.465 . . . . 54.4 113.291 172.282 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -59.63 -46.14 94.48 Favored Glycine 0 C--N 1.333 0.387 0 C-N-CA 119.247 -1.454 . . . . 47.93 112.314 177.935 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 49.2 mt -67.5 -41.08 85.57 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 C-N-CA 119.599 -0.84 . . . . 45.16 110.493 -177.097 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 62.4 m -61.62 -35.08 76.85 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 120.187 -0.605 . . . . 43.77 112.046 179.335 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 28.1 ttmt -64.11 -51.41 64.1 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 119.153 -1.019 . . . . 76.37 110.524 177.998 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 96.7 mm-40 -62.26 -30.85 71.41 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 119.868 -0.733 . . . . 61.48 111.889 -173.82 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 33.8 mt -72.59 -40.64 62.88 Favored 'Isoleucine or valine' 0 C--O 1.239 0.535 0 C-N-CA 119.556 -0.858 . . . . 44.64 110.472 -179.077 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 4.0 mmt85 -74.11 -27.88 61.09 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 118.966 -1.093 . . . . 70.82 112.424 178.993 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 15.4 mt -60.36 -48.16 82.94 Favored 'General case' 0 CA--C 1.516 -0.327 0 C-N-CA 118.616 -1.234 . . . . 69.54 109.709 168.289 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 41.1 tp -57.79 -46.91 83.94 Favored 'General case' 0 C--O 1.238 0.495 0 C-N-CA 120.619 -0.432 . . . . 50.55 110.886 178.028 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 56.3 mt-10 -68.59 -34.78 76.39 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 119.059 -1.056 . . . . 55.64 110.855 -176.331 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 80.1 m-20 -66.93 -43.79 82.34 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 119.759 -0.776 . . . . 71.07 110.681 173.959 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -59.46 -42.93 93.14 Favored 'General case' 0 C--O 1.236 0.374 0 O-C-N 122.461 -0.149 . . . . 70.7 111.365 176.909 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 3.6 mp -79.45 -26.75 41.68 Favored 'General case' 0 C--N 1.347 0.461 0 N-CA-C 113.296 0.85 . . . . 51.87 113.296 176.808 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.37 20.85 78.49 Favored Glycine 0 C--N 1.333 0.377 0 N-CA-C 115.326 0.89 . . . . 59.5 115.326 -175.954 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 4.6 p -136.53 152.31 29.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 107.569 -1.271 . . . . 55.04 107.569 175.918 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -85.71 125.68 33.39 Favored 'General case' 0 CA--C 1.519 -0.216 0 C-N-CA 120.804 -0.359 . . . . 70.78 110.749 174.362 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 67.6 t -82.75 -34.11 11.33 Favored 'Isoleucine or valine' 0 C--O 1.238 0.499 0 C-N-CA 119.262 -0.975 . . . . 37.94 109.993 174.104 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 74.8 m-85 -125.4 124.73 42.11 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 123.425 0.69 . . . . 44.97 110.337 -177.501 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -67.65 142.0 56.53 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 120.321 -0.552 . . . . 37.38 109.875 169.541 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 5.0 mtt85 -121.73 160.22 25.0 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 122.009 0.909 . . . . 51.83 111.091 -177.875 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 8.3 t -144.26 95.47 2.72 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 102.466 -3.161 . . . . 46.69 102.466 174.804 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 67.02 -151.63 52.53 Favored Glycine 0 N--CA 1.444 -0.832 0 C-N-CA 119.341 -1.409 . . . . 49.92 110.946 -167.835 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . . . -83.1 62.44 6.6 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 122.451 1.12 . . . . 48.56 110.298 177.849 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 77.2 t60 -164.03 138.84 5.89 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 107.947 -1.131 . . . . 38.79 107.947 -168.952 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 44.3 mt -90.55 135.19 33.86 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 121.556 0.694 . . . . 37.69 111.412 176.947 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 79.5 p -106.59 -41.59 5.22 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 113.524 0.935 . . . . 37.47 113.524 -178.398 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . . . -159.83 164.88 33.29 Favored 'General case' 0 C--O 1.238 0.486 0 N-CA-C 109.061 -0.718 . . . . 41.3 109.061 178.434 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 67.4 t -80.83 134.28 27.58 Favored 'Isoleucine or valine' 0 C--O 1.234 0.255 0 CA-C-N 115.13 -0.941 . . . . 39.8 108.515 169.66 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 17.4 p -77.56 160.4 74.96 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-O 120.849 0.357 . . . . 38.45 110.849 179.548 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_exo -44.23 -48.51 9.62 Favored 'Trans proline' 0 C--O 1.238 0.501 0 N-CA-C 114.276 0.837 . . . . 43.7 114.276 169.877 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.8 -39.79 95.1 Favored 'General case' 0 C--O 1.238 0.476 0 C-N-CA 121.025 -0.27 . . . . 36.07 111.525 178.36 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -66.15 -33.62 85.82 Favored Glycine 0 C--N 1.336 0.544 0 C-N-CA 121.38 -0.438 . . . . 32.83 114.174 -179.123 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 83.5 mt-10 -61.03 -43.21 99.23 Favored 'General case' 0 C--O 1.238 0.477 0 C-N-CA 118.954 -1.098 . . . . 60.51 110.578 177.122 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . . . -67.48 -47.05 71.18 Favored 'General case' 0 C--O 1.239 0.524 0 C-N-CA 120.602 -0.439 . . . . 57.93 110.873 177.915 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 57.9 mt -63.96 -44.99 98.04 Favored 'Isoleucine or valine' 0 C--O 1.237 0.417 0 N-CA-C 111.885 0.328 . . . . 29.92 111.885 -176.908 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 47.4 mt -64.5 -42.94 96.66 Favored 'Isoleucine or valine' 0 C--O 1.239 0.545 0 O-C-N 121.495 -0.753 . . . . 30.75 110.941 179.604 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 68.1 t60 -55.7 -46.74 77.59 Favored 'General case' 0 C--O 1.24 0.58 0 C-N-CA 120.362 -0.535 . . . . 26.09 111.213 178.125 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 69.8 m -68.37 -32.17 72.05 Favored 'General case' 0 C--O 1.237 0.437 0 N-CA-C 111.698 0.259 . . . . 36.84 111.698 179.181 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.15 -41.06 96.06 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 120.538 -0.465 . . . . 28.12 111.216 173.866 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -59.22 -41.22 96.64 Favored Glycine 0 C--N 1.337 0.62 0 C-N-CA 119.975 -1.107 . . . . 23.69 111.896 175.798 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -60.42 -42.9 96.96 Favored 'General case' 0 C--O 1.241 0.633 0 CA-C-N 116.896 0.348 . . . . 44.79 111.271 174.888 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 64.6 mt -63.01 -47.62 91.86 Favored 'Isoleucine or valine' 0 C--O 1.234 0.285 0 C-N-CA 119.827 -0.749 . . . . 22.02 110.068 177.638 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 58.4 mt -63.28 -37.41 87.12 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.032 -0.667 . . . . 19.95 111.782 -178.129 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ARG . . . . . 0.988 ' NH2' ' O ' ' A' ' 201' ' ' HOH . 87.0 mtm-85 -67.95 -35.99 79.34 Favored 'General case' 0 C--O 1.238 0.448 0 C-N-CA 118.502 -1.279 . . . . 33.71 110.657 177.797 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 16.9 mttm -70.73 -36.0 72.97 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 119.916 -0.714 . . . . 35.71 111.695 179.799 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 26.4 t -58.23 -41.67 81.58 Favored 'Isoleucine or valine' 0 C--O 1.238 0.478 0 CA-C-O 120.932 0.396 . . . . 30.02 110.725 171.41 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -65.34 -36.71 84.85 Favored 'General case' 0 C--O 1.237 0.437 0 O-C-N 121.858 -0.526 . . . . 55.17 111.969 178.092 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -68.03 -31.52 71.25 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 119.499 -0.88 . . . . 43.33 111.28 -178.941 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 43.8 mt -59.0 -40.83 81.55 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 C-N-CA 120.241 -0.584 . . . . 33.94 110.345 173.97 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' LYS . . . . . 0.439 ' NZ ' ' O ' ' A' ' 203' ' ' HOH . 10.1 mtpt -71.04 -27.97 64.04 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 120.198 -0.601 . . . . 47.0 111.777 179.171 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 -75.38 -36.5 60.89 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 120.485 -0.486 . . . . 63.76 111.696 173.829 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 73.8 mt -62.95 -46.26 96.77 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 C-N-CA 120.028 -0.669 . . . . 43.62 110.266 175.016 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -53.69 -49.65 67.57 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 121.024 0.44 . . . . 48.23 111.271 175.685 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -70.03 -30.87 68.27 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 112.36 0.504 . . . . 70.03 112.36 -173.6 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 86.7 mt-10 -64.91 -42.33 94.81 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 119.161 -1.015 . . . . 75.66 110.997 175.993 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 41.5 m-85 -74.7 -16.68 60.74 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 119.046 -1.061 . . . . 67.54 112.135 174.889 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.694 0 CA-C-O 121.739 0.781 . . . . 69.31 112.74 176.116 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 0' ' ' SER . . . . . . . . . . . . . 90.4 p . . . . . 0 C--O 1.232 0.142 0 CA-C-O 121.979 0.895 . . . . 48.12 111.269 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.5 ttm -64.45 151.09 45.16 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 114.959 -1.019 . . . . 46.83 111.106 173.959 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 2' ' ' LYS . . . . . . . . . . . . . 9.2 mmtp -121.51 149.22 43.41 Favored 'General case' 0 CA--C 1.513 -0.449 0 CA-C-N 116.135 -0.484 . . . . 47.8 109.969 -176.451 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' LEU . . . . . . . . . . . . . 50.2 mt -57.68 -34.97 69.96 Favored 'General case' 0 C--O 1.242 0.676 0 CA-C-N 115.636 -0.711 . . . . 30.3 111.236 175.121 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 53.7 tt0 -61.31 -43.62 98.57 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 119.61 -0.836 . . . . 45.17 110.666 -177.45 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -67.19 -33.65 75.85 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 120.341 -0.544 . . . . 31.23 110.868 -179.167 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.47 -41.3 93.5 Favored 'General case' 0 C--O 1.239 0.502 0 C-N-CA 120.113 -0.635 . . . . 31.36 110.998 174.045 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' ARG . . . . . . . . . . . . . 21.1 tpp180 -62.83 -36.05 81.93 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.507 -0.477 . . . . 51.06 110.77 174.771 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' TYR . . . . . . . . . . . . . 11.3 m-30 -68.8 -48.79 62.71 Favored 'General case' 0 C--O 1.234 0.271 0 C-N-CA 119.932 -0.707 . . . . 33.64 111.511 -178.371 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 45.8 pt -65.65 -34.42 70.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 C-N-CA 117.573 -1.651 . . . . 30.78 110.528 -176.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' TRP . . . . . . . . . . . . . 65.4 t-105 -63.11 -48.92 76.5 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 120.186 -0.606 . . . . 42.22 110.947 174.766 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -66.17 -42.22 89.23 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 119.907 -0.717 . . . . 37.9 111.318 -176.881 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 16.3 t -56.37 -40.77 68.82 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.37 0 CA-C-O 121.031 0.443 . . . . 35.09 110.412 174.878 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.8 -30.15 68.65 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 120.077 -0.649 . . . . 36.63 112.018 -178.737 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' HIS . . . . . . . . . . . . . 56.5 m80 -93.47 6.67 47.4 Favored 'General case' 0 C--O 1.233 0.223 0 N-CA-C 113.448 0.907 . . . . 47.72 113.448 179.678 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' HIS . . . . . . . . . . . . . 77.8 m80 -112.5 40.23 2.29 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 118.383 0.538 . . . . 48.79 110.414 165.483 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 44.0 42.7 4.94 Favored 'General case' 0 CA--C 1.521 -0.14 0 C-N-CA 123.987 0.915 . . . . 49.41 113.252 179.259 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 17.2 mt 69.88 15.84 7.82 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 123.925 0.89 . . . . 38.54 112.773 173.203 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -92.68 102.6 15.02 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 123.071 0.548 . . . . 49.28 110.441 179.248 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 59.7 t -68.56 -30.25 46.7 Favored 'Isoleucine or valine' 0 C--O 1.241 0.638 0 C-N-CA 119.476 -0.889 . . . . 38.89 110.792 -175.168 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 3.4 m -63.08 -48.27 79.32 Favored 'General case' 0 C--O 1.238 0.464 0 O-C-N 121.988 -0.445 . . . . 52.58 111.591 179.215 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.83 -34.16 77.71 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 120.321 -0.552 . . . . 44.23 111.338 179.385 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 10.9 m -67.67 -42.86 81.48 Favored 'General case' 0 C--O 1.237 0.444 0 N-CA-C 111.484 0.179 . . . . 50.84 111.484 178.454 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -57.92 -43.6 86.36 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 120.101 -0.64 . . . . 55.87 111.362 177.287 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' GLN . . . . . . . . . . . . . 15.4 mt-30 -70.12 -31.28 68.74 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 119.287 -0.965 . . . . 76.55 111.403 -178.996 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 3.5 m -60.08 -46.27 90.12 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-O 120.805 0.336 . . . . 54.36 111.794 173.071 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 65.7 mt -91.54 7.77 39.74 Favored 'General case' 0 C--O 1.238 0.455 0 N-CA-C 112.997 0.74 . . . . 61.95 112.997 -173.82 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' TYR . . . . . . . . . . . . . 33.7 m-85 45.93 60.97 2.88 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 122.94 1.352 . . . . 83.87 109.83 -178.134 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 4.8 t -150.28 177.34 10.04 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 113.54 -1.664 . . . . 55.89 106.623 179.482 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 39.6 p -88.76 150.32 23.01 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.723 0.773 . . . . 55.64 110.274 -178.458 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -64.36 -39.6 43.66 Favored Pre-proline 0 C--O 1.249 1.042 0 CA-C-O 118.125 -0.941 . . . . 53.34 111.842 175.191 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_exo -60.11 -31.19 92.96 Favored 'Trans proline' 0 C--O 1.236 0.423 0 CA-C-N 121.459 1.557 . . . . 49.08 114.973 171.339 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' GLY . . . . . . . . . . . . . . . -62.28 -44.75 97.24 Favored Glycine 0 C--N 1.334 0.436 0 C-N-CA 120.09 -1.053 . . . . 38.26 112.098 178.0 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' ILE . . . . . . . . . . . . . 47.4 mt -67.42 -43.51 87.56 Favored 'Isoleucine or valine' 0 C--O 1.24 0.572 0 CA-C-O 121.104 0.478 . . . . 47.03 110.037 -178.539 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 49.1 m -59.72 -44.92 93.52 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.622 -0.431 . . . . 39.9 110.453 179.58 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 35.5 tptt -58.55 -47.76 83.15 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 116.485 -0.325 . . . . 58.89 111.238 178.716 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 96.0 mm-40 -66.87 -28.39 68.29 Favored 'General case' 0 CA--C 1.516 -0.336 0 C-N-CA 119.071 -1.052 . . . . 36.39 112.387 -178.602 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 40.8 mt -72.91 -38.83 57.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 C-N-CA 119.419 -0.913 . . . . 30.33 110.608 179.587 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' ARG . . . . . 0.423 ' NE ' ' O ' ' B' ' 103' ' ' HOH . 2.3 mtp180 -73.88 -30.47 62.65 Favored 'General case' 0 C--O 1.239 0.543 0 C-N-CA 118.591 -1.244 . . . . 66.46 111.316 -177.923 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.25 -48.24 80.83 Favored 'General case' 0 CA--C 1.513 -0.461 0 C-N-CA 120.536 -0.465 . . . . 37.91 110.873 171.204 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 52.0 tp -56.31 -45.8 80.1 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 120.449 -0.5 . . . . 32.3 110.722 176.375 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 66.5 mt-10 -68.57 -34.42 75.79 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 118.238 -1.385 . . . . 37.67 111.584 -175.68 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' ASP . . . . . . . . . . . . . 73.5 m-20 -64.45 -44.26 91.69 Favored 'General case' 0 C--N 1.345 0.398 0 C-N-CA 120.861 -0.335 . . . . 42.04 111.741 174.556 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -61.19 -43.18 99.28 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 118.297 -1.361 . . . . 47.18 111.632 176.033 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 88.5 mt -75.18 -26.74 59.27 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 120.248 -0.581 . . . . 33.07 111.941 -179.512 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.03 17.56 77.21 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.512 -0.851 . . . . 34.45 114.466 -175.866 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' VAL . . . . . . . . . . . . . 27.6 m -134.2 151.57 32.53 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.419 0 N-CA-C 106.812 -1.551 . . . . 34.73 106.812 175.422 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -85.68 128.64 34.84 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 115.52 -0.764 . . . . 60.76 109.373 173.665 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 53.1 t -81.97 -33.64 11.94 Favored 'Isoleucine or valine' 0 C--O 1.243 0.761 0 C-N-CA 119.7 -0.8 . . . . 32.52 109.925 174.104 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' PHE . . . . . . . . . . . . . 72.5 m-85 -121.95 126.0 47.6 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 107.833 -1.173 . . . . 31.19 107.833 -176.003 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -69.57 138.66 53.39 Favored 'General case' 0 C--O 1.24 0.578 0 N-CA-C 108.905 -0.776 . . . . 36.55 108.905 169.721 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' ARG . . . . . 0.484 ' NH1' ' O ' ' B' ' 102' ' ' HOH . 6.4 mtt85 -120.44 156.33 31.65 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 121.996 0.903 . . . . 43.51 111.145 -176.324 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 8.5 t -147.64 93.27 2.19 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 104.768 -2.308 . . . . 49.64 104.768 176.731 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . 65.98 -151.55 51.96 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 119.5 -1.333 . . . . 39.12 111.188 -167.246 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . . . -81.36 63.25 5.6 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 122.682 1.23 . . . . 40.87 109.67 177.455 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' HIS . . . . . . . . . . . . . 83.0 t60 -162.54 134.6 5.42 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 115.291 -0.868 . . . . 38.42 109.468 -170.185 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 19.1 mt -93.83 133.59 37.07 Favored 'General case' 0 C--O 1.238 0.469 0 N-CA-C 108.518 -0.919 . . . . 32.28 108.518 172.985 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' THR . . . . . . . . . . . . . 80.4 p -103.99 -43.84 5.18 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.44 -0.504 . . . . 41.91 112.243 -178.278 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . . . -157.45 166.15 33.76 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 108.406 -0.961 . . . . 35.65 108.406 -179.294 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 57.8 t -83.97 135.35 25.0 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 114.934 -1.03 . . . . 34.23 108.914 169.931 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 21.1 p -74.82 157.55 85.6 Favored Pre-proline 0 N--CA 1.451 -0.41 0 C-N-CA 124.254 1.022 . . . . 32.59 111.796 -178.718 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo -45.58 -49.96 9.96 Favored 'Trans proline' 0 C--O 1.243 0.743 0 N-CA-C 113.374 0.49 . . . . 41.45 113.374 171.776 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.29 -40.28 95.63 Favored 'General case' 0 C--O 1.24 0.588 0 C-N-CA 120.183 -0.607 . . . . 29.85 111.182 177.449 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -63.35 -33.11 86.37 Favored Glycine 0 C--N 1.341 0.817 0 C-N-CA 121.053 -0.594 . . . . 29.75 113.58 -177.316 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' GLU . . . . . . . . . . . . . 89.7 mt-10 -59.25 -41.77 89.57 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 117.404 0.602 . . . . 61.37 110.866 175.439 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' ARG . . . . . . . . . . . . . 48.2 mtp180 -70.31 -46.73 63.66 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 120.902 0.382 . . . . 62.94 110.902 178.861 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' ILE . . . . . . . . . . . . . 90.7 mt -62.43 -44.76 99.58 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-O 121.165 0.507 . . . . 29.24 110.697 -177.725 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 54.7 mt -64.68 -41.87 93.45 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 O-C-N 121.471 -0.768 . . . . 25.94 110.717 178.726 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 59.8 t60 -58.33 -47.76 82.72 Favored 'General case' 0 C--O 1.238 0.483 0 C-N-CA 119.037 -1.065 . . . . 33.84 111.206 177.147 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' THR . . . . . . . . . . . . . 60.5 m -69.22 -32.81 72.31 Favored 'General case' 0 C--O 1.239 0.525 0 C-N-CA 120.746 -0.381 . . . . 36.27 111.633 -178.767 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.48 -39.37 90.67 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.652 -0.419 . . . . 38.01 110.788 172.743 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . -61.1 -44.1 98.59 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 119.665 -1.255 . . . . 33.59 113.163 174.942 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -60.26 -40.68 91.19 Favored 'General case' 0 C--O 1.238 0.495 0 C-N-CA 119.632 -0.827 . . . . 49.9 110.5 177.898 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' ILE . . . . . . . . . . . . . 60.1 mt -62.22 -48.34 88.86 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 N-CA-C 109.837 -0.431 . . . . 40.29 109.837 178.939 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' LEU . . . . . . . . . . . . . 36.8 mt -62.99 -34.86 78.45 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 119.874 -0.73 . . . . 29.04 110.609 -178.607 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 35.5 mtm180 -66.38 -39.2 88.94 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 119.579 -0.848 . . . . 50.74 111.037 173.85 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' LYS . . . . . . . . . . . . . 17.4 mttm -73.3 -34.24 65.62 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 118.693 -1.203 . . . . 44.52 111.622 -177.812 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 37.5 t -55.12 -41.22 58.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 C-N-CA 120.225 -0.59 . . . . 43.94 110.104 170.067 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 43.6 mm-40 -65.89 -35.12 79.77 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.183 -0.607 . . . . 61.88 111.654 177.977 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' SER . . . . . . . . . . . . . 43.0 m -64.19 -32.38 73.94 Favored 'General case' 0 CA--C 1.516 -0.364 0 C-N-CA 120.186 -0.606 . . . . 55.33 111.36 179.248 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 36.5 mt -62.93 -46.56 96.0 Favored 'Isoleucine or valine' 0 C--O 1.24 0.56 0 C-N-CA 120.594 -0.442 . . . . 44.28 111.096 176.694 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.4 -27.17 64.09 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 119.1 -1.04 . . . . 56.14 111.539 -179.745 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' GLN . . . . . . . . . . . . . 12.1 tt0 -70.41 -36.35 73.97 Favored 'General case' 0 C--O 1.241 0.627 0 C-N-CA 119.161 -1.016 . . . . 67.98 110.746 172.817 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 81.9 mt -64.16 -46.06 94.61 Favored 'Isoleucine or valine' 0 C--O 1.24 0.576 0 C-N-CA 120.195 -0.602 . . . . 53.62 110.401 173.056 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -54.51 -49.4 70.29 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.335 -0.546 . . . . 54.45 111.361 174.658 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' GLN . . . . . . . . . . . . . 79.6 mt-30 -62.57 -44.7 95.68 Favored 'General case' 0 C--O 1.238 0.495 0 C-N-CA 119.903 -0.719 . . . . 72.03 110.42 -172.852 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 10.9 tm-20 -52.21 -52.14 54.03 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-O 121.073 0.463 . . . . 85.54 110.898 175.632 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 42.4 m-85 -78.2 -12.72 60.02 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 113.53 0.937 . . . . 68.45 113.53 -173.399 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . . . . . . . . 0 C--O 1.238 0.451 0 CA-C-N 118.953 0.797 . . . . 71.06 110.009 174.321 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' GOL . . . . . 0.713 ' O1 ' ' O ' ' A' ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . 0.988 ' O ' ' NH2' ' A' ' 75' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . 0.713 ' O ' ' O1 ' ' A' ' 101' ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' HOH . . . . . 0.439 ' O ' ' NZ ' ' A' ' 81' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 ' B' B ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' HOH . . . . . 0.484 ' O ' ' NH1' ' B' ' 51' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' HOH . . . . . 0.423 ' O ' ' NE ' ' B' ' 38' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 91.8 p . . . . . 0 N--CA 1.45 -0.428 0 N-CA-C 113.408 0.892 . . . . 67.5 113.408 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.6 ptp -66.32 153.96 41.26 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 115.232 -0.895 . . . . 60.39 110.524 174.292 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -122.09 153.89 38.07 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.703 -0.68 . . . . 64.92 109.308 -175.101 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 3' ' ' LEU . . . . . 0.584 ' HG ' ' HG ' ' B' ' 3' ' ' LEU . 45.1 mt -57.4 -34.56 69.01 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 115.347 -0.842 . . . . 33.61 112.148 177.168 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 18.1 tt0 -61.67 -42.51 99.02 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 119.335 -0.946 . . . . 51.56 110.465 -178.532 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -67.04 -33.1 74.79 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 119.359 -0.936 . . . . 39.75 111.056 179.845 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.4 -41.44 89.32 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 119.68 -0.808 . . . . 34.68 111.31 175.294 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 7' ' ' ARG . . . . . 0.409 ' HA ' HD11 ' A' ' 74' ' ' LEU . 21.9 tpp180 -62.33 -36.71 83.04 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 120.469 -0.492 . . . . 39.4 111.432 176.186 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 9.7 m-30 -66.41 -47.01 74.63 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 112.122 0.416 . . . . 45.4 112.122 -177.448 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 45.0 pt -70.4 -32.72 51.17 Favored 'Isoleucine or valine' 0 C--O 1.242 0.678 0 C-N-CA 117.832 -1.547 . . . . 26.98 110.001 -176.27 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 72.2 t-105 -62.13 -47.74 83.21 Favored 'General case' 0 C--O 1.237 0.436 0 O-C-N 121.853 -0.53 . . . . 29.39 110.485 174.136 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -67.64 -43.94 79.12 Favored 'General case' 0 C--O 1.238 0.467 0 C-N-CA 120.593 -0.443 . . . . 33.64 111.687 -177.886 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 15.8 t -58.12 -39.48 73.09 Favored 'Isoleucine or valine' 0 C--O 1.238 0.486 0 C-N-CA 120.508 -0.477 . . . . 30.99 110.424 176.01 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.62 -28.81 66.24 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 119.024 -1.07 . . . . 23.54 111.172 179.317 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 42.1 m80 -93.51 5.27 52.16 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 113.188 0.81 . . . . 36.62 113.188 -178.944 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 75.6 m80 -114.25 41.19 2.33 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 123.898 0.879 . . . . 29.59 110.687 166.21 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 46.23 39.68 6.49 Favored 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 123.697 0.799 . . . . 40.06 112.702 178.775 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 27.7 mt 66.97 15.41 10.14 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.792 0.664 . . . . 27.51 112.792 177.346 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 47.2 t-20 -91.83 101.15 13.73 Favored 'General case' 0 C--O 1.232 0.167 0 N-CA-C 106.029 -1.841 . . . . 44.8 106.029 -179.583 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' VAL . . . . . 0.403 HG12 ' HG3' ' A' ' 30' ' ' GLN . 86.2 t -68.49 -30.44 47.45 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 CA-C-N 115.899 -0.591 . . . . 41.8 110.546 -175.027 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.7 t -64.69 -48.8 73.36 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-O 120.935 0.398 . . . . 49.81 111.083 177.315 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.48 -34.03 76.88 Favored 'General case' 0 C--O 1.235 0.331 0 O-C-N 122.275 -0.266 . . . . 38.64 111.628 177.886 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 12.2 m -68.02 -45.28 74.46 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.667 -0.413 . . . . 29.48 110.852 179.346 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -54.37 -43.5 71.41 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.733 -0.387 . . . . 36.3 110.932 179.106 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 21.8 tt0 -71.67 -32.47 67.91 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 117.607 -1.637 . . . . 69.07 111.749 179.94 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.8 m -58.24 -43.3 87.74 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 120.414 -0.514 . . . . 42.37 110.968 173.68 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 72.0 mt -89.98 6.15 43.39 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 112.863 0.69 . . . . 37.51 112.863 -176.21 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 93.6 m-85 47.83 60.65 3.41 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 122.06 0.933 . . . . 52.44 110.872 -177.39 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 5.2 t -150.72 176.35 11.11 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 107.535 -1.283 . . . . 58.4 107.535 178.917 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 43.4 p -87.92 149.45 24.06 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 109.066 -0.716 . . . . 60.19 109.066 -177.606 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' GLN . . . . . 0.403 ' HG3' HG12 ' A' ' 19' ' ' VAL . 42.6 tt0 -66.58 -43.08 50.01 Favored Pre-proline 0 C--O 1.245 0.833 0 CA-C-O 118.497 -0.763 . . . . 69.19 113.02 -179.61 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -58.18 -30.56 90.97 Favored 'Trans proline' 0 C--O 1.239 0.539 0 CA-C-N 121.202 1.465 . . . . 54.4 113.291 172.282 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -59.63 -46.14 94.48 Favored Glycine 0 C--N 1.333 0.387 0 C-N-CA 119.247 -1.454 . . . . 47.93 112.314 177.935 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 49.2 mt -67.5 -41.08 85.57 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 C-N-CA 119.599 -0.84 . . . . 45.16 110.493 -177.097 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 62.4 m -61.62 -35.08 76.85 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 120.187 -0.605 . . . . 43.77 112.046 179.335 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 28.1 ttmt -64.11 -51.41 64.1 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 119.153 -1.019 . . . . 76.37 110.524 177.998 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' GLN . . . . . 0.465 ' HA ' HD12 ' A' ' 39' ' ' LEU . 96.7 mm-40 -62.26 -30.85 71.41 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 119.868 -0.733 . . . . 61.48 111.889 -173.82 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 33.8 mt -72.59 -40.64 62.88 Favored 'Isoleucine or valine' 0 C--O 1.239 0.535 0 C-N-CA 119.556 -0.858 . . . . 44.64 110.472 -179.077 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 4.0 mmt85 -74.11 -27.88 61.09 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 118.966 -1.093 . . . . 70.82 112.424 178.993 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' LEU . . . . . 0.465 HD12 ' HA ' ' A' ' 36' ' ' GLN . 15.4 mt -60.36 -48.16 82.94 Favored 'General case' 0 CA--C 1.516 -0.327 0 C-N-CA 118.616 -1.234 . . . . 69.54 109.709 168.289 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 40' ' ' LEU . . . . . 0.42 ' O ' HD13 ' A' ' 44' ' ' LEU . 41.1 tp -57.79 -46.91 83.94 Favored 'General case' 0 C--O 1.238 0.495 0 C-N-CA 120.619 -0.432 . . . . 50.55 110.886 178.028 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 56.3 mt-10 -68.59 -34.78 76.39 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 119.059 -1.056 . . . . 55.64 110.855 -176.331 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 80.1 m-20 -66.93 -43.79 82.34 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 119.759 -0.776 . . . . 71.07 110.681 173.959 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -59.46 -42.93 93.14 Favored 'General case' 0 C--O 1.236 0.374 0 O-C-N 122.461 -0.149 . . . . 70.7 111.365 176.909 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' LEU . . . . . 0.42 HD13 ' O ' ' A' ' 40' ' ' LEU . 3.6 mp -79.45 -26.75 41.68 Favored 'General case' 0 C--N 1.347 0.461 0 N-CA-C 113.296 0.85 . . . . 51.87 113.296 176.808 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.37 20.85 78.49 Favored Glycine 0 C--N 1.333 0.377 0 N-CA-C 115.326 0.89 . . . . 59.5 115.326 -175.954 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 4.6 p -136.53 152.31 29.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 107.569 -1.271 . . . . 55.04 107.569 175.918 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -85.71 125.68 33.39 Favored 'General case' 0 CA--C 1.519 -0.216 0 C-N-CA 120.804 -0.359 . . . . 70.78 110.749 174.362 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 67.6 t -82.75 -34.11 11.33 Favored 'Isoleucine or valine' 0 C--O 1.238 0.499 0 C-N-CA 119.262 -0.975 . . . . 37.94 109.993 174.104 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 74.8 m-85 -125.4 124.73 42.11 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 123.425 0.69 . . . . 44.97 110.337 -177.501 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -67.65 142.0 56.53 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 120.321 -0.552 . . . . 37.38 109.875 169.541 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 5.0 mtt85 -121.73 160.22 25.0 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 122.009 0.909 . . . . 51.83 111.091 -177.875 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 8.3 t -144.26 95.47 2.72 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 102.466 -3.161 . . . . 46.69 102.466 174.804 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 67.02 -151.63 52.53 Favored Glycine 0 N--CA 1.444 -0.832 0 C-N-CA 119.341 -1.409 . . . . 49.92 110.946 -167.835 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . . . -83.1 62.44 6.6 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 122.451 1.12 . . . . 48.56 110.298 177.849 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 77.2 t60 -164.03 138.84 5.89 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 107.947 -1.131 . . . . 38.79 107.947 -168.952 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 44.3 mt -90.55 135.19 33.86 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 121.556 0.694 . . . . 37.69 111.412 176.947 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 79.5 p -106.59 -41.59 5.22 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 113.524 0.935 . . . . 37.47 113.524 -178.398 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . . . -159.83 164.88 33.29 Favored 'General case' 0 C--O 1.238 0.486 0 N-CA-C 109.061 -0.718 . . . . 41.3 109.061 178.434 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 67.4 t -80.83 134.28 27.58 Favored 'Isoleucine or valine' 0 C--O 1.234 0.255 0 CA-C-N 115.13 -0.941 . . . . 39.8 108.515 169.66 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 17.4 p -77.56 160.4 74.96 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-O 120.849 0.357 . . . . 38.45 110.849 179.548 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_exo -44.23 -48.51 9.62 Favored 'Trans proline' 0 C--O 1.238 0.501 0 N-CA-C 114.276 0.837 . . . . 43.7 114.276 169.877 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.8 -39.79 95.1 Favored 'General case' 0 C--O 1.238 0.476 0 C-N-CA 121.025 -0.27 . . . . 36.07 111.525 178.36 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -66.15 -33.62 85.82 Favored Glycine 0 C--N 1.336 0.544 0 C-N-CA 121.38 -0.438 . . . . 32.83 114.174 -179.123 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 83.5 mt-10 -61.03 -43.21 99.23 Favored 'General case' 0 C--O 1.238 0.477 0 C-N-CA 118.954 -1.098 . . . . 60.51 110.578 177.122 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ARG . . . . . 0.639 ' HB3' HD13 ' B' ' 83' ' ' ILE . . . -67.48 -47.05 71.18 Favored 'General case' 0 C--O 1.239 0.524 0 C-N-CA 120.602 -0.439 . . . . 57.93 110.873 177.915 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 57.9 mt -63.96 -44.99 98.04 Favored 'Isoleucine or valine' 0 C--O 1.237 0.417 0 N-CA-C 111.885 0.328 . . . . 29.92 111.885 -176.908 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 47.4 mt -64.5 -42.94 96.66 Favored 'Isoleucine or valine' 0 C--O 1.239 0.545 0 O-C-N 121.495 -0.753 . . . . 30.75 110.941 179.604 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 68.1 t60 -55.7 -46.74 77.59 Favored 'General case' 0 C--O 1.24 0.58 0 C-N-CA 120.362 -0.535 . . . . 26.09 111.213 178.125 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 69.8 m -68.37 -32.17 72.05 Favored 'General case' 0 C--O 1.237 0.437 0 N-CA-C 111.698 0.259 . . . . 36.84 111.698 179.181 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.15 -41.06 96.06 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 120.538 -0.465 . . . . 28.12 111.216 173.866 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -59.22 -41.22 96.64 Favored Glycine 0 C--N 1.337 0.62 0 C-N-CA 119.975 -1.107 . . . . 23.69 111.896 175.798 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -60.42 -42.9 96.96 Favored 'General case' 0 C--O 1.241 0.633 0 CA-C-N 116.896 0.348 . . . . 44.79 111.271 174.888 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 64.6 mt -63.01 -47.62 91.86 Favored 'Isoleucine or valine' 0 C--O 1.234 0.285 0 C-N-CA 119.827 -0.749 . . . . 22.02 110.068 177.638 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' LEU . . . . . 0.409 HD11 ' HA ' ' A' ' 7' ' ' ARG . 58.4 mt -63.28 -37.41 87.12 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.032 -0.667 . . . . 19.95 111.782 -178.129 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 87.0 mtm-85 -67.95 -35.99 79.34 Favored 'General case' 0 C--O 1.238 0.448 0 C-N-CA 118.502 -1.279 . . . . 33.71 110.657 177.797 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 16.9 mttm -70.73 -36.0 72.97 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 119.916 -0.714 . . . . 35.71 111.695 179.799 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 26.4 t -58.23 -41.67 81.58 Favored 'Isoleucine or valine' 0 C--O 1.238 0.478 0 CA-C-O 120.932 0.396 . . . . 30.02 110.725 171.41 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' GLU . . . . . 0.425 ' HG2' ' O ' ' A' ' 203' ' ' HOH . 10.9 mm-40 -65.34 -36.71 84.85 Favored 'General case' 0 C--O 1.237 0.437 0 O-C-N 121.858 -0.526 . . . . 55.17 111.969 178.092 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 79' ' ' SER . . . . . 0.459 ' O ' HG13 ' A' ' 83' ' ' ILE . 0.8 OUTLIER -68.03 -31.52 71.25 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 119.499 -0.88 . . . . 43.33 111.28 -178.941 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 43.8 mt -59.0 -40.83 81.55 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 C-N-CA 120.241 -0.584 . . . . 33.94 110.345 173.97 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' LYS . . . . . 0.43 ' NZ ' ' O ' ' A' ' 203' ' ' HOH . 10.1 mtpt -71.04 -27.97 64.04 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 120.198 -0.601 . . . . 47.0 111.777 179.171 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 82' ' ' GLN . . . . . 0.675 ' O ' ' HG3' ' A' ' 86' ' ' GLU . 34.1 mt-30 -75.38 -36.5 60.89 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 120.485 -0.486 . . . . 63.76 111.696 173.829 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 83' ' ' ILE . . . . . 0.459 HG13 ' O ' ' A' ' 79' ' ' SER . 73.8 mt -62.95 -46.26 96.77 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 C-N-CA 120.028 -0.669 . . . . 43.62 110.266 175.016 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -53.69 -49.65 67.57 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 121.024 0.44 . . . . 48.23 111.271 175.685 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -70.03 -30.87 68.27 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 112.36 0.504 . . . . 70.03 112.36 -173.6 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' GLU . . . . . 0.675 ' HG3' ' O ' ' A' ' 82' ' ' GLN . 86.7 mt-10 -64.91 -42.33 94.81 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 119.161 -1.015 . . . . 75.66 110.997 175.993 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 41.5 m-85 -74.7 -16.68 60.74 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 119.046 -1.061 . . . . 67.54 112.135 174.889 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.694 0 CA-C-O 121.739 0.781 . . . . 69.31 112.74 176.116 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 0' ' ' SER . . . . . . . . . . . . . 90.4 p . . . . . 0 C--O 1.232 0.142 0 CA-C-O 121.979 0.895 . . . . 48.12 111.269 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.5 ttm -64.45 151.09 45.16 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 114.959 -1.019 . . . . 46.83 111.106 173.959 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 2' ' ' LYS . . . . . 0.413 ' HB2' ' HG3' ' B' ' 5' ' ' GLN . 9.2 mmtp -121.51 149.22 43.41 Favored 'General case' 0 CA--C 1.513 -0.449 0 CA-C-N 116.135 -0.484 . . . . 47.8 109.969 -176.451 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 3' ' ' LEU . . . . . 0.584 ' HG ' ' HG ' ' A' ' 3' ' ' LEU . 50.2 mt -57.68 -34.97 69.96 Favored 'General case' 0 C--O 1.242 0.676 0 CA-C-N 115.636 -0.711 . . . . 30.3 111.236 175.121 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 53.7 tt0 -61.31 -43.62 98.57 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 119.61 -0.836 . . . . 45.17 110.666 -177.45 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 5' ' ' GLN . . . . . 0.413 ' HG3' ' HB2' ' B' ' 2' ' ' LYS . 11.5 mt-30 -67.19 -33.65 75.85 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 120.341 -0.544 . . . . 31.23 110.868 -179.167 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.47 -41.3 93.5 Favored 'General case' 0 C--O 1.239 0.502 0 C-N-CA 120.113 -0.635 . . . . 31.36 110.998 174.045 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 7' ' ' ARG . . . . . . . . . . . . . 21.1 tpp180 -62.83 -36.05 81.93 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.507 -0.477 . . . . 51.06 110.77 174.771 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 8' ' ' TYR . . . . . . . . . . . . . 11.3 m-30 -68.8 -48.79 62.71 Favored 'General case' 0 C--O 1.234 0.271 0 C-N-CA 119.932 -0.707 . . . . 33.64 111.511 -178.371 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 45.8 pt -65.65 -34.42 70.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 C-N-CA 117.573 -1.651 . . . . 30.78 110.528 -176.921 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' TRP . . . . . . . . . . . . . 65.4 t-105 -63.11 -48.92 76.5 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 120.186 -0.606 . . . . 42.22 110.947 174.766 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -66.17 -42.22 89.23 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 119.907 -0.717 . . . . 37.9 111.318 -176.881 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 16.3 t -56.37 -40.77 68.82 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.37 0 CA-C-O 121.031 0.443 . . . . 35.09 110.412 174.878 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.8 -30.15 68.65 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 120.077 -0.649 . . . . 36.63 112.018 -178.737 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' HIS . . . . . . . . . . . . . 56.5 m80 -93.47 6.67 47.4 Favored 'General case' 0 C--O 1.233 0.223 0 N-CA-C 113.448 0.907 . . . . 47.72 113.448 179.678 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' HIS . . . . . . . . . . . . . 77.8 m80 -112.5 40.23 2.29 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 118.383 0.538 . . . . 48.79 110.414 165.483 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 44.0 42.7 4.94 Favored 'General case' 0 CA--C 1.521 -0.14 0 C-N-CA 123.987 0.915 . . . . 49.41 113.252 179.259 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 17.2 mt 69.88 15.84 7.82 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 123.925 0.89 . . . . 38.54 112.773 173.203 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 18' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -92.68 102.6 15.02 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 123.071 0.548 . . . . 49.28 110.441 179.248 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' VAL . . . . . 0.461 HG12 ' HG2' ' B' ' 30' ' ' GLN . 59.7 t -68.56 -30.25 46.7 Favored 'Isoleucine or valine' 0 C--O 1.241 0.638 0 C-N-CA 119.476 -0.889 . . . . 38.89 110.792 -175.168 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 3.4 m -63.08 -48.27 79.32 Favored 'General case' 0 C--O 1.238 0.464 0 O-C-N 121.988 -0.445 . . . . 52.58 111.591 179.215 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.83 -34.16 77.71 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 120.321 -0.552 . . . . 44.23 111.338 179.385 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 10.9 m -67.67 -42.86 81.48 Favored 'General case' 0 C--O 1.237 0.444 0 N-CA-C 111.484 0.179 . . . . 50.84 111.484 178.454 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -57.92 -43.6 86.36 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 120.101 -0.64 . . . . 55.87 111.362 177.287 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' GLN . . . . . . . . . . . . . 15.4 mt-30 -70.12 -31.28 68.74 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 119.287 -0.965 . . . . 76.55 111.403 -178.996 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 3.5 m -60.08 -46.27 90.12 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-O 120.805 0.336 . . . . 54.36 111.794 173.071 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 65.7 mt -91.54 7.77 39.74 Favored 'General case' 0 C--O 1.238 0.455 0 N-CA-C 112.997 0.74 . . . . 61.95 112.997 -173.82 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' TYR . . . . . . . . . . . . . 33.7 m-85 45.93 60.97 2.88 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 122.94 1.352 . . . . 83.87 109.83 -178.134 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 4.8 t -150.28 177.34 10.04 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 113.54 -1.664 . . . . 55.89 106.623 179.482 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 39.6 p -88.76 150.32 23.01 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.723 0.773 . . . . 55.64 110.274 -178.458 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 30' ' ' GLN . . . . . 0.461 ' HG2' HG12 ' B' ' 19' ' ' VAL . 0.6 OUTLIER -64.36 -39.6 43.66 Favored Pre-proline 0 C--O 1.249 1.042 0 CA-C-O 118.125 -0.941 . . . . 53.34 111.842 175.191 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 31' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_exo -60.11 -31.19 92.96 Favored 'Trans proline' 0 C--O 1.236 0.423 0 CA-C-N 121.459 1.557 . . . . 49.08 114.973 171.339 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 32' ' ' GLY . . . . . . . . . . . . . . . -62.28 -44.75 97.24 Favored Glycine 0 C--N 1.334 0.436 0 C-N-CA 120.09 -1.053 . . . . 38.26 112.098 178.0 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 33' ' ' ILE . . . . . . . . . . . . . 47.4 mt -67.42 -43.51 87.56 Favored 'Isoleucine or valine' 0 C--O 1.24 0.572 0 CA-C-O 121.104 0.478 . . . . 47.03 110.037 -178.539 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 49.1 m -59.72 -44.92 93.52 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.622 -0.431 . . . . 39.9 110.453 179.58 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 35.5 tptt -58.55 -47.76 83.15 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 116.485 -0.325 . . . . 58.89 111.238 178.716 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 96.0 mm-40 -66.87 -28.39 68.29 Favored 'General case' 0 CA--C 1.516 -0.336 0 C-N-CA 119.071 -1.052 . . . . 36.39 112.387 -178.602 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 40.8 mt -72.91 -38.83 57.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 C-N-CA 119.419 -0.913 . . . . 30.33 110.608 179.587 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 38' ' ' ARG . . . . . . . . . . . . . 2.3 mtp180 -73.88 -30.47 62.65 Favored 'General case' 0 C--O 1.239 0.543 0 C-N-CA 118.591 -1.244 . . . . 66.46 111.316 -177.923 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.25 -48.24 80.83 Favored 'General case' 0 CA--C 1.513 -0.461 0 C-N-CA 120.536 -0.465 . . . . 37.91 110.873 171.204 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 52.0 tp -56.31 -45.8 80.1 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 120.449 -0.5 . . . . 32.3 110.722 176.375 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 66.5 mt-10 -68.57 -34.42 75.79 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 118.238 -1.385 . . . . 37.67 111.584 -175.68 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 42' ' ' ASP . . . . . . . . . . . . . 73.5 m-20 -64.45 -44.26 91.69 Favored 'General case' 0 C--N 1.345 0.398 0 C-N-CA 120.861 -0.335 . . . . 42.04 111.741 174.556 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -61.19 -43.18 99.28 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 118.297 -1.361 . . . . 47.18 111.632 176.033 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 88.5 mt -75.18 -26.74 59.27 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 120.248 -0.581 . . . . 33.07 111.941 -179.512 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.03 17.56 77.21 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.512 -0.851 . . . . 34.45 114.466 -175.866 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 46' ' ' VAL . . . . . . . . . . . . . 27.6 m -134.2 151.57 32.53 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.419 0 N-CA-C 106.812 -1.551 . . . . 34.73 106.812 175.422 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -85.68 128.64 34.84 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 115.52 -0.764 . . . . 60.76 109.373 173.665 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 53.1 t -81.97 -33.64 11.94 Favored 'Isoleucine or valine' 0 C--O 1.243 0.761 0 C-N-CA 119.7 -0.8 . . . . 32.52 109.925 174.104 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 49' ' ' PHE . . . . . . . . . . . . . 72.5 m-85 -121.95 126.0 47.6 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 107.833 -1.173 . . . . 31.19 107.833 -176.003 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -69.57 138.66 53.39 Favored 'General case' 0 C--O 1.24 0.578 0 N-CA-C 108.905 -0.776 . . . . 36.55 108.905 169.721 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 6.4 mtt85 -120.44 156.33 31.65 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 121.996 0.903 . . . . 43.51 111.145 -176.324 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 8.5 t -147.64 93.27 2.19 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 104.768 -2.308 . . . . 49.64 104.768 176.731 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . 65.98 -151.55 51.96 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 119.5 -1.333 . . . . 39.12 111.188 -167.246 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . . . -81.36 63.25 5.6 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 122.682 1.23 . . . . 40.87 109.67 177.455 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 55' ' ' HIS . . . . . . . . . . . . . 83.0 t60 -162.54 134.6 5.42 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 115.291 -0.868 . . . . 38.42 109.468 -170.185 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 19.1 mt -93.83 133.59 37.07 Favored 'General case' 0 C--O 1.238 0.469 0 N-CA-C 108.518 -0.919 . . . . 32.28 108.518 172.985 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 57' ' ' THR . . . . . . . . . . . . . 80.4 p -103.99 -43.84 5.18 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.44 -0.504 . . . . 41.91 112.243 -178.278 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . . . -157.45 166.15 33.76 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 108.406 -0.961 . . . . 35.65 108.406 -179.294 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 57.8 t -83.97 135.35 25.0 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 114.934 -1.03 . . . . 34.23 108.914 169.931 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 21.1 p -74.82 157.55 85.6 Favored Pre-proline 0 N--CA 1.451 -0.41 0 C-N-CA 124.254 1.022 . . . . 32.59 111.796 -178.718 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo -45.58 -49.96 9.96 Favored 'Trans proline' 0 C--O 1.243 0.743 0 N-CA-C 113.374 0.49 . . . . 41.45 113.374 171.776 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.29 -40.28 95.63 Favored 'General case' 0 C--O 1.24 0.588 0 C-N-CA 120.183 -0.607 . . . . 29.85 111.182 177.449 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -63.35 -33.11 86.37 Favored Glycine 0 C--N 1.341 0.817 0 C-N-CA 121.053 -0.594 . . . . 29.75 113.58 -177.316 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 64' ' ' GLU . . . . . . . . . . . . . 89.7 mt-10 -59.25 -41.77 89.57 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 117.404 0.602 . . . . 61.37 110.866 175.439 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 65' ' ' ARG . . . . . . . . . . . . . 48.2 mtp180 -70.31 -46.73 63.66 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 120.902 0.382 . . . . 62.94 110.902 178.861 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 66' ' ' ILE . . . . . . . . . . . . . 90.7 mt -62.43 -44.76 99.58 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-O 121.165 0.507 . . . . 29.24 110.697 -177.725 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 54.7 mt -64.68 -41.87 93.45 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 O-C-N 121.471 -0.768 . . . . 25.94 110.717 178.726 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 59.8 t60 -58.33 -47.76 82.72 Favored 'General case' 0 C--O 1.238 0.483 0 C-N-CA 119.037 -1.065 . . . . 33.84 111.206 177.147 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 69' ' ' THR . . . . . . . . . . . . . 60.5 m -69.22 -32.81 72.31 Favored 'General case' 0 C--O 1.239 0.525 0 C-N-CA 120.746 -0.381 . . . . 36.27 111.633 -178.767 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.48 -39.37 90.67 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.652 -0.419 . . . . 38.01 110.788 172.743 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . -61.1 -44.1 98.59 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 119.665 -1.255 . . . . 33.59 113.163 174.942 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -60.26 -40.68 91.19 Favored 'General case' 0 C--O 1.238 0.495 0 C-N-CA 119.632 -0.827 . . . . 49.9 110.5 177.898 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 73' ' ' ILE . . . . . . . . . . . . . 60.1 mt -62.22 -48.34 88.86 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 N-CA-C 109.837 -0.431 . . . . 40.29 109.837 178.939 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 74' ' ' LEU . . . . . . . . . . . . . 36.8 mt -62.99 -34.86 78.45 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 119.874 -0.73 . . . . 29.04 110.609 -178.607 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 35.5 mtm180 -66.38 -39.2 88.94 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 119.579 -0.848 . . . . 50.74 111.037 173.85 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 76' ' ' LYS . . . . . . . . . . . . . 17.4 mttm -73.3 -34.24 65.62 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 118.693 -1.203 . . . . 44.52 111.622 -177.812 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 37.5 t -55.12 -41.22 58.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 C-N-CA 120.225 -0.59 . . . . 43.94 110.104 170.067 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 43.6 mm-40 -65.89 -35.12 79.77 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.183 -0.607 . . . . 61.88 111.654 177.977 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 79' ' ' SER . . . . . 0.504 ' O ' HG13 ' B' ' 83' ' ' ILE . 43.0 m -64.19 -32.38 73.94 Favored 'General case' 0 CA--C 1.516 -0.364 0 C-N-CA 120.186 -0.606 . . . . 55.33 111.36 179.248 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 36.5 mt -62.93 -46.56 96.0 Favored 'Isoleucine or valine' 0 C--O 1.24 0.56 0 C-N-CA 120.594 -0.442 . . . . 44.28 111.096 176.694 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 81' ' ' LYS . . . . . 0.434 ' O ' ' HG3' ' B' ' 85' ' ' GLN . 0.0 OUTLIER -70.4 -27.17 64.09 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 119.1 -1.04 . . . . 56.14 111.539 -179.745 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 82' ' ' GLN . . . . . . . . . . . . . 12.1 tt0 -70.41 -36.35 73.97 Favored 'General case' 0 C--O 1.241 0.627 0 C-N-CA 119.161 -1.016 . . . . 67.98 110.746 172.817 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 83' ' ' ILE . . . . . 0.639 HD13 ' HB3' ' A' ' 65' ' ' ARG . 81.9 mt -64.16 -46.06 94.61 Favored 'Isoleucine or valine' 0 C--O 1.24 0.576 0 C-N-CA 120.195 -0.602 . . . . 53.62 110.401 173.056 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -54.51 -49.4 70.29 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.335 -0.546 . . . . 54.45 111.361 174.658 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 85' ' ' GLN . . . . . 0.434 ' HG3' ' O ' ' B' ' 81' ' ' LYS . 79.6 mt-30 -62.57 -44.7 95.68 Favored 'General case' 0 C--O 1.238 0.495 0 C-N-CA 119.903 -0.719 . . . . 72.03 110.42 -172.852 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 10.9 tm-20 -52.21 -52.14 54.03 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-O 121.073 0.463 . . . . 85.54 110.898 175.632 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 42.4 m-85 -78.2 -12.72 60.02 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 113.53 0.937 . . . . 68.45 113.53 -173.399 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . . . . . . . . 0 C--O 1.238 0.451 0 CA-C-N 118.953 0.797 . . . . 71.06 110.009 174.321 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 101' ' ' GOL . . . . . 0.686 ' O1 ' ' O ' ' A' ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . 0.686 ' O ' ' O1 ' ' A' ' 101' ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 203' ' ' HOH . . . . . 0.43 ' O ' ' NZ ' ' A' ' 81' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 ' B' B ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 91.8 p . . . . . 0 N--CA 1.45 -0.428 0 N-CA-C 113.408 0.892 . . . . 67.5 113.408 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.6 ptp -66.32 153.96 41.26 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 115.232 -0.895 . . . . 60.390000000000001 110.524 174.292 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -122.09 153.89 38.07 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.703 -0.68 . . . . 64.920000000000002 109.308 -175.101 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.584 ' HG ' ' HG ' ' B' ' 3' ' ' LEU . 45.1 mt -57.4 -34.56 69.01 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 115.347 -0.842 . . . . 33.609999999999999 112.148 177.168 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 18.1 tt0 -61.67 -42.51 99.02 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 119.335 -0.946 . . . . 51.560000000000002 110.465 -178.532 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -67.04 -33.1 74.79 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 119.359 -0.936 . . . . 39.75 111.056 179.845 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.4 -41.44 89.32 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 119.68 -0.808 . . . . 34.68 111.31 175.294 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.409 ' HA ' HD11 ' A' ' 74' ' ' LEU . 21.9 tpp180 -62.33 -36.71 83.04 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 120.469 -0.492 . . . . 39.399999999999999 111.432 176.186 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 9.7 m-30 -66.41 -47.01 74.63 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 112.122 0.416 . . . . 45.399999999999999 112.122 -177.448 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 45.0 pt -70.4 -32.72 51.17 Favored 'Isoleucine or valine' 0 C--O 1.242 0.678 0 C-N-CA 117.832 -1.547 . . . . 26.98 110.001 -176.27 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 72.2 t-105 -62.13 -47.74 83.21 Favored 'General case' 0 C--O 1.237 0.436 0 O-C-N 121.853 -0.53 . . . . 29.390000000000001 110.485 174.136 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -67.64 -43.94 79.12 Favored 'General case' 0 C--O 1.238 0.467 0 C-N-CA 120.593 -0.443 . . . . 33.640000000000001 111.687 -177.886 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 15.8 t -58.12 -39.48 73.09 Favored 'Isoleucine or valine' 0 C--O 1.238 0.486 0 C-N-CA 120.508 -0.477 . . . . 30.989999999999998 110.424 176.01 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.62 -28.81 66.24 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 119.024 -1.07 . . . . 23.539999999999999 111.172 179.317 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 42.1 m80 -93.51 5.27 52.16 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 113.188 0.81 . . . . 36.619999999999997 113.188 -178.944 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 75.6 m80 -114.25 41.19 2.33 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 123.898 0.879 . . . . 29.59 110.687 166.21 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 46.23 39.68 6.49 Favored 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 123.697 0.799 . . . . 40.060000000000002 112.702 178.775 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 27.7 mt 66.97 15.41 10.14 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.792 0.664 . . . . 27.510000000000002 112.792 177.346 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 47.2 t-20 -91.83 101.15 13.73 Favored 'General case' 0 C--O 1.232 0.167 0 N-CA-C 106.029 -1.841 . . . . 44.799999999999997 106.029 -179.583 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.403 HG12 ' HG3' ' A' ' 30' ' ' GLN . 86.2 t -68.49 -30.44 47.45 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 CA-C-N 115.899 -0.591 . . . . 41.799999999999997 110.546 -175.027 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.7 t -64.69 -48.8 73.36 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-O 120.935 0.398 . . . . 49.810000000000002 111.083 177.315 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.48 -34.03 76.88 Favored 'General case' 0 C--O 1.235 0.331 0 O-C-N 122.275 -0.266 . . . . 38.640000000000001 111.628 177.886 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 12.2 m -68.02 -45.28 74.46 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.667 -0.413 . . . . 29.48 110.852 179.346 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -54.37 -43.5 71.41 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.733 -0.387 . . . . 36.299999999999997 110.932 179.106 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 21.8 tt0 -71.67 -32.47 67.91 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 117.607 -1.637 . . . . 69.069999999999993 111.749 179.94 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.8 m -58.24 -43.3 87.74 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 120.414 -0.514 . . . . 42.369999999999997 110.968 173.68 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 72.0 mt -89.98 6.15 43.39 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 112.863 0.69 . . . . 37.509999999999998 112.863 -176.21 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 93.6 m-85 47.83 60.65 3.41 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 122.06 0.933 . . . . 52.439999999999998 110.872 -177.39 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 5.2 t -150.72 176.35 11.11 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 107.535 -1.283 . . . . 58.399999999999999 107.535 178.917 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 43.4 p -87.92 149.45 24.06 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 109.066 -0.716 . . . . 60.189999999999998 109.066 -177.606 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.403 ' HG3' HG12 ' A' ' 19' ' ' VAL . 6.7 tt0 -66.58 -43.08 50.01 Favored Pre-proline 0 C--O 1.245 0.833 0 CA-C-O 118.497 -0.763 . . . . 69.189999999999998 113.02 -179.61 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -58.18 -30.56 90.97 Favored 'Trans proline' 0 C--O 1.239 0.539 0 CA-C-N 121.202 1.465 . . . . 54.399999999999999 113.291 172.282 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -59.63 -46.14 94.48 Favored Glycine 0 C--N 1.333 0.387 0 C-N-CA 119.247 -1.454 . . . . 47.93 112.314 177.935 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 49.2 mt -67.5 -41.08 85.57 Favored 'Isoleucine or valine' 0 C--O 1.234 0.266 0 C-N-CA 119.599 -0.84 . . . . 45.159999999999997 110.493 -177.097 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 62.4 m -61.62 -35.08 76.85 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 120.187 -0.605 . . . . 43.770000000000003 112.046 179.335 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 28.1 ttmt -64.11 -51.41 64.1 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 119.153 -1.019 . . . . 76.370000000000005 110.524 177.998 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.465 ' HA ' HD12 ' A' ' 39' ' ' LEU . 96.7 mm-40 -62.26 -30.85 71.41 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 119.868 -0.733 . . . . 61.479999999999997 111.889 -173.82 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 33.8 mt -72.59 -40.64 62.88 Favored 'Isoleucine or valine' 0 C--O 1.239 0.535 0 C-N-CA 119.556 -0.858 . . . . 44.640000000000001 110.472 -179.077 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 4.0 mmt85 -74.11 -27.88 61.09 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 118.966 -1.093 . . . . 70.819999999999993 112.424 178.993 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.465 HD12 ' HA ' ' A' ' 36' ' ' GLN . 15.4 mt -60.36 -48.16 82.94 Favored 'General case' 0 CA--C 1.516 -0.327 0 C-N-CA 118.616 -1.234 . . . . 69.540000000000006 109.709 168.289 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.42 ' O ' HD13 ' A' ' 44' ' ' LEU . 41.1 tp -57.79 -46.91 83.94 Favored 'General case' 0 C--O 1.238 0.495 0 C-N-CA 120.619 -0.432 . . . . 50.549999999999997 110.886 178.028 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 56.3 mt-10 -68.59 -34.78 76.39 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 119.059 -1.056 . . . . 55.640000000000001 110.855 -176.331 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 80.1 m-20 -66.93 -43.79 82.34 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 119.759 -0.776 . . . . 71.069999999999993 110.681 173.959 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -59.46 -42.93 93.14 Favored 'General case' 0 C--O 1.236 0.374 0 O-C-N 122.461 -0.149 . . . . 70.700000000000003 111.365 176.909 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.42 HD13 ' O ' ' A' ' 40' ' ' LEU . 3.6 mp -79.45 -26.75 41.68 Favored 'General case' 0 C--N 1.347 0.461 0 N-CA-C 113.296 0.85 . . . . 51.869999999999997 113.296 176.808 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.37 20.85 78.49 Favored Glycine 0 C--N 1.333 0.377 0 N-CA-C 115.326 0.89 . . . . 59.5 115.326 -175.954 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 4.6 p -136.53 152.31 29.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 107.569 -1.271 . . . . 55.039999999999999 107.569 175.918 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -85.71 125.68 33.39 Favored 'General case' 0 CA--C 1.519 -0.216 0 C-N-CA 120.804 -0.359 . . . . 70.780000000000001 110.749 174.362 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 67.6 t -82.75 -34.11 11.33 Favored 'Isoleucine or valine' 0 C--O 1.238 0.499 0 C-N-CA 119.262 -0.975 . . . . 37.939999999999998 109.993 174.104 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 74.8 m-85 -125.4 124.73 42.11 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 123.425 0.69 . . . . 44.969999999999999 110.337 -177.501 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -67.65 142.0 56.53 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 120.321 -0.552 . . . . 37.380000000000003 109.875 169.541 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 5.0 mtt85 -121.73 160.22 25.0 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 122.009 0.909 . . . . 51.829999999999998 111.091 -177.875 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 8.3 t -144.26 95.47 2.72 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 102.466 -3.161 . . . . 46.689999999999998 102.466 174.804 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 67.02 -151.63 52.53 Favored Glycine 0 N--CA 1.444 -0.832 0 C-N-CA 119.341 -1.409 . . . . 49.920000000000002 110.946 -167.835 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . . . -83.1 62.44 6.6 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 122.451 1.12 . . . . 48.560000000000002 110.298 177.849 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 77.2 t60 -164.03 138.84 5.89 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 107.947 -1.131 . . . . 38.789999999999999 107.947 -168.952 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 44.3 mt -90.55 135.19 33.86 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 121.556 0.694 . . . . 37.689999999999998 111.412 176.947 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 79.5 p -106.59 -41.59 5.22 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 113.524 0.935 . . . . 37.469999999999999 113.524 -178.398 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . . . -159.83 164.88 33.29 Favored 'General case' 0 C--O 1.238 0.486 0 N-CA-C 109.061 -0.718 . . . . 41.299999999999997 109.061 178.434 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 67.4 t -80.83 134.28 27.58 Favored 'Isoleucine or valine' 0 C--O 1.234 0.255 0 CA-C-N 115.13 -0.941 . . . . 39.799999999999997 108.515 169.66 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 17.4 p -77.56 160.4 74.96 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-O 120.849 0.357 . . . . 38.450000000000003 110.849 179.548 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_exo -44.23 -48.51 9.62 Favored 'Trans proline' 0 C--O 1.238 0.501 0 N-CA-C 114.276 0.837 . . . . 43.700000000000003 114.276 169.877 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.8 -39.79 95.1 Favored 'General case' 0 C--O 1.238 0.476 0 C-N-CA 121.025 -0.27 . . . . 36.07 111.525 178.36 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -66.15 -33.62 85.82 Favored Glycine 0 C--N 1.336 0.544 0 C-N-CA 121.38 -0.438 . . . . 32.829999999999998 114.174 -179.123 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 83.5 mt-10 -61.03 -43.21 99.23 Favored 'General case' 0 C--O 1.238 0.477 0 C-N-CA 118.954 -1.098 . . . . 60.509999999999998 110.578 177.122 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.639 ' HB3' HD13 ' B' ' 83' ' ' ILE . . . -67.48 -47.05 71.18 Favored 'General case' 0 C--O 1.239 0.524 0 C-N-CA 120.602 -0.439 . . . . 57.93 110.873 177.915 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 57.9 mt -63.96 -44.99 98.04 Favored 'Isoleucine or valine' 0 C--O 1.237 0.417 0 N-CA-C 111.885 0.328 . . . . 29.920000000000002 111.885 -176.908 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 47.4 mt -64.5 -42.94 96.66 Favored 'Isoleucine or valine' 0 C--O 1.239 0.545 0 O-C-N 121.495 -0.753 . . . . 30.75 110.941 179.604 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 68.1 t60 -55.7 -46.74 77.59 Favored 'General case' 0 C--O 1.24 0.58 0 C-N-CA 120.362 -0.535 . . . . 26.09 111.213 178.125 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 69.8 m -68.37 -32.17 72.05 Favored 'General case' 0 C--O 1.237 0.437 0 N-CA-C 111.698 0.259 . . . . 36.840000000000003 111.698 179.181 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.15 -41.06 96.06 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 120.538 -0.465 . . . . 28.120000000000001 111.216 173.866 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -59.22 -41.22 96.64 Favored Glycine 0 C--N 1.337 0.62 0 C-N-CA 119.975 -1.107 . . . . 23.690000000000001 111.896 175.798 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -60.42 -42.9 96.96 Favored 'General case' 0 C--O 1.241 0.633 0 CA-C-N 116.896 0.348 . . . . 44.789999999999999 111.271 174.888 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 64.6 mt -63.01 -47.62 91.86 Favored 'Isoleucine or valine' 0 C--O 1.234 0.285 0 C-N-CA 119.827 -0.749 . . . . 22.02 110.068 177.638 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.409 HD11 ' HA ' ' A' ' 7' ' ' ARG . 58.4 mt -63.28 -37.41 87.12 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.032 -0.667 . . . . 19.949999999999999 111.782 -178.129 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 87.0 mtm-85 -67.95 -35.99 79.34 Favored 'General case' 0 C--O 1.238 0.448 0 C-N-CA 118.502 -1.279 . . . . 33.710000000000001 110.657 177.797 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 16.9 mttm -70.73 -36.0 72.97 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 119.916 -0.714 . . . . 35.710000000000001 111.695 179.799 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 26.4 t -58.23 -41.67 81.58 Favored 'Isoleucine or valine' 0 C--O 1.238 0.478 0 CA-C-O 120.932 0.396 . . . . 30.02 110.725 171.41 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.425 ' HG2' ' O ' ' A' ' 203' ' ' HOH . 10.9 mm-40 -65.34 -36.71 84.85 Favored 'General case' 0 C--O 1.237 0.437 0 O-C-N 121.858 -0.526 . . . . 55.170000000000002 111.969 178.092 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' SER . . . . . 0.459 ' O ' HG13 ' A' ' 83' ' ' ILE . 0.8 OUTLIER -68.03 -31.52 71.25 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 119.499 -0.88 . . . . 43.329999999999998 111.28 -178.941 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 43.8 mt -59.0 -40.83 81.55 Favored 'Isoleucine or valine' 0 C--O 1.239 0.51 0 C-N-CA 120.241 -0.584 . . . . 33.939999999999998 110.345 173.97 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.43 ' NZ ' ' O ' ' A' ' 203' ' ' HOH . 10.1 mtpt -71.04 -27.97 64.04 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 120.198 -0.601 . . . . 47.0 111.777 179.171 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' GLN . . . . . 0.675 ' O ' ' HG3' ' A' ' 86' ' ' GLU . 34.1 mt-30 -75.38 -36.5 60.89 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 120.485 -0.486 . . . . 63.759999999999998 111.696 173.829 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.459 HG13 ' O ' ' A' ' 79' ' ' SER . 73.8 mt -62.95 -46.26 96.77 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 C-N-CA 120.028 -0.669 . . . . 43.619999999999997 110.266 175.016 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -53.69 -49.65 67.57 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 121.024 0.44 . . . . 48.229999999999997 111.271 175.685 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -70.03 -30.87 68.27 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 112.36 0.504 . . . . 70.030000000000001 112.36 -173.6 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.675 ' HG3' ' O ' ' A' ' 82' ' ' GLN . 86.7 mt-10 -64.91 -42.33 94.81 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 119.161 -1.015 . . . . 75.659999999999997 110.997 175.993 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 41.5 m-85 -74.7 -16.68 60.74 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 119.046 -1.061 . . . . 67.540000000000006 112.135 174.889 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.694 0 CA-C-O 121.739 0.781 . . . . 69.310000000000002 112.74 176.116 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 0' ' ' SER . . . . . . . . . . . . . 90.4 p . . . . . 0 C--O 1.232 0.142 0 CA-C-O 121.979 0.895 . . . . 48.119999999999997 111.269 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.5 ttm -64.45 151.09 45.16 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 114.959 -1.019 . . . . 46.829999999999998 111.106 173.959 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 2' ' ' LYS . . . . . 0.533 ' H ' HE21 ' B' ' 5' ' ' GLN . 9.2 mmtp -121.51 149.22 43.41 Favored 'General case' 0 CA--C 1.513 -0.449 0 CA-C-N 116.135 -0.484 . . . . 47.799999999999997 109.969 -176.451 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' LEU . . . . . 0.584 ' HG ' ' HG ' ' A' ' 3' ' ' LEU . 50.2 mt -57.68 -34.97 69.96 Favored 'General case' 0 C--O 1.242 0.676 0 CA-C-N 115.636 -0.711 . . . . 30.300000000000001 111.236 175.121 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 53.7 tt0 -61.31 -43.62 98.57 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 119.61 -0.836 . . . . 45.170000000000002 110.666 -177.45 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' GLN . . . . . 0.533 HE21 ' H ' ' B' ' 2' ' ' LYS . 5.2 mt-30 -67.19 -33.65 75.85 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 120.341 -0.544 . . . . 31.23 110.868 -179.167 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.47 -41.3 93.5 Favored 'General case' 0 C--O 1.239 0.502 0 C-N-CA 120.113 -0.635 . . . . 31.359999999999999 110.998 174.045 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' ARG . . . . . . . . . . . . . 21.1 tpp180 -62.83 -36.05 81.93 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.507 -0.477 . . . . 51.060000000000002 110.77 174.771 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' TYR . . . . . . . . . . . . . 11.3 m-30 -68.8 -48.79 62.71 Favored 'General case' 0 C--O 1.234 0.271 0 C-N-CA 119.932 -0.707 . . . . 33.640000000000001 111.511 -178.371 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 45.8 pt -65.65 -34.42 70.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 C-N-CA 117.573 -1.651 . . . . 30.780000000000001 110.528 -176.921 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' TRP . . . . . . . . . . . . . 65.4 t-105 -63.11 -48.92 76.5 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 120.186 -0.606 . . . . 42.219999999999999 110.947 174.766 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -66.17 -42.22 89.23 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 119.907 -0.717 . . . . 37.899999999999999 111.318 -176.881 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 16.3 t -56.37 -40.77 68.82 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.37 0 CA-C-O 121.031 0.443 . . . . 35.090000000000003 110.412 174.878 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.8 -30.15 68.65 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 120.077 -0.649 . . . . 36.630000000000003 112.018 -178.737 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' HIS . . . . . . . . . . . . . 56.5 m80 -93.47 6.67 47.4 Favored 'General case' 0 C--O 1.233 0.223 0 N-CA-C 113.448 0.907 . . . . 47.719999999999999 113.448 179.678 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' HIS . . . . . . . . . . . . . 77.8 m80 -112.5 40.23 2.29 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 118.383 0.538 . . . . 48.789999999999999 110.414 165.483 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 44.0 42.7 4.94 Favored 'General case' 0 CA--C 1.521 -0.14 0 C-N-CA 123.987 0.915 . . . . 49.409999999999997 113.252 179.259 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 17.2 mt 69.88 15.84 7.82 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 123.925 0.89 . . . . 38.539999999999999 112.773 173.203 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -92.68 102.6 15.02 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 123.071 0.548 . . . . 49.280000000000001 110.441 179.248 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' VAL . . . . . 0.461 HG12 ' HG2' ' B' ' 30' ' ' GLN . 59.7 t -68.56 -30.25 46.7 Favored 'Isoleucine or valine' 0 C--O 1.241 0.638 0 C-N-CA 119.476 -0.889 . . . . 38.890000000000001 110.792 -175.168 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 3.4 m -63.08 -48.27 79.32 Favored 'General case' 0 C--O 1.238 0.464 0 O-C-N 121.988 -0.445 . . . . 52.579999999999998 111.591 179.215 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.83 -34.16 77.71 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 120.321 -0.552 . . . . 44.229999999999997 111.338 179.385 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 10.9 m -67.67 -42.86 81.48 Favored 'General case' 0 C--O 1.237 0.444 0 N-CA-C 111.484 0.179 . . . . 50.840000000000003 111.484 178.454 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -57.92 -43.6 86.36 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 120.101 -0.64 . . . . 55.869999999999997 111.362 177.287 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' GLN . . . . . . . . . . . . . 15.4 mt-30 -70.12 -31.28 68.74 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 119.287 -0.965 . . . . 76.549999999999997 111.403 -178.996 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' SER . . . . . . . . . . . . . 3.5 m -60.08 -46.27 90.12 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-O 120.805 0.336 . . . . 54.359999999999999 111.794 173.071 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 65.7 mt -91.54 7.77 39.74 Favored 'General case' 0 C--O 1.238 0.455 0 N-CA-C 112.997 0.74 . . . . 61.950000000000003 112.997 -173.82 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' TYR . . . . . . . . . . . . . 33.7 m-85 45.93 60.97 2.88 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 122.94 1.352 . . . . 83.870000000000005 109.83 -178.134 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 4.8 t -150.28 177.34 10.04 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 113.54 -1.664 . . . . 55.890000000000001 106.623 179.482 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 39.6 p -88.76 150.32 23.01 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.723 0.773 . . . . 55.640000000000001 110.274 -178.458 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' GLN . . . . . 0.461 ' HG2' HG12 ' B' ' 19' ' ' VAL . 0.6 OUTLIER -64.36 -39.6 43.66 Favored Pre-proline 0 C--O 1.249 1.042 0 CA-C-O 118.125 -0.941 . . . . 53.340000000000003 111.842 175.191 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_exo -60.11 -31.19 92.96 Favored 'Trans proline' 0 C--O 1.236 0.423 0 CA-C-N 121.459 1.557 . . . . 49.079999999999998 114.973 171.339 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' GLY . . . . . . . . . . . . . . . -62.28 -44.75 97.24 Favored Glycine 0 C--N 1.334 0.436 0 C-N-CA 120.09 -1.053 . . . . 38.259999999999998 112.098 178.0 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' ILE . . . . . . . . . . . . . 47.4 mt -67.42 -43.51 87.56 Favored 'Isoleucine or valine' 0 C--O 1.24 0.572 0 CA-C-O 121.104 0.478 . . . . 47.030000000000001 110.037 -178.539 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 49.1 m -59.72 -44.92 93.52 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.622 -0.431 . . . . 39.899999999999999 110.453 179.58 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 35.5 tptt -58.55 -47.76 83.15 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 116.485 -0.325 . . . . 58.890000000000001 111.238 178.716 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 96.0 mm-40 -66.87 -28.39 68.29 Favored 'General case' 0 CA--C 1.516 -0.336 0 C-N-CA 119.071 -1.052 . . . . 36.390000000000001 112.387 -178.602 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 40.8 mt -72.91 -38.83 57.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 C-N-CA 119.419 -0.913 . . . . 30.329999999999998 110.608 179.587 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' ARG . . . . . . . . . . . . . 2.3 mtp180 -73.88 -30.47 62.65 Favored 'General case' 0 C--O 1.239 0.543 0 C-N-CA 118.591 -1.244 . . . . 66.459999999999994 111.316 -177.923 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.25 -48.24 80.83 Favored 'General case' 0 CA--C 1.513 -0.461 0 C-N-CA 120.536 -0.465 . . . . 37.909999999999997 110.873 171.204 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 52.0 tp -56.31 -45.8 80.1 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 120.449 -0.5 . . . . 32.299999999999997 110.722 176.375 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 66.5 mt-10 -68.57 -34.42 75.79 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 118.238 -1.385 . . . . 37.670000000000002 111.584 -175.68 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' ASP . . . . . . . . . . . . . 73.5 m-20 -64.45 -44.26 91.69 Favored 'General case' 0 C--N 1.345 0.398 0 C-N-CA 120.861 -0.335 . . . . 42.039999999999999 111.741 174.556 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -61.19 -43.18 99.28 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 118.297 -1.361 . . . . 47.18 111.632 176.033 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 88.5 mt -75.18 -26.74 59.27 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 120.248 -0.581 . . . . 33.07 111.941 -179.512 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.03 17.56 77.21 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.512 -0.851 . . . . 34.450000000000003 114.466 -175.866 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' VAL . . . . . . . . . . . . . 27.6 m -134.2 151.57 32.53 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.419 0 N-CA-C 106.812 -1.551 . . . . 34.729999999999997 106.812 175.422 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -85.68 128.64 34.84 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 115.52 -0.764 . . . . 60.759999999999998 109.373 173.665 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 53.1 t -81.97 -33.64 11.94 Favored 'Isoleucine or valine' 0 C--O 1.243 0.761 0 C-N-CA 119.7 -0.8 . . . . 32.520000000000003 109.925 174.104 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' PHE . . . . . . . . . . . . . 72.5 m-85 -121.95 126.0 47.6 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 107.833 -1.173 . . . . 31.190000000000001 107.833 -176.003 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -69.57 138.66 53.39 Favored 'General case' 0 C--O 1.24 0.578 0 N-CA-C 108.905 -0.776 . . . . 36.549999999999997 108.905 169.721 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' ARG . . . . . . . . . . . . . 6.4 mtt85 -120.44 156.33 31.65 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 121.996 0.903 . . . . 43.509999999999998 111.145 -176.324 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' SER . . . . . . . . . . . . . 8.5 t -147.64 93.27 2.19 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 104.768 -2.308 . . . . 49.640000000000001 104.768 176.731 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' GLY . . . . . . . . . . . . . . . 65.98 -151.55 51.96 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 119.5 -1.333 . . . . 39.119999999999997 111.188 -167.246 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . . . -81.36 63.25 5.6 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 122.682 1.23 . . . . 40.869999999999997 109.67 177.455 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' HIS . . . . . . . . . . . . . 83.0 t60 -162.54 134.6 5.42 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 115.291 -0.868 . . . . 38.420000000000002 109.468 -170.185 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 19.1 mt -93.83 133.59 37.07 Favored 'General case' 0 C--O 1.238 0.469 0 N-CA-C 108.518 -0.919 . . . . 32.280000000000001 108.518 172.985 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' THR . . . . . . . . . . . . . 80.4 p -103.99 -43.84 5.18 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.44 -0.504 . . . . 41.909999999999997 112.243 -178.278 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . . . -157.45 166.15 33.76 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 108.406 -0.961 . . . . 35.649999999999999 108.406 -179.294 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 57.8 t -83.97 135.35 25.0 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 114.934 -1.03 . . . . 34.229999999999997 108.914 169.931 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' THR . . . . . . . . . . . . . 21.1 p -74.82 157.55 85.6 Favored Pre-proline 0 N--CA 1.451 -0.41 0 C-N-CA 124.254 1.022 . . . . 32.590000000000003 111.796 -178.718 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo -45.58 -49.96 9.96 Favored 'Trans proline' 0 C--O 1.243 0.743 0 N-CA-C 113.374 0.49 . . . . 41.450000000000003 113.374 171.776 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.29 -40.28 95.63 Favored 'General case' 0 C--O 1.24 0.588 0 C-N-CA 120.183 -0.607 . . . . 29.850000000000001 111.182 177.449 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -63.35 -33.11 86.37 Favored Glycine 0 C--N 1.341 0.817 0 C-N-CA 121.053 -0.594 . . . . 29.75 113.58 -177.316 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' GLU . . . . . . . . . . . . . 89.7 mt-10 -59.25 -41.77 89.57 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 117.404 0.602 . . . . 61.369999999999997 110.866 175.439 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' ARG . . . . . . . . . . . . . 48.2 mtp180 -70.31 -46.73 63.66 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 120.902 0.382 . . . . 62.939999999999998 110.902 178.861 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' ILE . . . . . . . . . . . . . 90.7 mt -62.43 -44.76 99.58 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-O 121.165 0.507 . . . . 29.239999999999998 110.697 -177.725 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 54.7 mt -64.68 -41.87 93.45 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 O-C-N 121.471 -0.768 . . . . 25.940000000000001 110.717 178.726 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' HIS . . . . . . . . . . . . . 59.8 t60 -58.33 -47.76 82.72 Favored 'General case' 0 C--O 1.238 0.483 0 C-N-CA 119.037 -1.065 . . . . 33.840000000000003 111.206 177.147 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' THR . . . . . . . . . . . . . 60.5 m -69.22 -32.81 72.31 Favored 'General case' 0 C--O 1.239 0.525 0 C-N-CA 120.746 -0.381 . . . . 36.270000000000003 111.633 -178.767 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.48 -39.37 90.67 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.652 -0.419 . . . . 38.009999999999998 110.788 172.743 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . -61.1 -44.1 98.59 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 119.665 -1.255 . . . . 33.590000000000003 113.163 174.942 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -60.26 -40.68 91.19 Favored 'General case' 0 C--O 1.238 0.495 0 C-N-CA 119.632 -0.827 . . . . 49.899999999999999 110.5 177.898 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' ILE . . . . . . . . . . . . . 60.1 mt -62.22 -48.34 88.86 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 N-CA-C 109.837 -0.431 . . . . 40.289999999999999 109.837 178.939 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' LEU . . . . . . . . . . . . . 36.8 mt -62.99 -34.86 78.45 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 119.874 -0.73 . . . . 29.039999999999999 110.609 -178.607 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 35.5 mtm180 -66.38 -39.2 88.94 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 119.579 -0.848 . . . . 50.740000000000002 111.037 173.85 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' LYS . . . . . . . . . . . . . 17.4 mttm -73.3 -34.24 65.62 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 118.693 -1.203 . . . . 44.520000000000003 111.622 -177.812 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 37.5 t -55.12 -41.22 58.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 C-N-CA 120.225 -0.59 . . . . 43.939999999999998 110.104 170.067 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 43.6 mm-40 -65.89 -35.12 79.77 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.183 -0.607 . . . . 61.880000000000003 111.654 177.977 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' SER . . . . . 0.504 ' O ' HG13 ' B' ' 83' ' ' ILE . 43.0 m -64.19 -32.38 73.94 Favored 'General case' 0 CA--C 1.516 -0.364 0 C-N-CA 120.186 -0.606 . . . . 55.329999999999998 111.36 179.248 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 36.5 mt -62.93 -46.56 96.0 Favored 'Isoleucine or valine' 0 C--O 1.24 0.56 0 C-N-CA 120.594 -0.442 . . . . 44.280000000000001 111.096 176.694 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' LYS . . . . . 0.434 ' O ' ' HG3' ' B' ' 85' ' ' GLN . 0.0 OUTLIER -70.4 -27.17 64.09 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 119.1 -1.04 . . . . 56.140000000000001 111.539 -179.745 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' GLN . . . . . . . . . . . . . 12.1 tt0 -70.41 -36.35 73.97 Favored 'General case' 0 C--O 1.241 0.627 0 C-N-CA 119.161 -1.016 . . . . 67.980000000000004 110.746 172.817 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' ILE . . . . . 0.639 HD13 ' HB3' ' A' ' 65' ' ' ARG . 81.9 mt -64.16 -46.06 94.61 Favored 'Isoleucine or valine' 0 C--O 1.24 0.576 0 C-N-CA 120.195 -0.602 . . . . 53.619999999999997 110.401 173.056 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -54.51 -49.4 70.29 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.335 -0.546 . . . . 54.450000000000003 111.361 174.658 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' GLN . . . . . 0.434 ' HG3' ' O ' ' B' ' 81' ' ' LYS . 79.6 mt-30 -62.57 -44.7 95.68 Favored 'General case' 0 C--O 1.238 0.495 0 C-N-CA 119.903 -0.719 . . . . 72.030000000000001 110.42 -172.852 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 10.9 tm-20 -52.21 -52.14 54.03 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-O 121.073 0.463 . . . . 85.540000000000006 110.898 175.632 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' PHE . . . . . . . . . . . . . 42.4 m-85 -78.2 -12.72 60.02 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 113.53 0.937 . . . . 68.450000000000003 113.53 -173.399 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . . . . . . . . 0 C--O 1.238 0.451 0 CA-C-N 118.953 0.797 . . . . 71.060000000000002 110.009 174.321 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' GOL . . . . . 0.686 ' O1 ' ' O ' ' A' ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . 0.686 ' O ' ' O1 ' ' A' ' 101' ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' HOH . . . . . 0.43 ' O ' ' NZ ' ' A' ' 81' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 ' B' B ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_