data_1fue_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 1fue _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 2' ' ' GLY . . . . . 0.458 ' N ' ' C ' ' A' ' 28' ' ' ASN . . . . . . . . 0 N--CA 1.48 1.605 0 N-CA-C 113.529 0.171 . . . . 59.66 113.529 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 89.5 mttt -57.09 -37.85 72.5 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 117.888 2.551 . . . . 55.71 117.888 -178.171 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 63.9 mt -74.78 110.89 10.02 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-N 118.063 0.392 . . . . 36.08 111.933 179.817 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -87.13 116.91 4.57 Favored Glycine 0 CA--C 1.523 0.569 0 C-N-CA 120.081 -1.057 . . . . 26.3 110.853 179.229 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 71.2 mt -106.98 98.94 7.58 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.369 0 N-CA-C 108.091 -1.078 . . . . 23.47 108.091 -179.961 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 21.0 m-85 -93.42 129.01 39.73 Favored 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 123.233 0.613 . . . . 26.5 111.851 -179.42 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 16.7 p90 -133.01 162.56 31.38 Favored 'General case' 0 C--O 1.241 0.649 0 CA-C-O 121.651 0.739 . . . . 24.85 110.725 179.629 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -141.11 136.45 7.53 Favored Glycine 0 N--CA 1.449 -0.497 0 N-CA-C 104.907 -3.277 . . . . 23.1 104.907 178.126 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 11.6 t -149.82 159.52 44.3 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 115.433 1.642 . . . . 30.0 115.433 -178.947 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 -114.49 -52.69 2.7 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 114.965 -1.016 . . . . 39.52 108.719 177.49 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 13.7 m -84.69 -46.56 11.35 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 120.882 0.372 . . . . 43.2 110.622 179.7 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 138.77 -11.03 3.42 Favored Glycine 0 N--CA 1.446 -0.699 0 C-N-CA 119.6 -1.286 . . . . 29.47 112.391 179.503 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -54.06 -53.14 57.15 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.822 -0.351 . . . . 31.91 111.784 179.86 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.4 -47.34 72.84 Favored 'General case' 0 C--O 1.221 -0.438 0 C-N-CA 120.165 -0.614 . . . . 21.34 111.553 -179.163 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -56.3 -44.91 80.35 Favored 'General case' 0 CA--C 1.515 -0.377 0 CA-C-O 121.179 0.514 . . . . 35.11 110.026 -179.322 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.72 -38.54 91.35 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.991 -0.549 . . . . 20.71 110.683 -179.275 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 43.8 mm -65.83 -47.61 85.06 Favored 'Isoleucine or valine' 0 C--O 1.237 0.404 0 CA-C-O 121.026 0.441 . . . . 25.86 110.013 179.219 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -54.33 -39.59 67.2 Favored 'General case' 0 CA--C 1.511 -0.549 0 CA-C-N 115.968 -0.56 . . . . 21.39 109.98 179.791 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 47.8 mm-40 -67.96 -37.88 82.09 Favored 'General case' 0 C--N 1.33 -0.26 0 O-C-N 123.869 0.731 . . . . 26.65 112.458 -179.599 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 30.8 ttmt -70.07 -34.14 72.81 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 115.425 -0.807 . . . . 53.58 109.557 -179.429 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 57.3 mt -71.36 -45.25 70.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 C-N-CA 119.938 -0.705 . . . . 29.21 109.545 179.535 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 42.3 t -49.29 -54.64 15.93 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 116.34 -0.391 . . . . 30.17 110.741 178.98 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -59.88 -36.02 76.05 Favored 'General case' 0 C--O 1.222 -0.348 0 N-CA-C 112.563 0.579 . . . . 55.78 112.563 -178.947 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -79.09 -25.53 43.04 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 114.112 1.153 . . . . 40.53 114.112 -178.493 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 10.7 tp -100.91 -26.43 3.6 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.377 0 CA-C-O 120.949 0.404 . . . . 36.44 111.371 -178.749 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 67.76 171.68 5.87 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.795 -0.717 . . . . 30.98 113.543 179.774 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ASN . . . . . 0.458 ' C ' ' N ' ' A' ' 2' ' ' GLY . 2.7 t-20 44.1 56.78 4.58 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.629 -0.508 . . . . 48.26 109.629 179.73 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -143.16 157.72 44.26 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 114.742 1.386 . . . . 33.74 114.742 -179.158 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 83.2 tt0 -125.96 122.3 35.54 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 115.529 -0.76 . . . . 40.97 109.071 179.517 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 65.0 t -85.53 136.08 23.58 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.378 0 N-CA-C 108.138 -1.06 . . . . 27.92 108.138 179.747 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 45.2 t -138.98 125.17 23.57 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.361 0 N-CA-C 112.02 0.378 . . . . 32.05 112.02 -179.013 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 10.6 t0 -75.62 125.34 28.84 Favored 'General case' 0 C--O 1.234 0.267 0 N-CA-C 106.482 -1.673 . . . . 47.27 106.482 177.792 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 34.7 m -62.74 -30.85 50.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 N-CA-C 112.273 0.471 . . . . 31.12 112.273 -178.793 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -59.25 -10.26 2.82 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.103 0.408 . . . . 40.76 112.103 -179.66 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 47.3 mttp -124.66 -8.63 7.36 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-O 120.613 0.244 . . . . 65.85 110.652 -179.727 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -68.81 168.16 14.0 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.971 0.415 . . . . 44.44 111.801 -178.823 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 76.4 p -139.49 163.38 32.69 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 106.596 -1.631 . . . . 41.51 106.596 179.004 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -62.31 -42.83 99.7 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 123.409 0.443 . . . . 49.04 110.209 178.894 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 8.1 mp0 -61.01 -47.64 85.51 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 123.197 0.599 . . . . 74.3 111.424 -179.873 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -61.57 -46.97 87.62 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.763 -0.828 . . . . 40.98 108.763 179.3 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 84.3 t80 -52.74 -46.34 67.39 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.461 -0.791 . . . . 38.68 112.98 -179.817 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 71.9 m-20 -74.06 -4.06 33.17 Favored 'General case' 0 CA--C 1.513 -0.458 0 N-CA-C 112.735 0.643 . . . . 46.04 112.735 -179.016 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -74.27 -11.84 81.99 Favored Glycine 0 CA--C 1.524 0.603 0 C-N-CA 120.208 -0.996 . . . . 38.04 111.528 178.68 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 36.4 m-85 -110.24 150.43 28.71 Favored 'General case' 0 CA--C 1.51 -0.584 0 N-CA-C 109.411 -0.588 . . . . 31.38 109.411 179.89 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 69.3 p -105.93 -18.42 14.05 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 107.455 -1.313 . . . . 31.17 107.455 178.803 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -125.48 128.82 48.63 Favored 'General case' 0 C--O 1.239 0.53 0 N-CA-C 108.255 -1.017 . . . . 62.92 108.255 179.424 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 4.6 t -141.17 147.41 22.45 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.453 0 N-CA-C 115.542 1.682 . . . . 44.7 115.542 -177.143 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 86.8 mt -123.99 113.23 36.0 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.297 0 N-CA-C 108.139 -1.06 . . . . 23.79 108.139 177.719 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -98.91 105.11 17.21 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 114.469 1.285 . . . . 22.42 114.469 -176.404 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -105.5 119.76 55.2 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.516 0 N-CA-C 108.068 -1.086 . . . . 18.37 108.068 -179.423 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -138.26 129.5 15.67 Favored Pre-proline 0 N--CA 1.442 -0.867 0 N-CA-C 114.876 1.435 . . . . 19.29 114.876 -177.196 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -80.62 153.0 20.14 Favored 'Trans proline' 0 CA--C 1.536 0.625 0 C-N-CA 122.889 2.393 . . . . 32.54 108.593 179.228 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 18.3 m -92.44 122.74 35.17 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 113.402 0.89 . . . . 39.86 113.402 -178.902 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -84.43 178.57 7.69 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.193 0.521 . . . . 40.28 110.933 179.408 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -54.53 142.73 32.82 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.503 -0.856 . . . . 53.13 113.172 -179.285 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . 76.61 -7.32 1.86 Allowed 'General case' 0 C--O 1.234 0.261 0 N-CA-C 112.92 0.711 . . . . 53.9 112.92 179.221 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 101.09 5.07 53.59 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 119.987 -1.101 . . . . 52.19 111.735 -179.987 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 68.7 m-20 -82.77 166.15 19.29 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-O 121.501 0.667 . . . . 58.97 112.406 179.982 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -72.54 145.55 47.37 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 114.44 1.274 . . . . 44.47 114.44 -178.246 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 21.3 tm0? -53.2 145.33 13.9 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 103.485 -2.783 . . . . 45.96 103.485 177.467 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 1.4 m -45.85 -61.02 1.9 Allowed 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 115.654 1.724 . . . . 39.83 115.654 -177.846 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 63.0 m-20 -45.67 -44.66 13.55 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.011 0.434 . . . . 47.42 112.023 -179.59 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 2.9 m95 -68.87 -44.01 74.16 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 113.833 1.049 . . . . 33.49 113.833 -178.431 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -57.66 -37.96 74.28 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.095 -0.642 . . . . 77.74 112.389 179.95 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 77.8 m-20 -75.96 -34.77 59.84 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.142 0.423 . . . . 50.6 112.142 -179.638 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 40.7 t80 -73.87 -41.33 62.35 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.298 -0.561 . . . . 33.92 109.618 179.292 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 36.0 tp -63.84 -33.09 74.92 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.999 -0.546 . . . . 22.61 111.166 -179.453 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -65.38 -17.44 64.12 Favored Glycine 0 C--O 1.223 -0.579 0 CA-C-N 115.684 -0.689 . . . . 27.52 113.716 -179.788 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.0 p -97.62 5.88 48.8 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 117.627 0.714 . . . . 39.18 109.175 179.477 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' LEU . . . . . 0.473 ' O ' ' NZ ' ' A' ' 106' ' ' LYS . 67.8 mt -115.57 146.04 42.12 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.233 -0.44 . . . . 29.22 111.723 -179.921 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -114.9 173.81 6.29 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 107.672 -1.233 . . . . 59.28 107.672 178.415 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.19 -36.21 83.48 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.203 -0.453 . . . . 32.68 110.994 179.197 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 21.5 p -55.03 -33.31 62.54 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 112.083 0.401 . . . . 36.83 112.083 179.78 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 62.3 m-20 -68.39 -19.72 64.63 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 113.004 0.742 . . . . 34.66 113.004 178.659 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 71.6 m-85 -95.73 -24.6 16.44 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 119.75 -0.78 . . . . 22.89 110.352 -179.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -34.59 -56.84 0.53 Allowed 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 117.225 2.306 . . . . 32.0 117.225 -177.774 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 21.1 p-10 -89.78 18.3 5.74 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 117.662 2.467 . . . . 45.36 117.662 -176.848 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 50.5 mttp -116.38 165.73 12.87 Favored 'General case' 0 C--N 1.323 -0.565 0 C-N-CA 119.064 -1.054 . . . . 34.3 113.288 -178.914 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 72.0 m -109.03 127.49 54.14 Favored 'General case' 0 N--CA 1.448 -0.575 1 N-CA-C 99.395 -4.298 . . . . 29.35 99.395 176.352 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 17.0 mt -121.39 139.27 49.07 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.51 0 N-CA-C 118.151 2.649 . . . . 29.08 118.151 -174.837 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -122.69 131.21 8.19 Favored Glycine 0 CA--C 1.525 0.712 0 N-CA-C 107.54 -2.224 . . . . 26.96 107.54 177.506 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 91.2 mt -112.23 131.36 55.53 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 117.591 0.696 . . . . 33.22 112.378 -179.645 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 89.5 t -129.3 111.01 21.47 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.587 0 N-CA-C 108.273 -1.01 . . . . 22.88 108.273 179.419 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -107.52 151.51 16.92 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.037 -1.078 . . . . 29.24 112.82 179.801 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 47.2 mt -113.77 141.5 47.21 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 108.584 -0.895 . . . . 35.1 108.584 178.766 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -159.46 171.49 35.92 Favored Glycine 0 CA--C 1.52 0.369 0 C-N-CA 119.794 -1.193 . . . . 42.67 115.767 179.657 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ASP . . . . . 0.468 ' OD1' ' ND2' ' A' ' 143' ' ' ASN . 43.5 t0 -120.65 90.32 3.3 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 106.429 -1.693 . . . . 45.88 106.429 179.794 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' GLN . . . . . 0.418 ' NE2' ' OE1' ' A' ' 144' ' ' GLN . 13.0 pt20 -63.97 -25.43 68.13 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 116.212 1.93 . . . . 53.87 116.212 -178.309 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 77.7 m-20 -82.14 -54.6 5.14 Favored 'General case' 0 CA--C 1.517 -0.305 0 C-N-CA 120.138 -0.625 . . . . 62.83 110.686 179.294 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 60.0 m -68.13 -28.09 67.02 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 113.438 0.903 . . . . 59.78 113.438 179.964 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' TYR . . . . . . . . . . . . . 52.2 m-85 -128.96 64.99 1.45 Allowed 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 111.529 0.196 . . . . 59.37 111.529 -178.62 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' SER . . . . . 0.435 ' O ' ' N ' ' A' ' 124' ' ' ALA . 73.6 m -58.29 -24.64 60.15 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 115.079 1.511 . . . . 62.26 115.079 -178.857 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' GLU . . . . . 0.502 ' O ' ' OG1' ' A' ' 95' ' ' THR . 17.8 mt-10 -117.33 51.04 1.05 Allowed 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 119.651 -0.819 . . . . 92.13 112.505 -178.868 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' THR . . . . . 0.506 ' O ' ' CG2' ' A' ' 95' ' ' THR . 30.4 m 178.22 22.5 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 106.011 -1.848 . . . . 55.38 106.011 -178.88 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' PHE . . . . . . . . . . . . . 19.4 t80 -58.35 109.15 0.72 Allowed 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 116.765 2.135 . . . . 47.63 116.765 -177.933 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . 49.72 56.42 7.88 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 115.206 -0.906 . . . . 44.14 113.392 177.999 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -87.7 -19.24 27.9 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 114.74 1.385 . . . . 43.03 114.74 -179.207 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -42.36 -56.68 4.0 Favored Glycine 0 C--N 1.332 0.309 0 C-N-CA 120.175 -1.012 . . . . 37.27 110.691 179.613 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 13.6 mm -40.84 -44.22 0.65 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.574 0 C-N-CA 123.489 0.715 . . . . 38.3 111.892 179.916 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 79.0 t80 -53.53 -43.07 68.06 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.675 -0.693 . . . . 30.25 111.165 -179.373 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -63.21 -40.64 98.06 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.405 -0.518 . . . . 42.02 111.157 -179.133 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 69.8 mt -62.41 -44.65 99.46 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 N-CA-C 105.577 -2.008 . . . . 27.42 105.577 177.202 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' TYR . . . . . . . . . . . . . 73.1 t80 -51.15 -33.04 25.11 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 113.904 1.076 . . . . 39.37 113.904 -179.248 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -53.9 -29.42 41.86 Favored 'General case' 0 CA--C 1.516 -0.35 0 N-CA-C 112.633 0.605 . . . . 52.97 112.633 -179.737 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' LYS . . . . . 0.473 ' NZ ' ' O ' ' A' ' 71' ' ' LEU . 70.1 mttt -109.5 -35.18 6.3 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 118.855 -1.138 . . . . 22.49 109.833 178.974 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -60.54 -27.74 67.89 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 114.229 1.196 . . . . 20.61 114.229 -178.621 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 40.8 pttt -58.53 -13.53 5.87 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 120.87 -0.332 . . . . 31.33 111.419 -179.457 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -70.48 -23.66 62.72 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-N 116.342 -0.39 . . . . 24.09 111.568 178.748 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -107.01 -162.03 21.93 Favored Glycine 0 N--CA 1.45 -0.369 0 N-CA-C 109.069 -1.612 . . . . 30.44 109.069 179.317 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 81.6 tttt -93.27 104.82 16.96 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 117.532 0.666 . . . . 38.86 112.002 179.683 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 93.4 t -91.27 138.15 20.28 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.318 0 CA-C-O 120.996 0.427 . . . . 39.93 111.345 179.528 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 12.9 m -146.84 154.03 12.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 N-CA-C 109.458 -0.571 . . . . 38.06 109.458 -179.102 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 107.41 18.46 10.26 Favored Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 119.863 -1.161 . . . . 34.84 112.942 179.773 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' GLN . . . . . 0.507 ' N ' ' OE1' ' A' ' 115' ' ' GLN . 13.0 mp0 -58.86 138.63 57.2 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 106.585 -1.635 . . . . 60.46 106.585 178.324 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 33.5 p -123.21 153.42 40.12 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 114.215 1.191 . . . . 43.11 114.215 -177.94 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 26.7 t -67.54 158.64 31.5 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 114.881 -1.054 . . . . 55.6 108.934 179.18 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 4.7 t -97.57 10.82 38.88 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.939 -0.573 . . . . 63.81 111.645 -179.829 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -76.46 124.26 27.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.122 -0.49 . . . . 80.56 111.238 179.758 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 108.61 7.16 30.17 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.65 -0.786 . . . . 66.01 111.545 179.94 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -124.52 154.27 40.82 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.998 0.428 . . . . 57.87 111.63 -179.8 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 19.0 p-80 -135.49 106.51 6.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.713 -0.676 . . . . 69.5 110.349 179.151 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 4.7 p90 -156.87 169.76 24.03 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 108.66 -0.867 . . . . 59.91 108.66 -179.06 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' ALA . . . . . 0.435 ' N ' ' O ' ' A' ' 93' ' ' SER . . . -90.51 -69.65 0.72 Allowed 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.339 -0.391 . . . . 69.31 111.442 179.915 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -127.61 167.1 16.84 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.944 0.72 . . . . 67.5 112.944 -179.418 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 43.7 t 179.7 116.01 0.05 OUTLIER 'General case' 0 C--O 1.236 0.358 0 CA-C-N 115.519 -0.764 . . . . 60.24 111.025 179.695 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -59.25 -20.15 51.79 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.001 0.429 . . . . 58.85 110.299 179.346 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -64.34 -5.78 5.81 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 113.29 0.848 . . . . 33.62 113.29 179.957 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 37.2 t -103.16 117.2 48.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 120.835 0.35 . . . . 50.98 111.064 179.883 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -127.81 119.0 24.75 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 108.737 -0.838 . . . . 83.45 108.737 179.782 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 74.21 37.54 48.43 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.168 -1.015 . . . . 57.86 111.57 -179.552 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 60.64 19.95 55.48 Favored Glycine 0 C--N 1.332 0.342 0 C-N-CA 121.345 -0.455 . . . . 60.22 112.425 -179.725 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 4.5 tppp? -135.27 157.77 46.07 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.231 0.539 . . . . 67.48 110.08 -179.464 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -82.52 129.22 34.87 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.289 -0.634 . . . . 47.01 109.289 178.982 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 23.8 t -56.54 -20.5 11.02 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.663 0 N-CA-C 113.282 0.845 . . . . 41.27 113.282 179.767 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -167.78 -166.65 27.21 Favored Glycine 0 C--O 1.226 -0.357 0 N-CA-C 110.191 -1.164 . . . . 38.23 110.191 179.243 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 62.6 tp -72.48 137.09 46.13 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 118.084 0.942 . . . . 32.06 110.443 179.662 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 39.4 t -118.65 134.67 61.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.356 -0.383 . . . . 33.71 110.254 178.598 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' ILE . . . . . . . . . . . . . 25.0 mm -126.55 144.47 36.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 121.211 0.529 . . . . 37.31 111.872 -179.128 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 13.8 t0 -126.46 107.32 10.15 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 105.9 -1.889 . . . . 38.0 105.9 179.702 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -97.69 -10.62 24.66 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.145 0.424 . . . . 42.96 112.145 -179.764 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -93.53 -20.93 19.78 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.373 -0.602 . . . . 58.87 109.373 179.261 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' ASN . . . . . 0.468 ' ND2' ' OD1' ' A' ' 88' ' ' ASP . 64.1 m-20 -128.54 -30.59 2.32 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 115.708 1.744 . . . . 50.89 115.708 -178.232 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' GLN . . . . . 0.418 ' OE1' ' NE2' ' A' ' 89' ' ' GLN . 80.6 mt-30 -127.67 41.69 3.46 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 115.932 1.827 . . . . 66.41 115.932 -179.074 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -55.96 -26.45 48.13 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.614 -0.266 . . . . 62.08 111.116 179.507 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -72.69 -4.52 31.7 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 115.306 1.595 . . . . 62.38 115.306 -178.592 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 47.9 mt -116.8 -7.27 11.49 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 114.172 1.175 . . . . 52.29 114.172 -178.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 41.3 m -56.57 -60.7 3.16 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 114.667 1.358 . . . . 36.9 114.667 -179.368 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 57.9 m-20 -50.36 -33.09 19.18 Favored 'General case' 0 CA--C 1.514 -0.419 0 N-CA-C 114.799 1.407 . . . . 53.62 114.799 -178.21 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -83.65 -38.24 21.77 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 119.415 -0.914 . . . . 82.48 110.268 179.873 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 94.9 mtt180 -62.05 -46.61 88.41 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-O 120.886 0.374 . . . . 48.75 111.934 179.646 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' ILE . . . . . . . . . . . . . 41.2 mt -59.54 -41.33 84.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 N-CA-C 107.338 -1.356 . . . . 29.01 107.338 178.979 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -60.5 -48.9 79.74 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.501 -0.772 . . . . 37.27 112.237 179.837 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -65.78 -40.16 91.7 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.589 -0.444 . . . . 65.13 110.093 179.648 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' TRP . . . . . . . . . . . . . 12.2 t90 -62.53 -51.5 67.15 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 121.157 0.503 . . . . 36.75 111.003 -179.847 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' VAL . . . . . . . . . . . . . 73.0 t -53.76 -40.63 44.2 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 N-CA-C 107.979 -1.119 . . . . 44.32 107.979 179.132 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 62.6 mm-40 -60.03 -51.97 67.39 Favored 'General case' 0 C--N 1.331 -0.22 0 O-C-N 123.597 0.561 . . . . 65.37 111.474 179.292 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -60.27 -53.18 60.79 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 113.555 0.946 . . . . 57.07 113.555 -179.64 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 10.9 t -82.63 -15.42 11.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 114.615 1.339 . . . . 57.8 114.615 -178.216 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 4.9 tmt_? -39.3 -59.19 1.09 Allowed 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 112.333 0.494 . . . . 100.18 112.333 -179.134 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 161' ' ' GLY . . . . . . . . . . . . . . . -55.79 -30.6 56.93 Favored Glycine 0 C--N 1.331 0.262 0 N-CA-C 115.837 1.095 . . . . 62.92 115.837 -179.431 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 25.3 m -69.41 -21.12 63.79 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.207 0.447 . . . . 61.39 112.207 -179.585 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 163' ' ' PHE . . . . . . . . . . . . . 77.4 m-85 -103.95 148.06 26.62 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 108.528 -0.916 . . . . 61.84 108.528 178.529 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 164' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.298 0 CA-C-O 120.907 0.384 . . . . 65.98 111.138 -179.482 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 165' ' ' FMN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' GLY . . . . . 0.458 ' N ' ' C ' ' A' ' 28' ' ' ASN . . . . . . . . 0 N--CA 1.48 1.605 0 N-CA-C 113.529 0.171 . . . . 59.66 113.529 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' LYS . . . . . 0.437 ' O ' ' HD2' ' A' ' 45' ' ' PHE . 89.5 mttt -57.09 -37.85 72.5 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 117.888 2.551 . . . . 55.71 117.888 -178.171 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 63.9 mt -74.78 110.89 10.02 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-N 118.063 0.392 . . . . 36.08 111.933 179.817 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' GLY . . . . . 0.566 ' O ' HG13 ' A' ' 48' ' ' VAL . . . -87.13 116.91 4.57 Favored Glycine 0 CA--C 1.523 0.569 0 C-N-CA 120.081 -1.057 . . . . 26.3 110.853 179.229 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 6' ' ' ILE . . . . . 0.434 HG12 ' HB ' ' A' ' 49' ' ' ILE . 71.2 mt -106.98 98.94 7.58 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.369 0 N-CA-C 108.091 -1.078 . . . . 23.47 108.091 -179.961 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 21.0 m-85 -93.42 129.01 39.73 Favored 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 123.233 0.613 . . . . 26.5 111.851 -179.42 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 16.7 p90 -133.01 162.56 31.38 Favored 'General case' 0 C--O 1.241 0.649 0 CA-C-O 121.651 0.739 . . . . 24.85 110.725 179.629 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -141.11 136.45 7.53 Favored Glycine 0 N--CA 1.449 -0.497 0 N-CA-C 104.907 -3.277 . . . . 23.1 104.907 178.126 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' THR . . . . . 0.476 ' HB ' ' HB3' ' A' ' 15' ' ' ALA . 11.6 t -149.82 159.52 44.3 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 115.433 1.642 . . . . 30.0 115.433 -178.947 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 -114.49 -52.69 2.7 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 114.965 -1.016 . . . . 39.52 108.719 177.49 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' SER . . . . . 0.639 ' HB2' ' O1P' ' A' ' 165' ' ' FMN . 13.7 m -84.69 -46.56 11.35 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 120.882 0.372 . . . . 43.2 110.622 179.7 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 138.77 -11.03 3.42 Favored Glycine 0 N--CA 1.446 -0.699 0 C-N-CA 119.6 -1.286 . . . . 29.47 112.391 179.503 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ASN . . . . . 0.423 ' O ' HG12 ' A' ' 18' ' ' ILE . 97.4 m-20 -54.06 -53.14 57.15 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.822 -0.351 . . . . 31.91 111.784 179.86 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 15' ' ' ALA . . . . . 0.476 ' HB3' ' HB ' ' A' ' 10' ' ' THR . . . -54.4 -47.34 72.84 Favored 'General case' 0 C--O 1.221 -0.438 0 C-N-CA 120.165 -0.614 . . . . 21.34 111.553 -179.163 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -56.3 -44.91 80.35 Favored 'General case' 0 CA--C 1.515 -0.377 0 CA-C-O 121.179 0.514 . . . . 35.11 110.026 -179.322 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.72 -38.54 91.35 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.991 -0.549 . . . . 20.71 110.683 -179.275 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ILE . . . . . 0.423 HG12 ' O ' ' A' ' 14' ' ' ASN . 43.8 mm -65.83 -47.61 85.06 Favored 'Isoleucine or valine' 0 C--O 1.237 0.404 0 CA-C-O 121.026 0.441 . . . . 25.86 110.013 179.219 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -54.33 -39.59 67.2 Favored 'General case' 0 CA--C 1.511 -0.549 0 CA-C-N 115.968 -0.56 . . . . 21.39 109.98 179.791 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 47.8 mm-40 -67.96 -37.88 82.09 Favored 'General case' 0 C--N 1.33 -0.26 0 O-C-N 123.869 0.731 . . . . 26.65 112.458 -179.599 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' LYS . . . . . 0.459 ' HD3' ' OD1' ' A' ' 149' ' ' ASP . 30.8 ttmt -70.07 -34.14 72.81 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 115.425 -0.807 . . . . 53.58 109.557 -179.429 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 57.3 mt -71.36 -45.25 70.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 C-N-CA 119.938 -0.705 . . . . 29.21 109.545 179.535 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 42.3 t -49.29 -54.64 15.93 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 116.34 -0.391 . . . . 30.17 110.741 178.98 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -59.88 -36.02 76.05 Favored 'General case' 0 C--O 1.222 -0.348 0 N-CA-C 112.563 0.579 . . . . 55.78 112.563 -178.947 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -79.09 -25.53 43.04 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 114.112 1.153 . . . . 40.53 114.112 -178.493 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 10.7 tp -100.91 -26.43 3.6 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.377 0 CA-C-O 120.949 0.404 . . . . 36.44 111.371 -178.749 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 67.76 171.68 5.87 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.795 -0.717 . . . . 30.98 113.543 179.774 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ASN . . . . . 0.458 ' C ' ' N ' ' A' ' 2' ' ' GLY . 48.3 t30 44.1 56.78 4.58 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.629 -0.508 . . . . 48.26 109.629 179.73 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -143.16 157.72 44.26 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 114.742 1.386 . . . . 33.74 114.742 -179.158 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 83.2 tt0 -125.96 122.3 35.54 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 115.529 -0.76 . . . . 40.97 109.071 179.517 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 65.0 t -85.53 136.08 23.58 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.378 0 N-CA-C 108.138 -1.06 . . . . 27.92 108.138 179.747 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 45.2 t -138.98 125.17 23.57 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.361 0 N-CA-C 112.02 0.378 . . . . 32.05 112.02 -179.013 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 10.6 t0 -75.62 125.34 28.84 Favored 'General case' 0 C--O 1.234 0.267 0 N-CA-C 106.482 -1.673 . . . . 47.27 106.482 177.792 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' VAL . . . . . 0.419 HG23 ' HB3' ' A' ' 63' ' ' ASP . 34.7 m -62.74 -30.85 50.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 N-CA-C 112.273 0.471 . . . . 31.12 112.273 -178.793 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -59.25 -10.26 2.82 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.103 0.408 . . . . 40.76 112.103 -179.66 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 47.3 mttp -124.66 -8.63 7.36 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-O 120.613 0.244 . . . . 65.85 110.652 -179.727 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -68.81 168.16 14.0 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.971 0.415 . . . . 44.44 111.801 -178.823 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 76.4 p -139.49 163.38 32.69 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 106.596 -1.631 . . . . 41.51 106.596 179.004 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -62.31 -42.83 99.7 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 123.409 0.443 . . . . 49.04 110.209 178.894 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' GLU . . . . . 0.596 ' CD ' ' H ' ' A' ' 40' ' ' GLU . 8.1 mp0 -61.01 -47.64 85.51 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 123.197 0.599 . . . . 74.3 111.424 -179.873 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 63.0 tt0 -61.57 -46.97 87.62 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.763 -0.828 . . . . 40.98 108.763 179.3 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 84.3 t80 -52.74 -46.34 67.39 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.461 -0.791 . . . . 38.68 112.98 -179.817 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 71.9 m-20 -74.06 -4.06 33.17 Favored 'General case' 0 CA--C 1.513 -0.458 0 N-CA-C 112.735 0.643 . . . . 46.04 112.735 -179.016 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -74.27 -11.84 81.99 Favored Glycine 0 CA--C 1.524 0.603 0 C-N-CA 120.208 -0.996 . . . . 38.04 111.528 178.68 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' PHE . . . . . 0.437 ' HD2' ' O ' ' A' ' 3' ' ' LYS . 36.4 m-85 -110.24 150.43 28.71 Favored 'General case' 0 CA--C 1.51 -0.584 0 N-CA-C 109.411 -0.588 . . . . 31.38 109.411 179.89 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 69.3 p -105.93 -18.42 14.05 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 107.455 -1.313 . . . . 31.17 107.455 178.803 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' LYS . . . . . 0.479 ' HE3' ' O ' ' A' ' 164' ' ' ALA . 67.2 mttm -125.48 128.82 48.63 Favored 'General case' 0 C--O 1.239 0.53 0 N-CA-C 108.255 -1.017 . . . . 62.92 108.255 179.424 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 48' ' ' VAL . . . . . 0.599 HG12 ' CD1' ' A' ' 50' ' ' LEU . 4.6 t -141.17 147.41 22.45 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.453 0 N-CA-C 115.542 1.682 . . . . 44.7 115.542 -177.143 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 49' ' ' ILE . . . . . 0.434 ' HB ' HG12 ' A' ' 6' ' ' ILE . 86.8 mt -123.99 113.23 36.0 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.297 0 N-CA-C 108.139 -1.06 . . . . 23.79 108.139 177.719 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 50' ' ' LEU . . . . . 0.599 ' CD1' HG12 ' A' ' 48' ' ' VAL . 0.5 OUTLIER -98.91 105.11 17.21 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 114.469 1.285 . . . . 22.42 114.469 -176.404 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 51' ' ' VAL . . . . . 0.528 ' HA ' ' O ' ' A' ' 84' ' ' VAL . 0.2 OUTLIER -105.5 119.76 55.2 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.516 0 N-CA-C 108.068 -1.086 . . . . 18.37 108.068 -179.423 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -138.26 129.5 15.67 Favored Pre-proline 0 N--CA 1.442 -0.867 0 N-CA-C 114.876 1.435 . . . . 19.29 114.876 -177.196 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' PRO . . . . . 0.57 ' HA ' ' HB2' ' A' ' 86' ' ' LEU . 89.2 Cg_endo -80.62 153.0 20.14 Favored 'Trans proline' 0 CA--C 1.536 0.625 0 C-N-CA 122.889 2.393 . . . . 32.54 108.593 179.228 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 54' ' ' THR . . . . . 0.606 ' OG1' ' HA ' ' A' ' 97' ' ' ALA . 18.3 m -92.44 122.74 35.17 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 113.402 0.89 . . . . 39.86 113.402 -178.902 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -84.43 178.57 7.69 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.193 0.521 . . . . 40.28 110.933 179.408 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' GLY . . . . . 0.523 ' O ' ' HB3' ' A' ' 57' ' ' ALA . . . -54.53 142.73 32.82 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.503 -0.856 . . . . 53.13 113.172 -179.285 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ALA . . . . . 0.523 ' HB3' ' O ' ' A' ' 56' ' ' GLY . . . 76.61 -7.32 1.86 Allowed 'General case' 0 C--O 1.234 0.261 0 N-CA-C 112.92 0.711 . . . . 53.9 112.92 179.221 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 101.09 5.07 53.59 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 119.987 -1.101 . . . . 52.19 111.735 -179.987 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 68.7 m-20 -82.77 166.15 19.29 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-O 121.501 0.667 . . . . 58.97 112.406 179.982 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' LEU . . . . . 0.779 ' HB3' ' HG3' ' A' ' 65' ' ' GLU . 0.3 OUTLIER -72.54 145.55 47.37 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 114.44 1.274 . . . . 44.47 114.44 -178.246 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 61' ' ' GLN . . . . . 0.527 ' OE1' ' HB2' ' A' ' 63' ' ' ASP . 21.3 tm0? -53.2 145.33 13.9 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 103.485 -2.783 . . . . 45.96 103.485 177.467 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 1.4 m -45.85 -61.02 1.9 Allowed 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 115.654 1.724 . . . . 39.83 115.654 -177.846 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' ASP . . . . . 0.527 ' HB2' ' OE1' ' A' ' 61' ' ' GLN . 63.0 m-20 -45.67 -44.66 13.55 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.011 0.434 . . . . 47.42 112.023 -179.59 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 64' ' ' TRP . . . . . 0.456 ' HB3' ' HG ' ' A' ' 60' ' ' LEU . 2.9 m95 -68.87 -44.01 74.16 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 113.833 1.049 . . . . 33.49 113.833 -178.431 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 65' ' ' GLU . . . . . 0.779 ' HG3' ' HB3' ' A' ' 60' ' ' LEU . 13.5 mt-10 -57.66 -37.96 74.28 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.095 -0.642 . . . . 77.74 112.389 179.95 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 77.8 m-20 -75.96 -34.77 59.84 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.142 0.423 . . . . 50.6 112.142 -179.638 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 40.7 t80 -73.87 -41.33 62.35 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.298 -0.561 . . . . 33.92 109.618 179.292 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 36.0 tp -63.84 -33.09 74.92 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.999 -0.546 . . . . 22.61 111.166 -179.453 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -65.38 -17.44 64.12 Favored Glycine 0 C--O 1.223 -0.579 0 CA-C-N 115.684 -0.689 . . . . 27.52 113.716 -179.788 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.0 p -97.62 5.88 48.8 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 117.627 0.714 . . . . 39.18 109.175 179.477 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 67.8 mt -115.57 146.04 42.12 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.233 -0.44 . . . . 29.22 111.723 -179.921 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -114.9 173.81 6.29 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 107.672 -1.233 . . . . 59.28 107.672 178.415 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.19 -36.21 83.48 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.203 -0.453 . . . . 32.68 110.994 179.197 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 21.5 p -55.03 -33.31 62.54 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 112.083 0.401 . . . . 36.83 112.083 179.78 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 62.3 m-20 -68.39 -19.72 64.63 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 113.004 0.742 . . . . 34.66 113.004 178.659 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 71.6 m-85 -95.73 -24.6 16.44 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 119.75 -0.78 . . . . 22.89 110.352 -179.921 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -34.59 -56.84 0.53 Allowed 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 117.225 2.306 . . . . 32.0 117.225 -177.774 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' ASN . . . . . 0.46 ' HB3' ' O ' ' A' ' 201' ' ' HOH . 21.1 p-10 -89.78 18.3 5.74 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 117.662 2.467 . . . . 45.36 117.662 -176.848 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 50.5 mttp -116.38 165.73 12.87 Favored 'General case' 0 C--N 1.323 -0.565 0 C-N-CA 119.064 -1.054 . . . . 34.3 113.288 -178.914 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 72.0 m -109.03 127.49 54.14 Favored 'General case' 0 N--CA 1.448 -0.575 1 N-CA-C 99.395 -4.298 . . . . 29.35 99.395 176.352 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 17.0 mt -121.39 139.27 49.07 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.51 0 N-CA-C 118.151 2.649 . . . . 29.08 118.151 -174.837 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -122.69 131.21 8.19 Favored Glycine 0 CA--C 1.525 0.712 0 N-CA-C 107.54 -2.224 . . . . 26.96 107.54 177.506 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' LEU . . . . . 0.586 ' HB3' HD12 ' A' ' 100' ' ' ILE . 91.2 mt -112.23 131.36 55.53 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 117.591 0.696 . . . . 33.22 112.378 -179.645 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 84' ' ' VAL . . . . . 0.528 ' O ' ' HA ' ' A' ' 51' ' ' VAL . 89.5 t -129.3 111.01 21.47 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.587 0 N-CA-C 108.273 -1.01 . . . . 22.88 108.273 179.419 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -107.52 151.51 16.92 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.037 -1.078 . . . . 29.24 112.82 179.801 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' LEU . . . . . 0.57 ' HB2' ' HA ' ' A' ' 53' ' ' PRO . 47.2 mt -113.77 141.5 47.21 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 108.584 -0.895 . . . . 35.1 108.584 178.766 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -159.46 171.49 35.92 Favored Glycine 0 CA--C 1.52 0.369 0 C-N-CA 119.794 -1.193 . . . . 42.67 115.767 179.657 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ASP . . . . . 0.668 ' HB3' ' HD2' ' A' ' 92' ' ' TYR . 43.5 t0 -120.65 90.32 3.3 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 106.429 -1.693 . . . . 45.88 106.429 179.794 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 89' ' ' GLN . . . . . 0.584 ' HG2' ' OD2' ' A' ' 140' ' ' ASP . 13.0 pt20 -63.97 -25.43 68.13 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 116.212 1.93 . . . . 53.87 116.212 -178.309 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 77.7 m-20 -82.14 -54.6 5.14 Favored 'General case' 0 CA--C 1.517 -0.305 0 C-N-CA 120.138 -0.625 . . . . 62.83 110.686 179.294 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 60.0 m -68.13 -28.09 67.02 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 113.438 0.903 . . . . 59.78 113.438 179.964 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' TYR . . . . . 0.668 ' HD2' ' HB3' ' A' ' 88' ' ' ASP . 52.2 m-85 -128.96 64.99 1.45 Allowed 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 111.529 0.196 . . . . 59.37 111.529 -178.62 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 73.6 m -58.29 -24.64 60.15 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 115.079 1.511 . . . . 62.26 115.079 -178.857 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' GLU . . . . . 0.753 ' HG2' ' HB3' ' A' ' 124' ' ' ALA . 17.8 mt-10 -117.33 51.04 1.05 Allowed 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 119.651 -0.819 . . . . 92.13 112.505 -178.868 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 95' ' ' THR . . . . . 0.738 HG22 ' O ' ' A' ' 95' ' ' THR . 30.4 m 178.22 22.5 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 106.011 -1.848 . . . . 55.38 106.011 -178.88 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 96' ' ' PHE . . . . . . . . . . . . . 19.4 t80 -58.35 109.15 0.72 Allowed 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 116.765 2.135 . . . . 47.63 116.765 -177.933 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' ALA . . . . . 0.606 ' HA ' ' OG1' ' A' ' 54' ' ' THR . . . 49.72 56.42 7.88 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 115.206 -0.906 . . . . 44.14 113.392 177.999 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 98' ' ' GLU . . . . . 0.455 ' OE2' ' HA ' ' A' ' 126' ' ' SER . 21.6 mt-10 -87.7 -19.24 27.9 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 114.74 1.385 . . . . 43.03 114.74 -179.207 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -42.36 -56.68 4.0 Favored Glycine 0 C--N 1.332 0.309 0 C-N-CA 120.175 -1.012 . . . . 37.27 110.691 179.613 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' ILE . . . . . 0.586 HD12 ' HB3' ' A' ' 83' ' ' LEU . 13.6 mm -40.84 -44.22 0.65 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.574 0 C-N-CA 123.489 0.715 . . . . 38.3 111.892 179.916 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 101' ' ' PHE . . . . . 0.471 ' O ' ' HB3' ' A' ' 104' ' ' TYR . 79.0 t80 -53.53 -43.07 68.06 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.675 -0.693 . . . . 30.25 111.165 -179.373 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -63.21 -40.64 98.06 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.405 -0.518 . . . . 42.02 111.157 -179.133 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' ILE . . . . . 0.445 HG21 HD23 ' A' ' 50' ' ' LEU . 69.8 mt -62.41 -44.65 99.46 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 N-CA-C 105.577 -2.008 . . . . 27.42 105.577 177.202 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 104' ' ' TYR . . . . . 0.471 ' HB3' ' O ' ' A' ' 101' ' ' PHE . 73.1 t80 -51.15 -33.04 25.11 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 113.904 1.076 . . . . 39.37 113.904 -179.248 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 105' ' ' GLU . . . . . 0.593 ' HA ' ' OE1' ' A' ' 105' ' ' GLU . 3.6 mm-40 -53.9 -29.42 41.86 Favored 'General case' 0 CA--C 1.516 -0.35 0 N-CA-C 112.633 0.605 . . . . 52.97 112.633 -179.737 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 70.1 mttt -109.5 -35.18 6.3 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 118.855 -1.138 . . . . 22.49 109.833 178.974 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -60.54 -27.74 67.89 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 114.229 1.196 . . . . 20.61 114.229 -178.621 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 40.8 pttt -58.53 -13.53 5.87 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 120.87 -0.332 . . . . 31.33 111.419 -179.457 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -70.48 -23.66 62.72 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-N 116.342 -0.39 . . . . 24.09 111.568 178.748 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -107.01 -162.03 21.93 Favored Glycine 0 N--CA 1.45 -0.369 0 N-CA-C 109.069 -1.612 . . . . 30.44 109.069 179.317 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 81.6 tttt -93.27 104.82 16.96 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 117.532 0.666 . . . . 38.86 112.002 179.683 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 93.4 t -91.27 138.15 20.28 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.318 0 CA-C-O 120.996 0.427 . . . . 39.93 111.345 179.528 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 12.9 m -146.84 154.03 12.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 N-CA-C 109.458 -0.571 . . . . 38.06 109.458 -179.102 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 107.41 18.46 10.26 Favored Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 119.863 -1.161 . . . . 34.84 112.942 179.773 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' GLN . . . . . 0.426 ' OE1' ' N ' ' A' ' 115' ' ' GLN . 13.0 mp0 -58.86 138.63 57.2 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 106.585 -1.635 . . . . 60.46 106.585 178.324 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 116' ' ' THR . . . . . 0.601 ' O ' ' HB2' ' A' ' 134' ' ' PHE . 33.5 p -123.21 153.42 40.12 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 114.215 1.191 . . . . 43.11 114.215 -177.94 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 26.7 t -67.54 158.64 31.5 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 114.881 -1.054 . . . . 55.6 108.934 179.18 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 4.7 t -97.57 10.82 38.88 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.939 -0.573 . . . . 63.81 111.645 -179.829 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -76.46 124.26 27.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.122 -0.49 . . . . 80.56 111.238 179.758 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 108.61 7.16 30.17 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.65 -0.786 . . . . 66.01 111.545 179.94 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -124.52 154.27 40.82 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.998 0.428 . . . . 57.87 111.63 -179.8 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 19.0 p-80 -135.49 106.51 6.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.713 -0.676 . . . . 69.5 110.349 179.151 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 4.7 p90 -156.87 169.76 24.03 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 108.66 -0.867 . . . . 59.91 108.66 -179.06 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' ALA . . . . . 0.753 ' HB3' ' HG2' ' A' ' 94' ' ' GLU . . . -90.51 -69.65 0.72 Allowed 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.339 -0.391 . . . . 69.31 111.442 179.915 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -127.61 167.1 16.84 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.944 0.72 . . . . 67.5 112.944 -179.418 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' SER . . . . . 0.455 ' HA ' ' OE2' ' A' ' 98' ' ' GLU . 43.7 t 179.7 116.01 0.05 OUTLIER 'General case' 0 C--O 1.236 0.358 0 CA-C-N 115.519 -0.764 . . . . 60.24 111.025 179.695 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 127' ' ' LYS . . . . . 0.528 ' HA ' ' O ' ' A' ' 223' ' ' HOH . 92.0 mttt -59.25 -20.15 51.79 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.001 0.429 . . . . 58.85 110.299 179.346 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -64.34 -5.78 5.81 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 113.29 0.848 . . . . 33.62 113.29 179.957 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 37.2 t -103.16 117.2 48.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 120.835 0.35 . . . . 50.98 111.064 179.883 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -127.81 119.0 24.75 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 108.737 -0.838 . . . . 83.45 108.737 179.782 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 74.21 37.54 48.43 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.168 -1.015 . . . . 57.86 111.57 -179.552 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 60.64 19.95 55.48 Favored Glycine 0 C--N 1.332 0.342 0 C-N-CA 121.345 -0.455 . . . . 60.22 112.425 -179.725 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 4.5 tppp? -135.27 157.77 46.07 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.231 0.539 . . . . 67.48 110.08 -179.464 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 134' ' ' PHE . . . . . 0.601 ' HB2' ' O ' ' A' ' 116' ' ' THR . 0.6 OUTLIER -82.52 129.22 34.87 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.289 -0.634 . . . . 47.01 109.289 178.982 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 135' ' ' VAL . . . . . 0.415 HG12 HD12 ' A' ' 83' ' ' LEU . 23.8 t -56.54 -20.5 11.02 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.663 0 N-CA-C 113.282 0.845 . . . . 41.27 113.282 179.767 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -167.78 -166.65 27.21 Favored Glycine 0 C--O 1.226 -0.357 0 N-CA-C 110.191 -1.164 . . . . 38.23 110.191 179.243 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' LEU . . . . . 0.419 ' HB3' HG22 ' A' ' 84' ' ' VAL . 62.6 tp -72.48 137.09 46.13 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 118.084 0.942 . . . . 32.06 110.443 179.662 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 39.4 t -118.65 134.67 61.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.356 -0.383 . . . . 33.71 110.254 178.598 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 139' ' ' ILE . . . . . 0.48 HD12 HG23 ' A' ' 148' ' ' THR . 25.0 mm -126.55 144.47 36.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 121.211 0.529 . . . . 37.31 111.872 -179.128 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 140' ' ' ASP . . . . . 0.584 ' OD2' ' HG2' ' A' ' 89' ' ' GLN . 13.8 t0 -126.46 107.32 10.15 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 105.9 -1.889 . . . . 38.0 105.9 179.702 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 141' ' ' GLU . . . . . 0.566 ' HB3' ' O ' ' A' ' 216' ' ' HOH . 2.5 mm-40 -97.69 -10.62 24.66 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.145 0.424 . . . . 42.96 112.145 -179.764 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -93.53 -20.93 19.78 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.373 -0.602 . . . . 58.87 109.373 179.261 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 64.1 m-20 -128.54 -30.59 2.32 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 115.708 1.744 . . . . 50.89 115.708 -178.232 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 80.6 mt-30 -127.67 41.69 3.46 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 115.932 1.827 . . . . 66.41 115.932 -179.074 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -55.96 -26.45 48.13 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.614 -0.266 . . . . 62.08 111.116 179.507 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -72.69 -4.52 31.7 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 115.306 1.595 . . . . 62.38 115.306 -178.592 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 47.9 mt -116.8 -7.27 11.49 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 114.172 1.175 . . . . 52.29 114.172 -178.924 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 148' ' ' THR . . . . . 0.48 HG23 HD12 ' A' ' 139' ' ' ILE . 41.3 m -56.57 -60.7 3.16 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 114.667 1.358 . . . . 36.9 114.667 -179.368 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 149' ' ' ASP . . . . . 0.459 ' OD1' ' HD3' ' A' ' 21' ' ' LYS . 57.9 m-20 -50.36 -33.09 19.18 Favored 'General case' 0 CA--C 1.514 -0.419 0 N-CA-C 114.799 1.407 . . . . 53.62 114.799 -178.21 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 150' ' ' GLU . . . . . 0.441 ' HG3' ' N ' ' A' ' 151' ' ' ARG . 6.0 pt-20 -83.65 -38.24 21.77 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 119.415 -0.914 . . . . 82.48 110.268 179.873 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 151' ' ' ARG . . . . . 0.441 ' N ' ' HG3' ' A' ' 150' ' ' GLU . 94.9 mtt180 -62.05 -46.61 88.41 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-O 120.886 0.374 . . . . 48.75 111.934 179.646 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 152' ' ' ILE . . . . . 0.593 ' O ' HG23 ' A' ' 156' ' ' VAL . 41.2 mt -59.54 -41.33 84.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 N-CA-C 107.338 -1.356 . . . . 29.01 107.338 178.979 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -60.5 -48.9 79.74 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.501 -0.772 . . . . 37.27 112.237 179.837 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -65.78 -40.16 91.7 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.589 -0.444 . . . . 65.13 110.093 179.648 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 155' ' ' TRP . . . . . . . . . . . . . 12.2 t90 -62.53 -51.5 67.15 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 121.157 0.503 . . . . 36.75 111.003 -179.847 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 156' ' ' VAL . . . . . 0.662 ' O ' ' HB2' ' A' ' 160' ' ' ARG . 73.0 t -53.76 -40.63 44.2 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 N-CA-C 107.979 -1.119 . . . . 44.32 107.979 179.132 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 62.6 mm-40 -60.03 -51.97 67.39 Favored 'General case' 0 C--N 1.331 -0.22 0 O-C-N 123.597 0.561 . . . . 65.37 111.474 179.292 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 11.3 tt0 -60.27 -53.18 60.79 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 113.555 0.946 . . . . 57.07 113.555 -179.64 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 159' ' ' VAL . . . . . 0.495 HG11 ' HE1' ' A' ' 163' ' ' PHE . 10.9 t -82.63 -15.42 11.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 114.615 1.339 . . . . 57.8 114.615 -178.216 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 160' ' ' ARG . . . . . 0.662 ' HB2' ' O ' ' A' ' 156' ' ' VAL . 4.9 tmt_? -39.3 -59.19 1.09 Allowed 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 112.333 0.494 . . . . 100.18 112.333 -179.134 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 161' ' ' GLY . . . . . . . . . . . . . . . -55.79 -30.6 56.93 Favored Glycine 0 C--N 1.331 0.262 0 N-CA-C 115.837 1.095 . . . . 62.92 115.837 -179.431 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 25.3 m -69.41 -21.12 63.79 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.207 0.447 . . . . 61.39 112.207 -179.585 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 163' ' ' PHE . . . . . 0.495 ' HE1' HG11 ' A' ' 159' ' ' VAL . 77.4 m-85 -103.95 148.06 26.62 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 108.528 -0.916 . . . . 61.84 108.528 178.529 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 164' ' ' ALA . . . . . 0.479 ' O ' ' HE3' ' A' ' 47' ' ' LYS . . . . . . . . 0 C--N 1.329 -0.298 0 CA-C-O 120.907 0.384 . . . . 65.98 111.138 -179.482 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 165' ' ' FMN . . . . . 0.639 ' O1P' ' HB2' ' A' ' 12' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . 0.46 ' O ' ' HB3' ' A' ' 78' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 216' ' ' HOH . . . . . 0.566 ' O ' ' HB3' ' A' ' 141' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 . . . . . 0.528 ' O ' ' HA ' ' A' ' 127' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' GLY . . . . . 0.458 ' N ' ' C ' ' A' ' 28' ' ' ASN . . . . . . . . 0 N--CA 1.48 1.605 0 N-CA-C 113.529 0.171 . . . . 59.66 113.529 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.437 ' O ' ' HD2' ' A' ' 45' ' ' PHE . 89.5 mttt -57.09 -37.85 72.5 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 117.888 2.551 . . . . 55.71 117.888 -178.171 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 63.9 mt -74.78 110.89 10.02 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-N 118.063 0.392 . . . . 36.08 111.933 179.817 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.566 ' O ' HG13 ' A' ' 48' ' ' VAL . . . -87.13 116.91 4.57 Favored Glycine 0 CA--C 1.523 0.569 0 C-N-CA 120.081 -1.057 . . . . 26.3 110.853 179.229 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.434 HG12 ' HB ' ' A' ' 49' ' ' ILE . 71.2 mt -106.98 98.94 7.58 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.369 0 N-CA-C 108.091 -1.078 . . . . 23.47 108.091 -179.961 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 21.0 m-85 -93.42 129.01 39.73 Favored 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 123.233 0.613 . . . . 26.5 111.851 -179.42 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 16.7 p90 -133.01 162.56 31.38 Favored 'General case' 0 C--O 1.241 0.649 0 CA-C-O 121.651 0.739 . . . . 24.85 110.725 179.629 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -141.11 136.45 7.53 Favored Glycine 0 N--CA 1.449 -0.497 0 N-CA-C 104.907 -3.277 . . . . 23.1 104.907 178.126 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' THR . . . . . 0.476 ' HB ' ' HB3' ' A' ' 15' ' ' ALA . 11.6 t -149.82 159.52 44.3 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 115.433 1.642 . . . . 30.0 115.433 -178.947 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 -114.49 -52.69 2.7 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 114.965 -1.016 . . . . 39.52 108.719 177.49 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' SER . . . . . 0.639 ' HB2' ' O1P' ' A' ' 165' ' ' FMN . 13.7 m -84.69 -46.56 11.35 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 120.882 0.372 . . . . 43.2 110.622 179.7 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 138.77 -11.03 3.42 Favored Glycine 0 N--CA 1.446 -0.699 0 C-N-CA 119.6 -1.286 . . . . 29.47 112.391 179.503 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.423 ' O ' HG12 ' A' ' 18' ' ' ILE . 10.5 m120 -54.06 -53.14 57.15 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.822 -0.351 . . . . 31.91 111.784 179.86 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.476 ' HB3' ' HB ' ' A' ' 10' ' ' THR . . . -54.4 -47.34 72.84 Favored 'General case' 0 C--O 1.221 -0.438 0 C-N-CA 120.165 -0.614 . . . . 21.34 111.553 -179.163 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -56.3 -44.91 80.35 Favored 'General case' 0 CA--C 1.515 -0.377 0 CA-C-O 121.179 0.514 . . . . 35.11 110.026 -179.322 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.72 -38.54 91.35 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.991 -0.549 . . . . 20.71 110.683 -179.275 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.423 HG12 ' O ' ' A' ' 14' ' ' ASN . 43.8 mm -65.83 -47.61 85.06 Favored 'Isoleucine or valine' 0 C--O 1.237 0.404 0 CA-C-O 121.026 0.441 . . . . 25.86 110.013 179.219 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -54.33 -39.59 67.2 Favored 'General case' 0 CA--C 1.511 -0.549 0 CA-C-N 115.968 -0.56 . . . . 21.39 109.98 179.791 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 47.8 mm-40 -67.96 -37.88 82.09 Favored 'General case' 0 C--N 1.33 -0.26 0 O-C-N 123.869 0.731 . . . . 26.65 112.458 -179.599 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.459 ' HD3' ' OD1' ' A' ' 149' ' ' ASP . 30.8 ttmt -70.07 -34.14 72.81 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 115.425 -0.807 . . . . 53.58 109.557 -179.429 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 57.3 mt -71.36 -45.25 70.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 C-N-CA 119.938 -0.705 . . . . 29.21 109.545 179.535 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 42.3 t -49.29 -54.64 15.93 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 116.34 -0.391 . . . . 30.17 110.741 178.98 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -59.88 -36.02 76.05 Favored 'General case' 0 C--O 1.222 -0.348 0 N-CA-C 112.563 0.579 . . . . 55.78 112.563 -178.947 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -79.09 -25.53 43.04 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 114.112 1.153 . . . . 40.53 114.112 -178.493 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 10.7 tp -100.91 -26.43 3.6 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.377 0 CA-C-O 120.949 0.404 . . . . 36.44 111.371 -178.749 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 67.76 171.68 5.87 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.795 -0.717 . . . . 30.98 113.543 179.774 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.458 ' C ' ' N ' ' A' ' 2' ' ' GLY . 2.7 t-20 44.1 56.78 4.58 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.629 -0.508 . . . . 48.26 109.629 179.73 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -143.16 157.72 44.26 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 114.742 1.386 . . . . 33.74 114.742 -179.158 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 83.2 tt0 -125.96 122.3 35.54 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 115.529 -0.76 . . . . 40.97 109.071 179.517 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 65.0 t -85.53 136.08 23.58 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.378 0 N-CA-C 108.138 -1.06 . . . . 27.92 108.138 179.747 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 45.2 t -138.98 125.17 23.57 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.361 0 N-CA-C 112.02 0.378 . . . . 32.05 112.02 -179.013 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 10.6 t0 -75.62 125.34 28.84 Favored 'General case' 0 C--O 1.234 0.267 0 N-CA-C 106.482 -1.673 . . . . 47.27 106.482 177.792 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.419 HG23 ' HB3' ' A' ' 63' ' ' ASP . 34.7 m -62.74 -30.85 50.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 N-CA-C 112.273 0.471 . . . . 31.12 112.273 -178.793 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -59.25 -10.26 2.82 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.103 0.408 . . . . 40.76 112.103 -179.66 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 47.3 mttp -124.66 -8.63 7.36 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-O 120.613 0.244 . . . . 65.85 110.652 -179.727 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -68.81 168.16 14.0 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.971 0.415 . . . . 44.44 111.801 -178.823 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 76.4 p -139.49 163.38 32.69 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 106.596 -1.631 . . . . 41.51 106.596 179.004 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -62.31 -42.83 99.7 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 123.409 0.443 . . . . 49.04 110.209 178.894 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.596 ' CD ' ' H ' ' A' ' 40' ' ' GLU . 8.1 mp0 -61.01 -47.64 85.51 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 123.197 0.599 . . . . 74.3 111.424 -179.873 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -61.57 -46.97 87.62 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.763 -0.828 . . . . 40.98 108.763 179.3 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 84.3 t80 -52.74 -46.34 67.39 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.461 -0.791 . . . . 38.68 112.98 -179.817 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 71.9 m-20 -74.06 -4.06 33.17 Favored 'General case' 0 CA--C 1.513 -0.458 0 N-CA-C 112.735 0.643 . . . . 46.04 112.735 -179.016 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -74.27 -11.84 81.99 Favored Glycine 0 CA--C 1.524 0.603 0 C-N-CA 120.208 -0.996 . . . . 38.04 111.528 178.68 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.437 ' HD2' ' O ' ' A' ' 3' ' ' LYS . 36.4 m-85 -110.24 150.43 28.71 Favored 'General case' 0 CA--C 1.51 -0.584 0 N-CA-C 109.411 -0.588 . . . . 31.38 109.411 179.89 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 69.3 p -105.93 -18.42 14.05 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 107.455 -1.313 . . . . 31.17 107.455 178.803 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.479 ' HE3' ' O ' ' A' ' 164' ' ' ALA . 67.2 mttm -125.48 128.82 48.63 Favored 'General case' 0 C--O 1.239 0.53 0 N-CA-C 108.255 -1.017 . . . . 62.92 108.255 179.424 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.599 HG12 ' CD1' ' A' ' 50' ' ' LEU . 4.6 t -141.17 147.41 22.45 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.453 0 N-CA-C 115.542 1.682 . . . . 44.7 115.542 -177.143 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.434 ' HB ' HG12 ' A' ' 6' ' ' ILE . 86.8 mt -123.99 113.23 36.0 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.297 0 N-CA-C 108.139 -1.06 . . . . 23.79 108.139 177.719 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.599 ' CD1' HG12 ' A' ' 48' ' ' VAL . 0.5 OUTLIER -98.91 105.11 17.21 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 114.469 1.285 . . . . 22.42 114.469 -176.404 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.528 ' HA ' ' O ' ' A' ' 84' ' ' VAL . 0.2 OUTLIER -105.5 119.76 55.2 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.516 0 N-CA-C 108.068 -1.086 . . . . 18.37 108.068 -179.423 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -138.26 129.5 15.67 Favored Pre-proline 0 N--CA 1.442 -0.867 0 N-CA-C 114.876 1.435 . . . . 19.29 114.876 -177.196 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' PRO . . . . . 0.57 ' HA ' ' HB2' ' A' ' 86' ' ' LEU . 89.2 Cg_endo -80.62 153.0 20.14 Favored 'Trans proline' 0 CA--C 1.536 0.625 0 C-N-CA 122.889 2.393 . . . . 32.54 108.593 179.228 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' THR . . . . . 0.606 ' OG1' ' HA ' ' A' ' 97' ' ' ALA . 18.3 m -92.44 122.74 35.17 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 113.402 0.89 . . . . 39.86 113.402 -178.902 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -84.43 178.57 7.69 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.193 0.521 . . . . 40.28 110.933 179.408 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.523 ' O ' ' HB3' ' A' ' 57' ' ' ALA . . . -54.53 142.73 32.82 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.503 -0.856 . . . . 53.13 113.172 -179.285 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ALA . . . . . 0.523 ' HB3' ' O ' ' A' ' 56' ' ' GLY . . . 76.61 -7.32 1.86 Allowed 'General case' 0 C--O 1.234 0.261 0 N-CA-C 112.92 0.711 . . . . 53.9 112.92 179.221 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 101.09 5.07 53.59 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 119.987 -1.101 . . . . 52.19 111.735 -179.987 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 68.7 m-20 -82.77 166.15 19.29 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-O 121.501 0.667 . . . . 58.97 112.406 179.982 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.779 ' HB3' ' HG3' ' A' ' 65' ' ' GLU . 0.3 OUTLIER -72.54 145.55 47.37 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 114.44 1.274 . . . . 44.47 114.44 -178.246 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' GLN . . . . . 0.527 ' OE1' ' HB2' ' A' ' 63' ' ' ASP . 21.3 tm0? -53.2 145.33 13.9 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 103.485 -2.783 . . . . 45.96 103.485 177.467 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 1.4 m -45.85 -61.02 1.9 Allowed 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 115.654 1.724 . . . . 39.83 115.654 -177.846 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.527 ' HB2' ' OE1' ' A' ' 61' ' ' GLN . 63.0 m-20 -45.67 -44.66 13.55 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.011 0.434 . . . . 47.42 112.023 -179.59 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' TRP . . . . . 0.456 ' HB3' ' HG ' ' A' ' 60' ' ' LEU . 2.9 m95 -68.87 -44.01 74.16 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 113.833 1.049 . . . . 33.49 113.833 -178.431 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.779 ' HG3' ' HB3' ' A' ' 60' ' ' LEU . 13.5 mt-10 -57.66 -37.96 74.28 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.095 -0.642 . . . . 77.74 112.389 179.95 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 77.8 m-20 -75.96 -34.77 59.84 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.142 0.423 . . . . 50.6 112.142 -179.638 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 40.7 t80 -73.87 -41.33 62.35 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.298 -0.561 . . . . 33.92 109.618 179.292 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 36.0 tp -63.84 -33.09 74.92 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.999 -0.546 . . . . 22.61 111.166 -179.453 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -65.38 -17.44 64.12 Favored Glycine 0 C--O 1.223 -0.579 0 CA-C-N 115.684 -0.689 . . . . 27.52 113.716 -179.788 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.0 p -97.62 5.88 48.8 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 117.627 0.714 . . . . 39.18 109.175 179.477 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 67.8 mt -115.57 146.04 42.12 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.233 -0.44 . . . . 29.22 111.723 -179.921 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -114.9 173.81 6.29 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 107.672 -1.233 . . . . 59.28 107.672 178.415 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.19 -36.21 83.48 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.203 -0.453 . . . . 32.68 110.994 179.197 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 21.5 p -55.03 -33.31 62.54 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 112.083 0.401 . . . . 36.83 112.083 179.78 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 62.3 m-20 -68.39 -19.72 64.63 Favored 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 113.004 0.742 . . . . 34.66 113.004 178.659 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 71.6 m-85 -95.73 -24.6 16.44 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 119.75 -0.78 . . . . 22.89 110.352 -179.921 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -34.59 -56.84 0.53 Allowed 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 117.225 2.306 . . . . 32.0 117.225 -177.774 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.46 ' HB3' ' O ' ' A' ' 201' ' ' HOH . 21.1 p-10 -89.78 18.3 5.74 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 117.662 2.467 . . . . 45.36 117.662 -176.848 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 50.5 mttp -116.38 165.73 12.87 Favored 'General case' 0 C--N 1.323 -0.565 0 C-N-CA 119.064 -1.054 . . . . 34.3 113.288 -178.914 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 72.0 m -109.03 127.49 54.14 Favored 'General case' 0 N--CA 1.448 -0.575 1 N-CA-C 99.395 -4.298 . . . . 29.35 99.395 176.352 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 17.0 mt -121.39 139.27 49.07 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.51 0 N-CA-C 118.151 2.649 . . . . 29.08 118.151 -174.837 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -122.69 131.21 8.19 Favored Glycine 0 CA--C 1.525 0.712 0 N-CA-C 107.54 -2.224 . . . . 26.96 107.54 177.506 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.586 ' HB3' HD12 ' A' ' 100' ' ' ILE . 91.2 mt -112.23 131.36 55.53 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 117.591 0.696 . . . . 33.22 112.378 -179.645 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.528 ' O ' ' HA ' ' A' ' 51' ' ' VAL . 89.5 t -129.3 111.01 21.47 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.587 0 N-CA-C 108.273 -1.01 . . . . 22.88 108.273 179.419 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -107.52 151.51 16.92 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.037 -1.078 . . . . 29.24 112.82 179.801 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.57 ' HB2' ' HA ' ' A' ' 53' ' ' PRO . 47.2 mt -113.77 141.5 47.21 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 108.584 -0.895 . . . . 35.1 108.584 178.766 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -159.46 171.49 35.92 Favored Glycine 0 CA--C 1.52 0.369 0 C-N-CA 119.794 -1.193 . . . . 42.67 115.767 179.657 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.668 ' HB3' ' HD2' ' A' ' 92' ' ' TYR . 43.5 t0 -120.65 90.32 3.3 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 106.429 -1.693 . . . . 45.88 106.429 179.794 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.584 ' HG2' ' OD2' ' A' ' 140' ' ' ASP . 13.0 pt20 -63.97 -25.43 68.13 Favored 'General case' 0 C--N 1.332 -0.17 0 N-CA-C 116.212 1.93 . . . . 53.87 116.212 -178.309 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 77.7 m-20 -82.14 -54.6 5.14 Favored 'General case' 0 CA--C 1.517 -0.305 0 C-N-CA 120.138 -0.625 . . . . 62.83 110.686 179.294 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 60.0 m -68.13 -28.09 67.02 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 113.438 0.903 . . . . 59.78 113.438 179.964 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' TYR . . . . . 0.668 ' HD2' ' HB3' ' A' ' 88' ' ' ASP . 52.2 m-85 -128.96 64.99 1.45 Allowed 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 111.529 0.196 . . . . 59.37 111.529 -178.62 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 73.6 m -58.29 -24.64 60.15 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 115.079 1.511 . . . . 62.26 115.079 -178.857 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.753 ' HG2' ' HB3' ' A' ' 124' ' ' ALA . 17.8 mt-10 -117.33 51.04 1.05 Allowed 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 119.651 -0.819 . . . . 92.13 112.505 -178.868 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' THR . . . . . 0.738 HG22 ' O ' ' A' ' 95' ' ' THR . 30.4 m 178.22 22.5 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 106.011 -1.848 . . . . 55.38 106.011 -178.88 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' PHE . . . . . . . . . . . . . 19.4 t80 -58.35 109.15 0.72 Allowed 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 116.765 2.135 . . . . 47.63 116.765 -177.933 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.606 ' HA ' ' OG1' ' A' ' 54' ' ' THR . . . 49.72 56.42 7.88 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 115.206 -0.906 . . . . 44.14 113.392 177.999 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.455 ' OE2' ' HA ' ' A' ' 126' ' ' SER . 21.6 mt-10 -87.7 -19.24 27.9 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 114.74 1.385 . . . . 43.03 114.74 -179.207 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -42.36 -56.68 4.0 Favored Glycine 0 C--N 1.332 0.309 0 C-N-CA 120.175 -1.012 . . . . 37.27 110.691 179.613 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.586 HD12 ' HB3' ' A' ' 83' ' ' LEU . 13.6 mm -40.84 -44.22 0.65 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.574 0 C-N-CA 123.489 0.715 . . . . 38.3 111.892 179.916 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.471 ' O ' ' HB3' ' A' ' 104' ' ' TYR . 79.0 t80 -53.53 -43.07 68.06 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.675 -0.693 . . . . 30.25 111.165 -179.373 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -63.21 -40.64 98.06 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.405 -0.518 . . . . 42.02 111.157 -179.133 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.445 HG21 HD23 ' A' ' 50' ' ' LEU . 69.8 mt -62.41 -44.65 99.46 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 N-CA-C 105.577 -2.008 . . . . 27.42 105.577 177.202 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' TYR . . . . . 0.471 ' HB3' ' O ' ' A' ' 101' ' ' PHE . 73.1 t80 -51.15 -33.04 25.11 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 113.904 1.076 . . . . 39.37 113.904 -179.248 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' GLU . . . . . 0.593 ' HA ' ' OE1' ' A' ' 105' ' ' GLU . 3.6 mm-40 -53.9 -29.42 41.86 Favored 'General case' 0 CA--C 1.516 -0.35 0 N-CA-C 112.633 0.605 . . . . 52.97 112.633 -179.737 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 70.1 mttt -109.5 -35.18 6.3 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 118.855 -1.138 . . . . 22.49 109.833 178.974 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -60.54 -27.74 67.89 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 114.229 1.196 . . . . 20.61 114.229 -178.621 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 40.8 pttt -58.53 -13.53 5.87 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 120.87 -0.332 . . . . 31.33 111.419 -179.457 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -70.48 -23.66 62.72 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-N 116.342 -0.39 . . . . 24.09 111.568 178.748 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -107.01 -162.03 21.93 Favored Glycine 0 N--CA 1.45 -0.369 0 N-CA-C 109.069 -1.612 . . . . 30.44 109.069 179.317 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' LYS . . . . . . . . . . . . . 81.6 tttt -93.27 104.82 16.96 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 117.532 0.666 . . . . 38.86 112.002 179.683 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 93.4 t -91.27 138.15 20.28 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.318 0 CA-C-O 120.996 0.427 . . . . 39.93 111.345 179.528 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 12.9 m -146.84 154.03 12.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 N-CA-C 109.458 -0.571 . . . . 38.06 109.458 -179.102 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 107.41 18.46 10.26 Favored Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 119.863 -1.161 . . . . 34.84 112.942 179.773 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' GLN . . . . . 0.426 ' OE1' ' N ' ' A' ' 115' ' ' GLN . 13.0 mp0 -58.86 138.63 57.2 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 106.585 -1.635 . . . . 60.46 106.585 178.324 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' THR . . . . . 0.601 ' O ' ' HB2' ' A' ' 134' ' ' PHE . 33.5 p -123.21 153.42 40.12 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 114.215 1.191 . . . . 43.11 114.215 -177.94 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 26.7 t -67.54 158.64 31.5 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 114.881 -1.054 . . . . 55.6 108.934 179.18 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 4.7 t -97.57 10.82 38.88 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.939 -0.573 . . . . 63.81 111.645 -179.829 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -76.46 124.26 27.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.122 -0.49 . . . . 80.56 111.238 179.758 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 108.61 7.16 30.17 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.65 -0.786 . . . . 66.01 111.545 179.94 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -124.52 154.27 40.82 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.998 0.428 . . . . 57.87 111.63 -179.8 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 19.0 p-80 -135.49 106.51 6.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.713 -0.676 . . . . 69.5 110.349 179.151 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 4.7 p90 -156.87 169.76 24.03 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 108.66 -0.867 . . . . 59.91 108.66 -179.06 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.753 ' HB3' ' HG2' ' A' ' 94' ' ' GLU . . . -90.51 -69.65 0.72 Allowed 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.339 -0.391 . . . . 69.31 111.442 179.915 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -127.61 167.1 16.84 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.944 0.72 . . . . 67.5 112.944 -179.418 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' SER . . . . . 0.455 ' HA ' ' OE2' ' A' ' 98' ' ' GLU . 43.7 t 179.7 116.01 0.05 OUTLIER 'General case' 0 C--O 1.236 0.358 0 CA-C-N 115.519 -0.764 . . . . 60.24 111.025 179.695 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' LYS . . . . . 0.528 ' HA ' ' O ' ' A' ' 223' ' ' HOH . 92.0 mttt -59.25 -20.15 51.79 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.001 0.429 . . . . 58.85 110.299 179.346 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -64.34 -5.78 5.81 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 113.29 0.848 . . . . 33.62 113.29 179.957 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 37.2 t -103.16 117.2 48.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 120.835 0.35 . . . . 50.98 111.064 179.883 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -127.81 119.0 24.75 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 108.737 -0.838 . . . . 83.45 108.737 179.782 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 74.21 37.54 48.43 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.168 -1.015 . . . . 57.86 111.57 -179.552 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 60.64 19.95 55.48 Favored Glycine 0 C--N 1.332 0.342 0 C-N-CA 121.345 -0.455 . . . . 60.22 112.425 -179.725 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 4.5 tppp? -135.27 157.77 46.07 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.231 0.539 . . . . 67.48 110.08 -179.464 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' PHE . . . . . 0.601 ' HB2' ' O ' ' A' ' 116' ' ' THR . 0.6 OUTLIER -82.52 129.22 34.87 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.289 -0.634 . . . . 47.01 109.289 178.982 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' VAL . . . . . 0.415 HG12 HD12 ' A' ' 83' ' ' LEU . 23.8 t -56.54 -20.5 11.02 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.663 0 N-CA-C 113.282 0.845 . . . . 41.27 113.282 179.767 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -167.78 -166.65 27.21 Favored Glycine 0 C--O 1.226 -0.357 0 N-CA-C 110.191 -1.164 . . . . 38.23 110.191 179.243 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.419 ' HB3' HG22 ' A' ' 84' ' ' VAL . 62.6 tp -72.48 137.09 46.13 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 118.084 0.942 . . . . 32.06 110.443 179.662 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 39.4 t -118.65 134.67 61.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.356 -0.383 . . . . 33.71 110.254 178.598 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' ILE . . . . . 0.48 HD12 HG23 ' A' ' 148' ' ' THR . 25.0 mm -126.55 144.47 36.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 121.211 0.529 . . . . 37.31 111.872 -179.128 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' ASP . . . . . 0.584 ' OD2' ' HG2' ' A' ' 89' ' ' GLN . 13.8 t0 -126.46 107.32 10.15 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 105.9 -1.889 . . . . 38.0 105.9 179.702 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' GLU . . . . . 0.566 ' HB3' ' O ' ' A' ' 216' ' ' HOH . 2.5 mm-40 -97.69 -10.62 24.66 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.145 0.424 . . . . 42.96 112.145 -179.764 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -93.53 -20.93 19.78 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.373 -0.602 . . . . 58.87 109.373 179.261 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 64.1 m-20 -128.54 -30.59 2.32 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 115.708 1.744 . . . . 50.89 115.708 -178.232 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 80.6 mt-30 -127.67 41.69 3.46 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 115.932 1.827 . . . . 66.41 115.932 -179.074 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -55.96 -26.45 48.13 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.614 -0.266 . . . . 62.08 111.116 179.507 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -72.69 -4.52 31.7 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 115.306 1.595 . . . . 62.38 115.306 -178.592 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 47.9 mt -116.8 -7.27 11.49 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 114.172 1.175 . . . . 52.29 114.172 -178.924 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' THR . . . . . 0.48 HG23 HD12 ' A' ' 139' ' ' ILE . 41.3 m -56.57 -60.7 3.16 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 114.667 1.358 . . . . 36.9 114.667 -179.368 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' ASP . . . . . 0.459 ' OD1' ' HD3' ' A' ' 21' ' ' LYS . 57.9 m-20 -50.36 -33.09 19.18 Favored 'General case' 0 CA--C 1.514 -0.419 0 N-CA-C 114.799 1.407 . . . . 53.62 114.799 -178.21 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' GLU . . . . . 0.441 ' HG3' ' N ' ' A' ' 151' ' ' ARG . 6.0 pt-20 -83.65 -38.24 21.77 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 119.415 -0.914 . . . . 82.48 110.268 179.873 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' ARG . . . . . 0.441 ' N ' ' HG3' ' A' ' 150' ' ' GLU . 94.9 mtt180 -62.05 -46.61 88.41 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-O 120.886 0.374 . . . . 48.75 111.934 179.646 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' ILE . . . . . 0.593 ' O ' HG23 ' A' ' 156' ' ' VAL . 41.2 mt -59.54 -41.33 84.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 N-CA-C 107.338 -1.356 . . . . 29.01 107.338 178.979 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -60.5 -48.9 79.74 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.501 -0.772 . . . . 37.27 112.237 179.837 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -65.78 -40.16 91.7 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.589 -0.444 . . . . 65.13 110.093 179.648 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' TRP . . . . . . . . . . . . . 12.2 t90 -62.53 -51.5 67.15 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 121.157 0.503 . . . . 36.75 111.003 -179.847 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' VAL . . . . . 0.662 ' O ' ' HB2' ' A' ' 160' ' ' ARG . 73.0 t -53.76 -40.63 44.2 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 N-CA-C 107.979 -1.119 . . . . 44.32 107.979 179.132 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 62.6 mm-40 -60.03 -51.97 67.39 Favored 'General case' 0 C--N 1.331 -0.22 0 O-C-N 123.597 0.561 . . . . 65.37 111.474 179.292 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 158' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -60.27 -53.18 60.79 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 113.555 0.946 . . . . 57.07 113.555 -179.64 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 159' ' ' VAL . . . . . 0.495 HG11 ' HE1' ' A' ' 163' ' ' PHE . 10.9 t -82.63 -15.42 11.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 114.615 1.339 . . . . 57.8 114.615 -178.216 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 160' ' ' ARG . . . . . 0.662 ' HB2' ' O ' ' A' ' 156' ' ' VAL . 4.9 tmt_? -39.3 -59.19 1.09 Allowed 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 112.333 0.494 . . . . 100.18 112.333 -179.134 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 161' ' ' GLY . . . . . . . . . . . . . . . -55.79 -30.6 56.93 Favored Glycine 0 C--N 1.331 0.262 0 N-CA-C 115.837 1.095 . . . . 62.92 115.837 -179.431 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 162' ' ' SER . . . . . . . . . . . . . 25.3 m -69.41 -21.12 63.79 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.207 0.447 . . . . 61.39 112.207 -179.585 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 163' ' ' PHE . . . . . 0.495 ' HE1' HG11 ' A' ' 159' ' ' VAL . 77.4 m-85 -103.95 148.06 26.62 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 108.528 -0.916 . . . . 61.84 108.528 178.529 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 164' ' ' ALA . . . . . 0.479 ' O ' ' HE3' ' A' ' 47' ' ' LYS . . . . . . . . 0 C--N 1.329 -0.298 0 CA-C-O 120.907 0.384 . . . . 65.98 111.138 -179.482 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 165' ' ' FMN . . . . . 0.639 ' O1P' ' HB2' ' A' ' 12' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . 0.46 ' O ' ' HB3' ' A' ' 78' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 216' ' ' HOH . . . . . 0.566 ' O ' ' HB3' ' A' ' 141' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 . . . . . 0.528 ' O ' ' HA ' ' A' ' 127' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_