data_2h9u_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 2h9u _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.524 0 CA-C-O 120.723 0.297 . . . . 36.490000000000002 110.37 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 35.0 m 59.08 39.35 23.34 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.771 0.656 . . . . 32.32 112.771 179.119 -51.277 -162.949 -90.298 102.907 2.02 101.95 176.457 176.38 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 17.7 mp0 -66.73 136.3 55.3 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 107.506 -1.294 . . . . 41.43 107.506 179.405 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 89.24 -21.56 27.66 Favored Glycine 0 N--CA 1.451 -0.33 0 N-CA-C 116.699 1.44 . . . . 27.91 116.699 179.05 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -57.19 151.6 35.15 Favored Pre-proline 0 N--CA 1.464 0.245 0 CA-C-N 117.454 0.627 . . . . 23.73 110.83 -179.025 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -66.26 155.86 67.83 Favored 'Trans proline' 0 CA--C 1.53 0.31 0 N-CA-C 108.973 -1.203 . . . . 17.82 108.973 179.504 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 60.8 mt-10 -115.68 136.41 53.09 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 117.376 2.362 . . . . 27.32 117.376 -178.533 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 54.8 t -112.94 107.49 23.11 Favored 'Isoleucine or valine' 0 C--O 1.235 0.337 0 N-CA-C 105.907 -1.886 . . . . 14.51 105.907 176.65 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ARG . . . . . 0.524 ' NH2' ' NZ ' ' A' ' 38' ' ' LYS . 68.0 mtt-85 -96.4 126.16 41.41 Favored 'General case' 0 C--N 1.321 -0.642 0 C-N-CA 119.845 -0.742 . . . . 38.799999999999997 110.014 -179.689 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 42.1 mm -74.82 110.8 9.93 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 N-CA-C 112.867 0.691 . . . . 22.760000000000002 112.867 -177.99 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -113.47 -139.59 7.36 Favored Glycine 0 N--CA 1.45 -0.411 0 N-CA-C 115.131 0.812 . . . . 25.870000000000001 115.131 -179.382 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 14.3 tpt85 -79.84 -23.63 41.86 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 115.845 1.794 . . . . 40.93 115.845 -178.057 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 85.6 mttt -63.61 161.07 38.6 Favored Pre-proline 0 C--N 1.327 -0.409 0 C-N-CA 120.404 -0.518 . . . . 37.399999999999999 111.142 -179.239 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_exo -61.99 140.61 85.56 Favored 'Trans proline' 0 CA--C 1.536 0.606 0 C-N-CA 122.723 2.282 . . . . 27.289999999999999 112.154 179.63 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 54.0 t -46.99 -31.26 1.63 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.328 0 CA-C-O 121.044 0.449 . . . . 22.079999999999998 111.128 179.698 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 51.6 ttp -58.45 -35.93 72.88 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.913 -0.585 . . . . 39.380000000000003 111.273 179.838 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 13.2 t-20 -68.3 -39.87 81.93 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 112.596 0.591 . . . . 29.02 112.596 179.969 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 53.5 m-85 -72.21 -33.56 67.71 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.687 -0.233 . . . . 18.32 111.004 -179.59 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 42.5 t -62.38 -42.7 96.57 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 N-CA-C 106.719 -1.586 . . . . 15.51 106.719 177.478 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 53.7 tp -62.28 -41.46 98.5 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 116.327 -0.397 . . . . 19.690000000000001 111.154 -179.77 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.79 -43.21 93.93 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.126 0.488 . . . . 13.51 109.982 179.767 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.2 mt -60.35 -52.44 61.39 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 CA-C-N 116.022 -0.535 . . . . 12.880000000000001 109.907 179.425 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 95.4 mt -63.19 -47.72 81.39 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.639 0.607 . . . . 20.300000000000001 112.639 -179.364 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 35.3 m -58.24 -43.09 87.65 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.271 -0.641 . . . . 20.510000000000002 109.271 -179.585 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 73.0 m -63.36 -44.92 93.41 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.145 -0.479 . . . . 23.780000000000001 111.196 179.689 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 46.0 mt -71.44 -19.58 62.22 Favored 'General case' 0 N--CA 1.463 0.196 0 N-CA-C 113.78 1.03 . . . . 28.780000000000001 113.78 -179.449 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' MET . . . . . 0.419 ' CE ' ' NZ ' ' A' ' 97' ' ' LYS . 17.6 mmt -74.3 -13.86 60.82 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.195 0.442 . . . . 46.890000000000001 112.195 179.738 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -67.89 133.71 49.6 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 108.637 -0.875 . . . . 49.880000000000003 108.637 178.937 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 55.0 tt0 -54.97 -41.34 71.02 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 115.625 1.713 . . . . 52.640000000000001 115.625 -178.636 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -92.36 10.58 73.96 Favored Glycine 0 CA--C 1.519 0.341 0 N-CA-C 117.67 1.828 . . . . 44.060000000000002 117.67 -178.708 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 30.6 p -123.81 111.23 15.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 117.52 0.66 . . . . 41.659999999999997 109.549 -179.851 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -106.58 -1.94 22.38 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 112.896 0.702 . . . . 35.649999999999999 112.896 -178.623 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -135.79 145.63 46.73 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 114.966 1.469 . . . . 24.199999999999999 114.966 -178.864 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 11.4 p -149.95 134.87 10.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 107.634 -1.247 . . . . 17.879999999999999 107.634 177.272 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 92.3 t -105.65 132.1 53.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 121.494 0.664 . . . . 16.050000000000001 110.386 -179.513 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 60.0 t -105.26 129.34 58.2 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.626 0 N-CA-C 105.083 -2.192 . . . . 12.279999999999999 105.083 179.432 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' LYS . . . . . 0.524 ' NZ ' ' NH2' ' A' ' 10' ' ' ARG . 60.6 mtpt -128.7 148.98 50.87 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.269 -0.423 . . . . 31.780000000000001 111.575 -178.117 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -162.03 160.32 27.42 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 115.814 -0.63 . . . . 11.390000000000001 110.189 -179.855 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -133.93 157.54 45.76 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.913 -0.773 . . . . 39.509999999999998 108.913 179.019 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 53.32 -135.53 40.63 Favored Glycine 0 C--O 1.226 -0.366 0 N-CA-C 116.57 1.388 . . . . 15.539999999999999 116.57 178.715 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ARG . . . . . 0.527 ' NH1' ' ND2' ' A' ' 43' ' ' ASN . 21.2 ptt85 -61.24 -20.56 62.97 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 113.949 1.092 . . . . 42.859999999999999 113.949 -178.77 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ASN . . . . . 0.527 ' ND2' ' NH1' ' A' ' 42' ' ' ARG . 3.9 m120 -74.24 -10.43 59.59 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 112.974 0.731 . . . . 19.440000000000001 112.974 179.311 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 70.8 mt -60.71 -41.92 90.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 C-N-CA 120.558 -0.457 . . . . 11.050000000000001 110.816 179.79 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 78.5 m-20 -60.41 -38.94 85.61 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 108.953 -0.758 . . . . 25.809999999999999 108.953 179.263 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 50.3 mtp180 -71.65 -31.31 66.69 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.582 -0.735 . . . . 23.57 112.497 -178.359 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -65.19 -43.58 91.21 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 107.316 -1.364 . . . . 10.23 107.316 177.37 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 85.8 t -62.72 -41.81 93.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.166 -0.47 . . . . 10.44 110.26 -179.963 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 92.4 m-20 -60.36 -49.09 78.96 Favored 'General case' 0 C--O 1.223 -0.337 0 C-N-CA 120.862 -0.335 . . . . 19.75 111.009 179.59 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.96 -45.19 83.01 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.146 0.498 . . . . 10.199999999999999 110.452 179.779 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 42.1 t -66.4 -40.18 85.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.362 -0.381 . . . . 11.24 111.792 179.866 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 67.2 mm-40 -68.34 -33.54 74.48 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 119.969 -0.692 . . . . 16.210000000000001 111.86 -179.8 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 41.1 mt -63.17 -47.26 93.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 N-CA-C 106.379 -1.711 . . . . 18.469999999999999 106.379 178.218 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 54.9 t -61.2 -51.12 76.76 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.24 0 CA-C-N 116.201 -0.454 . . . . 16.420000000000002 111.07 179.383 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.94 -41.77 75.16 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 113.978 1.103 . . . . 42.259999999999998 113.978 -179.645 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 69.8 mmtt -75.96 -25.36 55.81 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 113.151 0.797 . . . . 36.030000000000001 113.151 -178.879 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 31.8 ttm180 -79.4 -32.73 43.05 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 119.947 -0.701 . . . . 40.350000000000001 110.073 179.149 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 93.6 m-85 -125.58 47.32 2.23 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.336 0.588 . . . . 28.359999999999999 109.588 179.759 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -52.68 -21.04 3.55 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 114.834 1.42 . . . . 31.690000000000001 114.834 -178.744 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 65.4 mttm -94.09 -14.4 25.79 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 117.65 2.463 . . . . 39.189999999999998 117.65 -178.254 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 15.3 p-10 -131.78 -3.97 3.65 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 117.428 2.381 . . . . 29.5 117.428 -179.365 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 69.3 mt -119.06 119.22 60.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 N-CA-C 108.044 -1.095 . . . . 25.449999999999999 108.044 178.04 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -113.35 153.52 28.4 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.732 -0.667 . . . . 37.719999999999999 112.362 -178.699 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 85.4 mt -90.89 103.15 14.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 N-CA-C 103.281 -2.859 . . . . 26.670000000000002 103.281 177.07 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 28.7 tttm -74.62 -36.57 62.94 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 115.553 1.686 . . . . 31.350000000000001 115.553 -177.265 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -161.35 150.69 16.51 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.286 -0.565 . . . . 28.280000000000001 111.485 -178.497 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 84.5 mt -140.49 134.31 34.15 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.225 0 N-CA-C 108.81 -0.811 . . . . 12.68 108.81 178.824 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 58.5 mttm -136.9 143.35 42.91 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.319 -0.993 . . . . 29.120000000000001 108.319 178.228 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 16.5 pt -121.86 154.5 26.23 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.488 0 N-CA-C 104.154 -2.536 . . . . 11.710000000000001 104.154 176.065 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 15.3 t0 -156.5 -175.11 5.25 Favored 'General case' 0 N--CA 1.444 -0.731 0 N-CA-C 105.286 -2.116 . . . . 27.149999999999999 105.286 -178.734 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 79.3 p -154.98 148.92 25.71 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 107.944 -1.132 . . . . 23.75 107.944 179.234 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 31.1 mt-30 -115.98 142.85 46.24 Favored 'General case' 0 CA--C 1.513 -0.451 0 CA-C-N 115.963 -0.562 . . . . 35.460000000000001 109.843 -179.953 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -94.87 123.12 38.15 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 104.928 -2.249 . . . . 39.119999999999997 104.928 176.353 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 23.0 pt -111.53 141.15 27.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 N-CA-C 105.699 -1.963 . . . . 24.890000000000001 105.699 178.309 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -141.92 156.78 45.49 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 118.702 -1.199 . . . . 33.950000000000003 112.79 -179.44 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 29.9 m -134.93 157.41 40.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 N-CA-C 102.564 -3.124 . . . . 20.379999999999999 102.564 177.388 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 18.5 mp0 -117.65 140.62 49.41 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 107.266 -1.383 . . . . 37.340000000000003 107.266 179.289 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 52.7 p -80.92 158.4 70.38 Favored Pre-proline 0 C--N 1.326 -0.431 0 N-CA-C 103.716 -2.698 . . . . 26.93 103.716 177.442 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -60.36 -20.57 63.68 Favored 'Trans proline' 0 C--O 1.232 0.207 0 C-N-CA 117.417 -1.256 . . . . 33.579999999999998 113.51 179.942 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 78.0 mm-40 -94.03 17.65 12.0 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 113.938 1.088 . . . . 37.259999999999998 113.938 179.971 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 84.53 14.33 71.03 Favored Glycine 0 CA--C 1.52 0.397 0 N-CA-C 120.3 2.88 . . . . 35.740000000000002 120.3 177.999 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 51.0 tt0 -93.12 129.66 39.02 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 118.501 1.15 . . . . 38.350000000000001 109.394 178.819 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 37.5 m -92.39 135.14 34.28 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.712 -0.477 . . . . 24.600000000000001 109.712 179.06 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 85.6 mtt180 -127.17 127.17 44.09 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 105.883 -1.895 . . . . 33.960000000000001 105.883 179.224 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 44.0 p -130.36 160.42 34.02 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 114.685 1.365 . . . . 19.359999999999999 114.685 -177.588 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 36.3 mtt85 -152.2 154.59 36.11 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 106.117 -1.808 . . . . 43.770000000000003 106.117 178.346 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 2.3 mtp180 -108.07 144.82 34.9 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.867 -0.79 . . . . 43.670000000000002 108.867 178.999 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 99.1 t -126.32 125.38 67.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 N-CA-C 104.989 -2.226 . . . . 16.039999999999999 104.989 178.487 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 67.0 m -83.46 156.85 22.68 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.137 -0.483 . . . . 12.59 111.9 -179.66 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 99.5 p -142.31 162.16 36.17 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.827 -0.624 . . . . 13.859999999999999 109.62 179.114 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 19.9 tt -141.78 145.0 24.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 N-CA-C 107.615 -1.254 . . . . 10.17 107.615 178.345 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -134.77 125.97 27.99 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 105.64 -1.985 . . . . 34.390000000000001 105.64 177.494 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 49.5 mt -123.59 121.49 62.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.802 -0.635 . . . . 11.44 110.011 -178.237 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 44.3 t -97.76 125.48 42.61 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 118.952 -1.099 . . . . 23.16 111.046 178.408 176.38 176.457 -90.298 101.95 2.02 102.907 -162.949 -51.277 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 82.9 mt -107.81 133.62 51.92 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 107.768 -1.197 . . . . 20.129999999999999 107.768 178.939 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -127.84 132.52 49.4 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 121.206 0.527 . . . . 33.630000000000003 110.39 179.976 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' LYS . . . . . 0.419 ' NZ ' ' CE ' ' A' ' 28' ' ' MET . 86.5 tttt -92.12 144.39 25.48 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 115.48 -0.782 . . . . 42.619999999999997 109.766 -179.726 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' ALA . . . . . 0.532 ' O ' ' C ' ' A' ' 99' ' ' GLY . . . -55.8 143.18 32.05 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 111.689 0.255 . . . . 48.07 111.689 179.399 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' GLY . . . . . 0.532 ' C ' ' O ' ' A' ' 98' ' ' ALA . . . 3.05 -73.06 0.0 OUTLIER Glycine 0 C--N 1.338 0.663 0 CA-C-O 121.673 0.596 . . . . 59.909999999999997 113.085 -179.136 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' GLU . . . . . 0.519 ' N ' ' O ' ' A' ' 98' ' ' ALA . 8.0 tp10 -141.74 -67.38 0.39 Allowed 'General case' 0 C--N 1.327 -0.391 0 O-C-N 122.114 -0.639 . . . . 66.810000000000002 110.316 177.084 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' SER . . . . . 0.522 ' O ' ' CB ' ' A' ' 102' ' ' ALA . 29.5 t -175.58 165.06 3.14 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 120.824 0.345 . . . . 70.090000000000003 110.282 178.45 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' ALA . . . . . 0.522 ' CB ' ' O ' ' A' ' 101' ' ' SER . . . . . . . . 0 C--O 1.249 1.048 0 CA-C-N 115.068 -0.969 . . . . 71.980000000000004 112.249 178.593 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1001 ' ' EDO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2001 ' ' EDO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 3001 ' ' EDO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 4001 ' ' EDO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 5001 ' ' EDO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6001 ' ' EDO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6002 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6003 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6004 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6005 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6006 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6007 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6008 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6009 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6010 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6011 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6012 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6013 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6014 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6015 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6016 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6017 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6018 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6019 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6020 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6021 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6022 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6023 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6024 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6025 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6026 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6027 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6028 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6029 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6030 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6031 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6032 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6033 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6034 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6035 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6036 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6037 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6038 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6039 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6040 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6041 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6042 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6043 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6044 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6045 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6046 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6047 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6048 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6049 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6050 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6051 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6052 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6053 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6054 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6055 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6056 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6057 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6058 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6059 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6060 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6061 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6062 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6063 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6064 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6065 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6066 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6067 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6068 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6069 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6070 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6071 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6072 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6073 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6074 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6075 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6076 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6077 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6078 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6079 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6080 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6081 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6082 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6083 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6084 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6085 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6086 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6087 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6088 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6089 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6090 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6091 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6092 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6093 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6094 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6095 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6096 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6097 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6098 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 6099 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.524 0 CA-C-O 120.723 0.297 . . . . 36.490000000000002 110.37 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 35.0 m 59.08 39.35 23.34 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.771 0.656 . . . . 32.32 112.771 179.119 -51.277 -162.949 -90.298 102.907 2.02 101.95 176.457 176.38 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' GLU . . . . . 0.435 ' H ' ' CD ' ' A' ' 4' ' ' GLU . 17.7 mp0 -66.73 136.3 55.3 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 107.506 -1.294 . . . . 41.43 107.506 179.405 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 89.24 -21.56 27.66 Favored Glycine 0 N--CA 1.451 -0.33 0 N-CA-C 116.699 1.44 . . . . 27.91 116.699 179.05 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -57.19 151.6 35.15 Favored Pre-proline 0 N--CA 1.464 0.245 0 CA-C-N 117.454 0.627 . . . . 23.73 110.83 -179.025 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -66.26 155.86 67.83 Favored 'Trans proline' 0 CA--C 1.53 0.31 0 N-CA-C 108.973 -1.203 . . . . 17.82 108.973 179.504 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 60.8 mt-10 -115.68 136.41 53.09 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 117.376 2.362 . . . . 27.32 117.376 -178.533 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 54.8 t -112.94 107.49 23.11 Favored 'Isoleucine or valine' 0 C--O 1.235 0.337 0 N-CA-C 105.907 -1.886 . . . . 14.51 105.907 176.65 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ARG . . . . . 0.619 HH22 ' NZ ' ' A' ' 38' ' ' LYS . 68.0 mtt-85 -96.4 126.16 41.41 Favored 'General case' 0 C--N 1.321 -0.642 0 C-N-CA 119.845 -0.742 . . . . 38.799999999999997 110.014 -179.689 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 42.1 mm -74.82 110.8 9.93 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 N-CA-C 112.867 0.691 . . . . 22.760000000000002 112.867 -177.99 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -113.47 -139.59 7.36 Favored Glycine 0 N--CA 1.45 -0.411 0 N-CA-C 115.131 0.812 . . . . 25.870000000000001 115.131 -179.382 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ARG . . . . . 0.533 HH11 ' HG3' ' A' ' 13' ' ' ARG . 14.3 tpt85 -79.84 -23.63 41.86 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 115.845 1.794 . . . . 40.93 115.845 -178.057 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 85.6 mttt -63.61 161.07 38.6 Favored Pre-proline 0 C--N 1.327 -0.409 0 C-N-CA 120.404 -0.518 . . . . 37.399999999999999 111.142 -179.239 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' PRO . . . . . 0.726 ' HD2' ' O ' ' A' 6038 ' ' HOH . 13.0 Cg_exo -61.99 140.61 85.56 Favored 'Trans proline' 0 CA--C 1.536 0.606 0 C-N-CA 122.723 2.282 . . . . 27.289999999999999 112.154 179.63 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 54.0 t -46.99 -31.26 1.63 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.328 0 CA-C-O 121.044 0.449 . . . . 22.079999999999998 111.128 179.698 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' MET . . . . . 0.685 ' HG3' ' H12' ' A' 2001 ' ' EDO . 51.6 ttp -58.45 -35.93 72.88 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.913 -0.585 . . . . 39.380000000000003 111.273 179.838 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ASN . . . . . 0.627 ' HB2' ' O ' ' A' 6038 ' ' HOH . 13.2 t-20 -68.3 -39.87 81.93 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 112.596 0.591 . . . . 29.02 112.596 179.969 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 53.5 m-85 -72.21 -33.56 67.71 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.687 -0.233 . . . . 18.32 111.004 -179.59 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 42.5 t -62.38 -42.7 96.57 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 N-CA-C 106.719 -1.586 . . . . 15.51 106.719 177.478 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 53.7 tp -62.28 -41.46 98.5 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 116.327 -0.397 . . . . 19.690000000000001 111.154 -179.77 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.79 -43.21 93.93 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.126 0.488 . . . . 13.51 109.982 179.767 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.2 mt -60.35 -52.44 61.39 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 CA-C-N 116.022 -0.535 . . . . 12.880000000000001 109.907 179.425 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 95.4 mt -63.19 -47.72 81.39 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.639 0.607 . . . . 20.300000000000001 112.639 -179.364 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 35.3 m -58.24 -43.09 87.65 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.271 -0.641 . . . . 20.510000000000002 109.271 -179.585 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 73.0 m -63.36 -44.92 93.41 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.145 -0.479 . . . . 23.780000000000001 111.196 179.689 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 46.0 mt -71.44 -19.58 62.22 Favored 'General case' 0 N--CA 1.463 0.196 0 N-CA-C 113.78 1.03 . . . . 28.780000000000001 113.78 -179.449 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' MET . . . . . 0.628 ' HE2' ' HZ2' ' A' ' 97' ' ' LYS . 17.6 mmt -74.3 -13.86 60.82 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.195 0.442 . . . . 46.890000000000001 112.195 179.738 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -67.89 133.71 49.6 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 108.637 -0.875 . . . . 49.880000000000003 108.637 178.937 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 55.0 tt0 -54.97 -41.34 71.02 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 115.625 1.713 . . . . 52.640000000000001 115.625 -178.636 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -92.36 10.58 73.96 Favored Glycine 0 CA--C 1.519 0.341 0 N-CA-C 117.67 1.828 . . . . 44.060000000000002 117.67 -178.708 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 30.6 p -123.81 111.23 15.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 117.52 0.66 . . . . 41.659999999999997 109.549 -179.851 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 31.4 m-20 -106.58 -1.94 22.38 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 112.896 0.702 . . . . 35.649999999999999 112.896 -178.623 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 91.9 mt-30 -135.79 145.63 46.73 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 114.966 1.469 . . . . 24.199999999999999 114.966 -178.864 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 11.4 p -149.95 134.87 10.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 107.634 -1.247 . . . . 17.879999999999999 107.634 177.272 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 92.3 t -105.65 132.1 53.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 121.494 0.664 . . . . 16.050000000000001 110.386 -179.513 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 60.0 t -105.26 129.34 58.2 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.626 0 N-CA-C 105.083 -2.192 . . . . 12.279999999999999 105.083 179.432 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' LYS . . . . . 0.619 ' NZ ' HH22 ' A' ' 10' ' ' ARG . 60.6 mtpt -128.7 148.98 50.87 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.269 -0.423 . . . . 31.780000000000001 111.575 -178.117 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -162.03 160.32 27.42 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 115.814 -0.63 . . . . 11.390000000000001 110.189 -179.855 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -133.93 157.54 45.76 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.913 -0.773 . . . . 39.509999999999998 108.913 179.019 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 53.32 -135.53 40.63 Favored Glycine 0 C--O 1.226 -0.366 0 N-CA-C 116.57 1.388 . . . . 15.539999999999999 116.57 178.715 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ARG . . . . . 0.544 ' HG3' ' NH1' ' A' ' 42' ' ' ARG . 21.2 ptt85 -61.24 -20.56 62.97 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 113.949 1.092 . . . . 42.859999999999999 113.949 -178.77 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 72.3 m-20 -74.24 -10.43 59.59 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 112.974 0.731 . . . . 19.440000000000001 112.974 179.311 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 70.8 mt -60.71 -41.92 90.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 C-N-CA 120.558 -0.457 . . . . 11.050000000000001 110.816 179.79 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -60.41 -38.94 85.61 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 108.953 -0.758 . . . . 25.809999999999999 108.953 179.263 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 50.3 mtp180 -71.65 -31.31 66.69 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.582 -0.735 . . . . 23.57 112.497 -178.359 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -65.19 -43.58 91.21 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 107.316 -1.364 . . . . 10.23 107.316 177.37 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 85.8 t -62.72 -41.81 93.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.166 -0.47 . . . . 10.44 110.26 -179.963 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 92.4 m-20 -60.36 -49.09 78.96 Favored 'General case' 0 C--O 1.223 -0.337 0 C-N-CA 120.862 -0.335 . . . . 19.75 111.009 179.59 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.96 -45.19 83.01 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.146 0.498 . . . . 10.199999999999999 110.452 179.779 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' VAL . . . . . 0.55 HG13 HD21 ' A' ' 95' ' ' LEU . 42.1 t -66.4 -40.18 85.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.362 -0.381 . . . . 11.24 111.792 179.866 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 67.2 mm-40 -68.34 -33.54 74.48 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 119.969 -0.692 . . . . 16.210000000000001 111.86 -179.8 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 41.1 mt -63.17 -47.26 93.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 N-CA-C 106.379 -1.711 . . . . 18.469999999999999 106.379 178.218 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 54.9 t -61.2 -51.12 76.76 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.24 0 CA-C-N 116.201 -0.454 . . . . 16.420000000000002 111.07 179.383 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.94 -41.77 75.16 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 113.978 1.103 . . . . 42.259999999999998 113.978 -179.645 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 69.8 mmtt -75.96 -25.36 55.81 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 113.151 0.797 . . . . 36.030000000000001 113.151 -178.879 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ARG . . . . . 0.585 ' HD3' ' H21' ' A' 6001 ' ' EDO . 31.8 ttm180 -79.4 -32.73 43.05 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 119.947 -0.701 . . . . 40.350000000000001 110.073 179.149 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 58' ' ' PHE . . . . . 0.566 ' CE2' ' HD2' ' A' ' 57' ' ' ARG . 93.6 m-85 -125.58 47.32 2.23 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.336 0.588 . . . . 28.359999999999999 109.588 179.759 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -52.68 -21.04 3.55 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 114.834 1.42 . . . . 31.690000000000001 114.834 -178.744 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 65.4 mttm -94.09 -14.4 25.79 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 117.65 2.463 . . . . 39.189999999999998 117.65 -178.254 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 15.3 p-10 -131.78 -3.97 3.65 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 117.428 2.381 . . . . 29.5 117.428 -179.365 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 69.3 mt -119.06 119.22 60.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 N-CA-C 108.044 -1.095 . . . . 25.449999999999999 108.044 178.04 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' GLU . . . . . 0.578 ' HG2' ' O ' ' A' 6020 ' ' HOH . 7.1 pt-20 -113.35 153.52 28.4 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.732 -0.667 . . . . 37.719999999999999 112.362 -178.699 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 85.4 mt -90.89 103.15 14.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 N-CA-C 103.281 -2.859 . . . . 26.670000000000002 103.281 177.07 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 28.7 tttm -74.62 -36.57 62.94 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 115.553 1.686 . . . . 31.350000000000001 115.553 -177.265 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -161.35 150.69 16.51 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.286 -0.565 . . . . 28.280000000000001 111.485 -178.497 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 84.5 mt -140.49 134.31 34.15 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.225 0 N-CA-C 108.81 -0.811 . . . . 12.68 108.81 178.824 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 58.5 mttm -136.9 143.35 42.91 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.319 -0.993 . . . . 29.120000000000001 108.319 178.228 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 16.5 pt -121.86 154.5 26.23 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.488 0 N-CA-C 104.154 -2.536 . . . . 11.710000000000001 104.154 176.065 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 15.3 t0 -156.5 -175.11 5.25 Favored 'General case' 0 N--CA 1.444 -0.731 0 N-CA-C 105.286 -2.116 . . . . 27.149999999999999 105.286 -178.734 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 79.3 p -154.98 148.92 25.71 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 107.944 -1.132 . . . . 23.75 107.944 179.234 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 31.1 mt-30 -115.98 142.85 46.24 Favored 'General case' 0 CA--C 1.513 -0.451 0 CA-C-N 115.963 -0.562 . . . . 35.460000000000001 109.843 -179.953 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -94.87 123.12 38.15 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 104.928 -2.249 . . . . 39.119999999999997 104.928 176.353 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 23.0 pt -111.53 141.15 27.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 N-CA-C 105.699 -1.963 . . . . 24.890000000000001 105.699 178.309 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' GLU . . . . . 0.527 ' HB3' HG22 ' A' ' 85' ' ' THR . 9.7 pt-20 -141.92 156.78 45.49 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 118.702 -1.199 . . . . 33.950000000000003 112.79 -179.44 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 29.9 m -134.93 157.41 40.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 N-CA-C 102.564 -3.124 . . . . 20.379999999999999 102.564 177.388 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 18.5 mp0 -117.65 140.62 49.41 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 107.266 -1.383 . . . . 37.340000000000003 107.266 179.289 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 52.7 p -80.92 158.4 70.38 Favored Pre-proline 0 C--N 1.326 -0.431 0 N-CA-C 103.716 -2.698 . . . . 26.93 103.716 177.442 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -60.36 -20.57 63.68 Favored 'Trans proline' 0 C--O 1.232 0.207 0 C-N-CA 117.417 -1.256 . . . . 33.579999999999998 113.51 179.942 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 78.0 mm-40 -94.03 17.65 12.0 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 113.938 1.088 . . . . 37.259999999999998 113.938 179.971 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 84.53 14.33 71.03 Favored Glycine 0 CA--C 1.52 0.397 0 N-CA-C 120.3 2.88 . . . . 35.740000000000002 120.3 177.999 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 51.0 tt0 -93.12 129.66 39.02 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 118.501 1.15 . . . . 38.350000000000001 109.394 178.819 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 37.5 m -92.39 135.14 34.28 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.712 -0.477 . . . . 24.600000000000001 109.712 179.06 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 85.6 mtt180 -127.17 127.17 44.09 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 105.883 -1.895 . . . . 33.960000000000001 105.883 179.224 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' THR . . . . . 0.527 HG22 ' HB3' ' A' ' 75' ' ' GLU . 44.0 p -130.36 160.42 34.02 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 114.685 1.365 . . . . 19.359999999999999 114.685 -177.588 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 36.3 mtt85 -152.2 154.59 36.11 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 106.117 -1.808 . . . . 43.770000000000003 106.117 178.346 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 2.3 mtp180 -108.07 144.82 34.9 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.867 -0.79 . . . . 43.670000000000002 108.867 178.999 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 99.1 t -126.32 125.38 67.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 N-CA-C 104.989 -2.226 . . . . 16.039999999999999 104.989 178.487 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 67.0 m -83.46 156.85 22.68 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.137 -0.483 . . . . 12.59 111.9 -179.66 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 99.5 p -142.31 162.16 36.17 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.827 -0.624 . . . . 13.859999999999999 109.62 179.114 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 19.9 tt -141.78 145.0 24.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 N-CA-C 107.615 -1.254 . . . . 10.17 107.615 178.345 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -134.77 125.97 27.99 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 105.64 -1.985 . . . . 34.390000000000001 105.64 177.494 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 49.5 mt -123.59 121.49 62.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.802 -0.635 . . . . 11.44 110.011 -178.237 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 44.3 t -97.76 125.48 42.61 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 118.952 -1.099 . . . . 23.16 111.046 178.408 176.38 176.457 -90.298 101.95 2.02 102.907 -162.949 -51.277 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' LEU . . . . . 0.55 HD21 HG13 ' A' ' 51' ' ' VAL . 82.9 mt -107.81 133.62 51.92 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 107.768 -1.197 . . . . 20.129999999999999 107.768 178.939 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -127.84 132.52 49.4 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 121.206 0.527 . . . . 33.630000000000003 110.39 179.976 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' LYS . . . . . 0.656 ' HE2' ' O ' ' A' ' 100' ' ' GLU . 86.5 tttt -92.12 144.39 25.48 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 115.48 -0.782 . . . . 42.619999999999997 109.766 -179.726 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 98' ' ' ALA . . . . . 0.532 ' O ' ' C ' ' A' ' 99' ' ' GLY . . . -55.8 143.18 32.05 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 111.689 0.255 . . . . 48.07 111.689 179.399 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 99' ' ' GLY . . . . . 0.532 ' C ' ' O ' ' A' ' 98' ' ' ALA . . . 3.05 -73.06 0.0 OUTLIER Glycine 0 C--N 1.338 0.663 0 CA-C-O 121.673 0.596 . . . . 59.909999999999997 113.085 -179.136 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 100' ' ' GLU . . . . . 0.656 ' O ' ' HE2' ' A' ' 97' ' ' LYS . 8.0 tp10 -141.74 -67.38 0.39 Allowed 'General case' 0 C--N 1.327 -0.391 0 O-C-N 122.114 -0.639 . . . . 66.810000000000002 110.316 177.084 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 101' ' ' SER . . . . . 0.637 ' O ' ' HB2' ' A' ' 102' ' ' ALA . 29.5 t -175.58 165.06 3.14 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 120.824 0.345 . . . . 70.090000000000003 110.282 178.45 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 102' ' ' ALA . . . . . 0.637 ' HB2' ' O ' ' A' ' 101' ' ' SER . . . . . . . . 0 C--O 1.249 1.048 0 CA-C-N 115.068 -0.969 . . . . 71.980000000000004 112.249 178.593 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1001 ' ' EDO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2001 ' ' EDO . . . . . 0.685 ' H12' ' HG3' ' A' ' 17' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 3001 ' ' EDO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 4001 ' ' EDO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 5001 ' ' EDO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6001 ' ' EDO . . . . . 0.585 ' H21' ' HD3' ' A' ' 57' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 6002 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6003 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6004 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6005 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6006 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6007 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6008 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6009 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6010 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6011 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6012 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6013 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6014 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6015 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6016 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6017 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6018 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6019 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6020 ' ' HOH . . . . . 0.578 ' O ' ' HG2' ' A' ' 63' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 6021 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6022 ' ' HOH . . . . . 0.493 ' O ' ' HE3' ' A' ' 28' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 6023 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6024 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6025 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6026 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6027 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6028 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6029 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6030 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6031 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6032 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6033 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6034 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6035 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6036 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6037 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6038 ' ' HOH . . . . . 0.726 ' O ' ' HD2' ' A' ' 15' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 6039 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6040 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6041 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6042 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6043 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6044 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6045 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6046 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6047 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6048 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6049 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6050 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6051 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6052 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6053 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6054 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6055 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6056 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6057 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6058 ' ' HOH . . . . . 0.462 ' O ' ' HD2' ' A' ' 13' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 6059 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6060 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6061 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6062 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6063 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6064 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6065 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6066 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6067 ' ' HOH . . . . . 0.619 ' O ' ' HD3' ' A' ' 97' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 6068 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6069 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6070 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6071 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6072 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6073 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6074 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6075 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6076 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6077 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6078 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6079 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6080 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6081 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6082 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6083 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6084 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6085 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6086 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6087 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6088 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6089 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6090 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6091 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6092 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6093 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6094 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6095 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6096 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6097 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6098 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 6099 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.524 0 CA-C-O 120.723 0.297 . . . . 36.49 110.37 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 35.0 m 59.08 39.35 23.34 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.771 0.656 . . . . 32.32 112.771 179.119 -51.277 -162.949 -90.298 102.907 2.02 101.95 176.457 176.38 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.435 ' CD ' ' H ' ' A' ' 4' ' ' GLU . 17.7 mp0 -66.73 136.3 55.3 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 107.506 -1.294 . . . . 41.43 107.506 179.405 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 89.24 -21.56 27.66 Favored Glycine 0 N--CA 1.451 -0.33 0 N-CA-C 116.699 1.44 . . . . 27.91 116.699 179.05 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -57.19 151.6 35.15 Favored Pre-proline 0 N--CA 1.464 0.245 0 CA-C-N 117.454 0.627 . . . . 23.73 110.83 -179.025 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -66.26 155.86 67.83 Favored 'Trans proline' 0 CA--C 1.53 0.31 0 N-CA-C 108.973 -1.203 . . . . 17.82 108.973 179.504 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 60.8 mt-10 -115.68 136.41 53.09 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 117.376 2.362 . . . . 27.32 117.376 -178.533 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 54.8 t -112.94 107.49 23.11 Favored 'Isoleucine or valine' 0 C--O 1.235 0.337 0 N-CA-C 105.907 -1.886 . . . . 14.51 105.907 176.65 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.619 HH22 ' NZ ' ' A' ' 38' ' ' LYS . 68.0 mtt-85 -96.4 126.16 41.41 Favored 'General case' 0 C--N 1.321 -0.642 0 C-N-CA 119.845 -0.742 . . . . 38.8 110.014 -179.689 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 42.1 mm -74.82 110.8 9.93 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 N-CA-C 112.867 0.691 . . . . 22.76 112.867 -177.99 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -113.47 -139.59 7.36 Favored Glycine 0 N--CA 1.45 -0.411 0 N-CA-C 115.131 0.812 . . . . 25.87 115.131 -179.382 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.533 ' HG3' HH11 ' A' ' 13' ' ' ARG . 14.3 tpt85 -79.84 -23.63 41.86 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 115.845 1.794 . . . . 40.93 115.845 -178.057 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 85.6 mttt -63.61 161.07 38.6 Favored Pre-proline 0 C--N 1.327 -0.409 0 C-N-CA 120.404 -0.518 . . . . 37.4 111.142 -179.239 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' PRO . . . . . 0.726 ' HD2' ' O ' ' A' 6038 ' ' HOH . 13.0 Cg_exo -61.99 140.61 85.56 Favored 'Trans proline' 0 CA--C 1.536 0.606 0 C-N-CA 122.723 2.282 . . . . 27.29 112.154 179.63 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 54.0 t -46.99 -31.26 1.63 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.328 0 CA-C-O 121.044 0.449 . . . . 22.08 111.128 179.698 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' MET . . . . . 0.685 ' HG3' ' H12' ' A' 2001 ' ' EDO . 51.6 ttp -58.45 -35.93 72.88 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.913 -0.585 . . . . 39.38 111.273 179.838 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.627 ' HB2' ' O ' ' A' 6038 ' ' HOH . 13.2 t-20 -68.3 -39.87 81.93 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 112.596 0.591 . . . . 29.02 112.596 179.969 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 53.5 m-85 -72.21 -33.56 67.71 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.687 -0.233 . . . . 18.32 111.004 -179.59 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 42.5 t -62.38 -42.7 96.57 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 N-CA-C 106.719 -1.586 . . . . 15.51 106.719 177.478 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 53.7 tp -62.28 -41.46 98.5 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 116.327 -0.397 . . . . 19.69 111.154 -179.77 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.79 -43.21 93.93 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.126 0.488 . . . . 13.51 109.982 179.767 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.2 mt -60.35 -52.44 61.39 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 CA-C-N 116.022 -0.535 . . . . 12.88 109.907 179.425 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 95.4 mt -63.19 -47.72 81.39 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.639 0.607 . . . . 20.3 112.639 -179.364 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 35.3 m -58.24 -43.09 87.65 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.271 -0.641 . . . . 20.51 109.271 -179.585 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 73.0 m -63.36 -44.92 93.41 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.145 -0.479 . . . . 23.78 111.196 179.689 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 46.0 mt -71.44 -19.58 62.22 Favored 'General case' 0 N--CA 1.463 0.196 0 N-CA-C 113.78 1.03 . . . . 28.78 113.78 -179.449 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' MET . . . . . 0.628 ' HE2' ' HZ2' ' A' ' 97' ' ' LYS . 17.6 mmt -74.3 -13.86 60.82 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.195 0.442 . . . . 46.89 112.195 179.738 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -67.89 133.71 49.6 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 108.637 -0.875 . . . . 49.88 108.637 178.937 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 55.0 tt0 -54.97 -41.34 71.02 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 115.625 1.713 . . . . 52.64 115.625 -178.636 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -92.36 10.58 73.96 Favored Glycine 0 CA--C 1.519 0.341 0 N-CA-C 117.67 1.828 . . . . 44.06 117.67 -178.708 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 30.6 p -123.81 111.23 15.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 117.52 0.66 . . . . 41.66 109.549 -179.851 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -106.58 -1.94 22.38 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 112.896 0.702 . . . . 35.65 112.896 -178.623 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -135.79 145.63 46.73 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 114.966 1.469 . . . . 24.2 114.966 -178.864 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 11.4 p -149.95 134.87 10.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 107.634 -1.247 . . . . 17.88 107.634 177.272 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 92.3 t -105.65 132.1 53.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 121.494 0.664 . . . . 16.05 110.386 -179.513 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 60.0 t -105.26 129.34 58.2 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.626 0 N-CA-C 105.083 -2.192 . . . . 12.28 105.083 179.432 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.619 ' NZ ' HH22 ' A' ' 10' ' ' ARG . 60.6 mtpt -128.7 148.98 50.87 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.269 -0.423 . . . . 31.78 111.575 -178.117 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -162.03 160.32 27.42 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 115.814 -0.63 . . . . 11.39 110.189 -179.855 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -133.93 157.54 45.76 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.913 -0.773 . . . . 39.51 108.913 179.019 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 53.32 -135.53 40.63 Favored Glycine 0 C--O 1.226 -0.366 0 N-CA-C 116.57 1.388 . . . . 15.54 116.57 178.715 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.593 HH12 ' ND2' ' A' ' 43' ' ' ASN . 21.2 ptt85 -61.24 -20.56 62.97 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 113.949 1.092 . . . . 42.86 113.949 -178.77 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.593 ' ND2' HH12 ' A' ' 42' ' ' ARG . 3.9 m120 -74.24 -10.43 59.59 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 112.974 0.731 . . . . 19.44 112.974 179.311 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 70.8 mt -60.71 -41.92 90.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 C-N-CA 120.558 -0.457 . . . . 11.05 110.816 179.79 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 78.5 m-20 -60.41 -38.94 85.61 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 108.953 -0.758 . . . . 25.81 108.953 179.263 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 50.3 mtp180 -71.65 -31.31 66.69 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.582 -0.735 . . . . 23.57 112.497 -178.359 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -65.19 -43.58 91.21 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 107.316 -1.364 . . . . 10.23 107.316 177.37 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 85.8 t -62.72 -41.81 93.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.166 -0.47 . . . . 10.44 110.26 -179.963 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 92.4 m-20 -60.36 -49.09 78.96 Favored 'General case' 0 C--O 1.223 -0.337 0 C-N-CA 120.862 -0.335 . . . . 19.75 111.009 179.59 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.96 -45.19 83.01 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.146 0.498 . . . . 10.2 110.452 179.779 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.55 HG13 HD21 ' A' ' 95' ' ' LEU . 42.1 t -66.4 -40.18 85.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.362 -0.381 . . . . 11.24 111.792 179.866 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 67.2 mm-40 -68.34 -33.54 74.48 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 119.969 -0.692 . . . . 16.21 111.86 -179.8 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 41.1 mt -63.17 -47.26 93.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 N-CA-C 106.379 -1.711 . . . . 18.47 106.379 178.218 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 54.9 t -61.2 -51.12 76.76 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.24 0 CA-C-N 116.201 -0.454 . . . . 16.42 111.07 179.383 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.94 -41.77 75.16 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 113.978 1.103 . . . . 42.26 113.978 -179.645 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 69.8 mmtt -75.96 -25.36 55.81 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 113.151 0.797 . . . . 36.03 113.151 -178.879 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.585 ' HD3' ' H21' ' A' 6001 ' ' EDO . 31.8 ttm180 -79.4 -32.73 43.05 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 119.947 -0.701 . . . . 40.35 110.073 179.149 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.566 ' CE2' ' HD2' ' A' ' 57' ' ' ARG . 93.6 m-85 -125.58 47.32 2.23 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.336 0.588 . . . . 28.36 109.588 179.759 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -52.68 -21.04 3.55 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 114.834 1.42 . . . . 31.69 114.834 -178.744 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 65.4 mttm -94.09 -14.4 25.79 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 117.65 2.463 . . . . 39.19 117.65 -178.254 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 15.3 p-10 -131.78 -3.97 3.65 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 117.428 2.381 . . . . 29.5 117.428 -179.365 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 69.3 mt -119.06 119.22 60.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 N-CA-C 108.044 -1.095 . . . . 25.45 108.044 178.04 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.578 ' HG2' ' O ' ' A' 6020 ' ' HOH . 7.1 pt-20 -113.35 153.52 28.4 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.732 -0.667 . . . . 37.72 112.362 -178.699 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 85.4 mt -90.89 103.15 14.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 N-CA-C 103.281 -2.859 . . . . 26.67 103.281 177.07 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 28.7 tttm -74.62 -36.57 62.94 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 115.553 1.686 . . . . 31.35 115.553 -177.265 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -161.35 150.69 16.51 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.286 -0.565 . . . . 28.28 111.485 -178.497 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 84.5 mt -140.49 134.31 34.15 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.225 0 N-CA-C 108.81 -0.811 . . . . 12.68 108.81 178.824 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 58.5 mttm -136.9 143.35 42.91 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.319 -0.993 . . . . 29.12 108.319 178.228 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 16.5 pt -121.86 154.5 26.23 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.488 0 N-CA-C 104.154 -2.536 . . . . 11.71 104.154 176.065 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 15.3 t0 -156.5 -175.11 5.25 Favored 'General case' 0 N--CA 1.444 -0.731 0 N-CA-C 105.286 -2.116 . . . . 27.15 105.286 -178.734 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 79.3 p -154.98 148.92 25.71 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 107.944 -1.132 . . . . 23.75 107.944 179.234 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 31.1 mt-30 -115.98 142.85 46.24 Favored 'General case' 0 CA--C 1.513 -0.451 0 CA-C-N 115.963 -0.562 . . . . 35.46 109.843 -179.953 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -94.87 123.12 38.15 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 104.928 -2.249 . . . . 39.12 104.928 176.353 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 23.0 pt -111.53 141.15 27.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 N-CA-C 105.699 -1.963 . . . . 24.89 105.699 178.309 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.527 ' HB3' HG22 ' A' ' 85' ' ' THR . 9.7 pt-20 -141.92 156.78 45.49 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 118.702 -1.199 . . . . 33.95 112.79 -179.44 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 29.9 m -134.93 157.41 40.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 N-CA-C 102.564 -3.124 . . . . 20.38 102.564 177.388 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 18.5 mp0 -117.65 140.62 49.41 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 107.266 -1.383 . . . . 37.34 107.266 179.289 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 52.7 p -80.92 158.4 70.38 Favored Pre-proline 0 C--N 1.326 -0.431 0 N-CA-C 103.716 -2.698 . . . . 26.93 103.716 177.442 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -60.36 -20.57 63.68 Favored 'Trans proline' 0 C--O 1.232 0.207 0 C-N-CA 117.417 -1.256 . . . . 33.58 113.51 179.942 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 78.0 mm-40 -94.03 17.65 12.0 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 113.938 1.088 . . . . 37.26 113.938 179.971 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 84.53 14.33 71.03 Favored Glycine 0 CA--C 1.52 0.397 0 N-CA-C 120.3 2.88 . . . . 35.74 120.3 177.999 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 51.0 tt0 -93.12 129.66 39.02 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 118.501 1.15 . . . . 38.35 109.394 178.819 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 37.5 m -92.39 135.14 34.28 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.712 -0.477 . . . . 24.6 109.712 179.06 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 85.6 mtt180 -127.17 127.17 44.09 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 105.883 -1.895 . . . . 33.96 105.883 179.224 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' THR . . . . . 0.527 HG22 ' HB3' ' A' ' 75' ' ' GLU . 44.0 p -130.36 160.42 34.02 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 114.685 1.365 . . . . 19.36 114.685 -177.588 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 36.3 mtt85 -152.2 154.59 36.11 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 106.117 -1.808 . . . . 43.77 106.117 178.346 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 2.3 mtp180 -108.07 144.82 34.9 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.867 -0.79 . . . . 43.67 108.867 178.999 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 99.1 t -126.32 125.38 67.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 N-CA-C 104.989 -2.226 . . . . 16.04 104.989 178.487 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 67.0 m -83.46 156.85 22.68 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.137 -0.483 . . . . 12.59 111.9 -179.66 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 99.5 p -142.31 162.16 36.17 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.827 -0.624 . . . . 13.86 109.62 179.114 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 19.9 tt -141.78 145.0 24.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 N-CA-C 107.615 -1.254 . . . . 10.17 107.615 178.345 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -134.77 125.97 27.99 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 105.64 -1.985 . . . . 34.39 105.64 177.494 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 49.5 mt -123.59 121.49 62.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.802 -0.635 . . . . 11.44 110.011 -178.237 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 44.3 t -97.76 125.48 42.61 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 118.952 -1.099 . . . . 23.16 111.046 178.408 176.38 176.457 -90.298 101.95 2.02 102.907 -162.949 -51.277 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.55 HD21 HG13 ' A' ' 51' ' ' VAL . 82.9 mt -107.81 133.62 51.92 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 107.768 -1.197 . . . . 20.13 107.768 178.939 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -127.84 132.52 49.4 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 121.206 0.527 . . . . 33.63 110.39 179.976 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.656 ' HE2' ' O ' ' A' ' 100' ' ' GLU . 86.5 tttt -92.12 144.39 25.48 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 115.48 -0.782 . . . . 42.62 109.766 -179.726 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' ALA . . . . . 0.532 ' O ' ' C ' ' A' ' 99' ' ' GLY . . . -55.8 143.18 32.05 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 111.689 0.255 . . . . 48.07 111.689 179.399 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' GLY . . . . . 0.532 ' C ' ' O ' ' A' ' 98' ' ' ALA . . . 3.05 -73.06 0.0 OUTLIER Glycine 0 C--N 1.338 0.663 0 CA-C-O 121.673 0.596 . . . . 59.91 113.085 -179.136 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.656 ' O ' ' HE2' ' A' ' 97' ' ' LYS . 8.0 tp10 -141.74 -67.38 0.39 Allowed 'General case' 0 C--N 1.327 -0.391 0 O-C-N 122.114 -0.639 . . . . 66.81 110.316 177.084 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' SER . . . . . 0.637 ' O ' ' HB2' ' A' ' 102' ' ' ALA . 29.5 t -175.58 165.06 3.14 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 120.824 0.345 . . . . 70.09 110.282 178.45 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.637 ' HB2' ' O ' ' A' ' 101' ' ' SER . . . . . . . . 0 C--O 1.249 1.048 0 CA-C-N 115.068 -0.969 . . . . 71.98 112.249 178.593 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1001 ' ' EDO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2001 ' ' EDO . . . . . 0.685 ' H12' ' HG3' ' A' ' 17' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 3001 ' ' EDO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 4001 ' ' EDO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 5001 ' ' EDO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6001 ' ' EDO . . . . . 0.585 ' H21' ' HD3' ' A' ' 57' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 6002 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6003 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6004 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6005 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6006 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6007 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6008 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6009 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6010 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6011 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6012 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6013 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6014 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6015 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6016 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6017 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6018 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6019 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6020 ' ' HOH . . . . . 0.578 ' O ' ' HG2' ' A' ' 63' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 6021 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6022 ' ' HOH . . . . . 0.493 ' O ' ' HE3' ' A' ' 28' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 6023 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6024 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6025 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6026 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6027 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6028 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6029 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6030 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6031 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6032 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6033 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6034 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6035 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6036 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6037 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6038 ' ' HOH . . . . . 0.726 ' O ' ' HD2' ' A' ' 15' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 6039 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6040 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6041 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6042 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6043 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6044 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6045 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6046 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6047 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6048 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6049 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6050 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6051 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6052 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6053 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6054 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6055 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6056 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6057 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6058 ' ' HOH . . . . . 0.462 ' O ' ' HD2' ' A' ' 13' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 6059 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6060 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6061 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6062 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6063 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6064 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6065 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6066 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6067 ' ' HOH . . . . . 0.619 ' O ' ' HD3' ' A' ' 97' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 6068 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6069 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6070 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6071 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6072 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6073 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6074 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6075 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6076 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6077 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6078 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6079 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6080 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6081 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6082 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6083 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6084 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6085 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6086 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6087 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6088 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6089 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6090 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6091 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6092 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6093 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6094 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6095 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6096 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6097 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6098 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 6099 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_