data_1eks_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 1eks _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 ' 15' ' ' MET . . . . . 0.42 ' SD ' ' CD2' ' A' ' 77' ' ' HIS . 22.3 ptt? . . . . . 0 N--CA 1.49 1.532 0 CA-C-O 122.965 1.364 . . . . 100.51 110.018 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 4.1 t -78.27 142.82 13.6 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.325 0 CA-C-N 115.102 -0.954 . . . . 100.51 111.894 -177.556 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 12.7 t0 -61.03 142.05 56.92 Favored 'General case' 0 C--N 1.33 -0.246 0 O-C-N 122.182 -0.324 . . . . 100.51 110.145 179.126 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 34.8 m -124.13 4.43 5.01 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 N-CA-C 113.826 1.047 . . . . 100.51 113.826 -179.183 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.4 p -68.04 -21.66 65.0 Favored 'General case' 0 C--O 1.239 0.541 0 N-CA-C 115.389 1.625 . . . . 100.51 115.389 -178.28 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -71.23 -93.03 0.01 OUTLIER 'General case' 0 C--O 1.242 0.663 0 N-CA-C 113.772 1.027 . . . . 100.51 113.772 178.391 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.98 123.62 19.92 Favored 'General case' 0 C--O 1.237 0.439 0 CA-C-O 116.344 -1.789 . . . . 100.51 110.445 -179.556 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -164.49 160.63 20.65 Favored 'General case' 0 C--O 1.242 0.683 0 N-CA-C 116.732 2.123 . . . . 100.51 116.732 -174.722 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 81.0 104.14 0.06 Allowed 'General case' 0 N--CA 1.447 -0.603 0 CA-C-O 124.88 2.276 . . . . 100.51 114.953 175.496 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -179.86 169.86 1.25 Allowed 'General case' 0 N--CA 1.444 -0.726 0 O-C-N 119.474 -2.016 . . . . 100.51 109.522 179.253 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 53.9 t -88.59 105.18 15.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.011 -0.995 . . . . 93.73 109.446 175.504 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 1.5 mmt-85 -95.4 147.52 23.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.432 -0.804 . . . . 97.2 110.283 -179.669 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -157.31 149.46 22.68 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 118.318 -1.353 . . . . 76.76 112.97 -178.401 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -153.07 153.15 32.26 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-O 124.769 2.224 . . . . 55.2 111.003 177.166 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 4.7 mtp85 -133.27 134.51 44.02 Favored 'General case' 0 CA--C 1.534 0.352 0 O-C-N 118.657 -2.527 . . . . 81.07 107.098 -178.592 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -131.2 166.45 21.11 Favored 'General case' 0 C--O 1.242 0.685 0 C-N-CA 119.285 -0.966 . . . . 48.8 108.639 -176.805 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -143.53 153.64 42.79 Favored 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 116.56 -2.056 . . . . 58.07 108.344 178.48 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -144.68 158.33 43.82 Favored 'General case' 0 C--N 1.316 -0.856 0 O-C-N 124.779 1.299 . . . . 41.83 108.096 -179.874 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 82.8 m-85 -135.6 139.65 44.0 Favored 'General case' 0 C--O 1.241 0.617 0 CA-C-O 121.95 0.881 . . . . 51.98 110.333 -179.078 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 39.3 t -117.56 119.31 61.3 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 C-N-CA 119.295 -0.962 . . . . 50.54 109.104 167.84 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 28.2 m -96.32 137.46 35.36 Favored 'General case' 0 C--N 1.322 -0.604 0 O-C-N 120.504 -1.373 . . . . 55.97 111.37 178.992 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 13.7 ptp -153.7 177.43 10.98 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.518 0.562 . . . . 61.11 112.518 -176.667 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 15.0 mtm-85 -71.03 161.84 30.46 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 109.751 -0.463 . . . . 69.01 109.751 175.64 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 5.4 p -64.16 -39.77 94.73 Favored 'General case' 0 C--N 1.32 -0.705 0 C-N-CA 124.336 1.054 . . . . 63.52 113.153 178.137 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -69.08 -34.5 75.23 Favored 'General case' 0 C--O 1.226 -0.174 0 O-C-N 120.674 -1.266 . . . . 74.76 111.194 -179.683 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 89.9 m -65.17 -51.01 63.72 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-O 116.911 -1.518 . . . . 66.13 107.28 176.909 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 42.8 tp -60.85 -37.61 82.69 Favored 'General case' 0 N--CA 1.448 -0.531 0 O-C-N 125.331 1.645 . . . . 63.47 113.558 177.454 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -55.27 -42.87 74.11 Favored 'General case' 0 C--O 1.244 0.789 0 N-CA-C 114.289 1.218 . . . . 60.76 114.289 172.72 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 10.6 mtm -63.12 -45.58 91.31 Favored 'General case' 0 N--CA 1.455 -0.212 0 O-C-N 120.216 -1.552 . . . . 73.29 113.53 177.076 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 4.1 mt -54.99 -59.52 2.31 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.519 0 N-CA-C 109.086 -0.709 . . . . 70.4 109.086 176.931 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 61.9 mt -52.47 -40.04 31.21 Favored 'Isoleucine or valine' 0 C--O 1.234 0.27 0 CA-C-O 122.234 1.016 . . . . 83.66 112.637 -179.337 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -86.19 4.2 39.61 Favored 'General case' 0 CA--C 1.48 -1.745 1 N-CA-C 125.207 5.262 . . . . 100.51 125.207 -172.651 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 126.97 -98.74 0.52 Allowed Glycine 0 N--CA 1.402 -3.605 3 C-N-CA 139.287 8.089 . . . . 100.51 107.99 0.339 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.48 158.39 9.76 Favored 'General case' 0 N--CA 1.442 -0.867 0 CA-C-N 108.89 -3.655 . . . . 100.51 109.155 178.817 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 55.2 m-70 56.39 20.36 4.67 Favored 'General case' 0 C--O 1.239 0.525 0 C-N-CA 124.423 1.089 . . . . 100.51 113.078 176.651 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 30.5 m-70 -114.35 -117.18 0.32 Allowed 'General case' 0 N--CA 1.442 -0.854 0 O-C-N 121.231 -0.918 . . . . 100.51 112.477 179.623 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -98.49 -62.89 1.18 Allowed 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 116.979 2.214 . . . . 100.51 116.979 -175.951 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -117.25 67.35 0.32 Allowed Glycine 0 CA--C 1.536 1.346 0 N-CA-C 107.169 -2.372 . . . . 88.79 107.169 -179.217 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 58.8 t0 -58.06 111.51 1.21 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 122.492 1.139 . . . . 71.11 111.916 -176.443 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 38.9 t -54.12 -44.79 64.89 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 C-N-CA 124.039 0.936 . . . . 65.08 113.409 177.934 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 4.4 m-30 -61.07 -40.36 93.38 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.503 0.557 . . . . 60.32 112.503 177.879 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -67.82 -41.86 82.42 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-O 124.859 2.266 . . . . 57.84 115.163 -177.476 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 39.0 m -58.9 -52.73 64.47 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 113.091 -1.868 . . . . 42.79 108.959 173.222 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.37 -38.36 83.63 Favored 'General case' 0 C--N 1.32 -0.701 0 C-N-CA 123.96 0.904 . . . . 43.2 112.497 -179.186 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 36.2 ttm105 -60.62 -51.52 69.04 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.462 0.649 . . . . 78.21 110.238 176.848 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 31.2 mm -57.09 -44.99 84.07 Favored 'Isoleucine or valine' 0 C--O 1.25 1.082 0 CA-C-N 115.9 -0.591 . . . . 42.91 111.179 178.996 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -65.47 -44.58 86.7 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 118.299 -1.36 . . . . 35.13 108.883 -172.098 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -53.26 -44.39 64.83 Favored Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 124.684 1.135 . . . . 44.35 113.369 177.366 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 20.9 mt -65.95 -38.76 82.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 117.885 0.843 . . . . 41.49 110.464 176.227 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 5.7 mm100 -70.94 -40.18 72.19 Favored 'General case' 0 C--N 1.346 0.426 0 CA-C-N 120.448 1.476 . . . . 39.05 110.131 178.875 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.31 -48.8 78.01 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 112.258 0.466 . . . . 35.63 112.258 178.846 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -58.17 -37.27 74.4 Favored 'General case' 0 C--N 1.351 0.65 0 C-N-CA 119.526 -0.87 . . . . 38.23 112.428 -179.467 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 25.2 mtmt -71.59 -15.91 62.28 Favored 'General case' 0 CA--C 1.526 0.055 0 CA-C-O 118.004 -0.998 . . . . 39.81 112.825 178.073 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 56.8 mtm-85 -102.43 12.46 36.5 Favored 'General case' 0 C--O 1.249 1.048 0 CA-C-N 120.238 1.381 . . . . 81.79 114.698 174.055 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 54.1 m -55.39 -41.6 72.87 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 116.623 2.083 . . . . 37.71 116.623 -175.686 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 65.8 p-90 -63.23 -31.13 72.2 Favored 'General case' 0 C--N 1.317 -0.821 0 C-N-CA 127.845 2.458 . . . . 77.82 110.247 178.888 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -75.81 -20.95 57.8 Favored 'General case' 0 C--O 1.237 0.426 0 O-C-N 119.437 -2.039 . . . . 72.73 114.221 175.576 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 94.4 mt -97.42 -35.59 10.63 Favored 'General case' 0 C--O 1.238 0.465 0 O-C-N 120.242 -1.536 . . . . 46.16 113.39 178.571 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 2.2 mm -103.76 109.85 62.89 Favored Pre-proline 0 C--N 1.331 -0.202 0 N-CA-C 107.839 -1.171 . . . . 41.82 107.839 -177.14 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_exo -48.52 -42.82 34.69 Favored 'Trans proline' 0 N--CA 1.446 -1.289 0 C-N-CA 124.962 3.775 . . . . 54.05 115.489 -166.009 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 93.9 mt -102.23 15.43 29.16 Favored 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 115.011 1.485 . . . . 63.9 115.011 -179.352 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 6.4 m -74.76 157.04 35.89 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 119.696 1.135 . . . . 60.2 110.84 170.122 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' HIS . . . . . 0.544 ' ND1' ' O1 ' ' A' ' 201' ' ' TLA . 55.7 m80 -100.71 137.76 19.92 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-O 121.985 0.898 . . . . 86.3 110.667 179.445 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -57.45 147.7 76.55 Favored 'Trans proline' 0 C--N 1.318 -1.034 0 C-N-CA 122.362 2.041 . . . . 74.71 110.259 176.453 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -164.92 162.47 20.71 Favored 'General case' 0 C--O 1.223 -0.328 0 CA-C-O 123.433 1.587 . . . . 70.8 113.376 175.732 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 11.0 mmt -90.2 95.11 10.04 Favored 'General case' 0 N--CA 1.445 -0.725 0 CA-C-O 116.25 -1.833 . . . . 72.97 112.299 178.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 46.6 mt -69.94 136.99 51.15 Favored 'General case' 0 C--O 1.239 0.513 0 CA-C-N 120.387 1.449 . . . . 57.36 110.666 176.651 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 20.2 p -97.53 -21.86 16.86 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 115.67 -2.412 . . . . 57.38 110.141 179.69 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 15.4 ttpt -157.79 133.47 9.13 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 119.001 -1.08 . . . . 77.21 110.98 -177.649 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 23.1 t -135.45 126.31 44.44 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 CA-C-N 114.509 -1.223 . . . . 47.79 109.137 -178.883 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -131.28 125.87 33.91 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 117.918 -1.513 . . . . 76.14 111.693 -177.161 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 31.8 t -116.98 111.45 35.11 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.6 0 N-CA-C 108.654 -0.869 . . . . 49.2 108.654 -179.531 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 65.5 m-20 -107.98 127.05 53.42 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 115.922 1.823 . . . . 69.19 115.922 178.879 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 6.5 mp -110.91 141.95 43.63 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.955 0.883 . . . . 64.55 110.762 -179.954 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -147.47 119.32 8.12 Favored 'General case' 0 C--N 1.32 -0.684 0 C-N-CA 125.115 1.366 . . . . 91.46 112.059 179.218 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -78.13 134.17 37.72 Favored 'General case' 0 C--N 1.32 -0.678 0 C-N-CA 126.276 1.831 . . . . 69.23 109.179 177.628 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -131.22 89.18 42.36 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 113.299 -1.773 . . . . 65.8 106.834 -177.194 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_exo -62.59 -35.12 72.28 Favored 'Trans proline' 0 N--CA 1.458 -0.567 0 C-N-CA 124.588 3.526 . . . . 72.38 110.954 179.044 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 18.9 pm0 -52.65 -41.88 64.19 Favored 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 126.096 1.758 . . . . 87.42 113.901 176.376 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 93.2 m-70 -107.57 10.4 29.2 Favored 'General case' 0 N--CA 1.444 -0.733 0 C-N-CA 126.691 1.996 . . . . 96.07 114.662 178.625 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 30.7 m-80 56.61 54.0 7.86 Favored 'General case' 0 C--N 1.322 -0.608 0 O-C-N 120.369 -1.457 . . . . 85.89 114.481 177.875 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 13.2 ptt180 -172.41 168.16 5.53 Favored 'General case' 0 C--O 1.224 -0.272 0 N-CA-C 114.177 1.177 . . . . 74.6 114.177 -177.087 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 22.6 t -104.6 137.94 31.49 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.574 0 CA-C-N 114.683 -1.144 . . . . 56.79 109.84 177.949 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 41.1 ttt-85 -105.61 126.2 51.86 Favored 'General case' 0 C--O 1.222 -0.389 0 N-CA-C 109.021 -0.733 . . . . 61.61 109.021 175.233 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 63.1 mt -111.17 121.52 63.96 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 CA-C-O 117.27 -1.347 . . . . 48.23 108.428 179.475 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -119.01 128.6 54.53 Favored 'General case' 0 N--CA 1.443 -0.801 0 CA-C-O 117.998 -1.001 . . . . 80.76 109.943 179.21 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 66.9 p -121.58 161.21 22.81 Favored 'General case' 0 C--O 1.222 -0.382 0 O-C-N 124.83 1.331 . . . . 47.43 110.955 -178.617 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 3.8 tp -147.9 127.2 13.04 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 125.855 1.662 . . . . 64.18 110.737 -179.163 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 89.4 m -128.89 140.54 51.63 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-N 114.048 -1.433 . . . . 48.36 110.66 178.044 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 37.0 ttm180 -139.17 151.36 46.55 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 113.933 1.086 . . . . 79.98 113.933 177.587 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -162.98 -179.01 6.43 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 114.821 -1.082 . . . . 68.98 110.256 175.553 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 99.5 m -130.27 105.32 7.83 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 105.927 -1.879 . . . . 74.09 105.927 176.84 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -164.24 -160.55 12.08 Favored Glycine 0 CA--C 1.525 0.714 0 C-N-CA 119.996 -1.097 . . . . 83.51 111.673 -177.123 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 14.1 mttp -90.6 -34.76 15.36 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 113.637 -1.282 . . . . 100.51 110.731 -179.578 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -104.0 153.68 20.55 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 115.218 1.562 . . . . 92.1 115.218 -178.681 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -76.76 170.71 55.06 Favored Glycine 0 CA--C 1.53 1.01 1 CA-C-O 128.363 4.313 . . . . 85.83 115.515 174.916 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 15.3 m -120.89 64.15 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.668 0 CA-C-N 111.737 -2.231 . . . . 63.57 110.495 -177.912 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 25.3 mp0 -95.89 -36.58 11.05 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.379 -0.971 . . . . 62.38 108.379 178.568 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' MET . . . . . . . . . . . . . 45.7 mmm -72.39 -32.51 66.45 Favored 'General case' 0 C--N 1.328 -0.35 0 O-C-N 124.762 1.289 . . . . 42.51 111.327 -179.838 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 35.9 mp0 -65.63 -40.14 92.22 Favored 'General case' 0 C--N 1.317 -0.84 0 C-N-CA 126.5 1.92 . . . . 41.82 111.558 176.552 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -73.09 -42.3 63.13 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 123.704 0.628 . . . . 38.03 110.737 179.052 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 53.7 mt -65.61 -34.62 78.66 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-O 122.588 1.185 . . . . 40.69 113.762 177.128 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 3.9 m -71.51 -41.67 68.96 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-O 115.87 -2.014 . . . . 36.26 109.925 -179.585 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -65.97 -40.15 91.03 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 119.89 1.223 . . . . 37.3 111.036 177.413 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -69.36 -38.36 78.05 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 118.881 -0.581 . . . . 38.62 110.658 178.338 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 69.3 m -66.61 -42.36 86.98 Favored 'General case' 0 C--O 1.244 0.781 0 N-CA-C 114.747 1.388 . . . . 40.29 114.747 176.826 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 50.6 t -75.58 -28.08 19.48 Favored 'Isoleucine or valine' 0 C--N 1.351 0.648 0 O-C-N 120.549 -1.345 . . . . 35.23 111.715 179.113 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -62.54 -47.78 82.41 Favored 'General case' 0 N--CA 1.469 0.483 0 O-C-N 118.847 -2.408 . . . . 35.89 110.646 171.854 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -58.81 -41.49 86.9 Favored 'General case' 0 N--CA 1.453 -0.299 0 O-C-N 119.165 -2.209 . . . . 42.51 112.744 174.994 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 50.5 mt -64.9 -34.79 79.23 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 112.072 0.397 . . . . 38.53 112.072 176.74 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 40.7 m -70.45 -39.62 74.2 Favored 'General case' 0 C--O 1.24 0.562 0 O-C-N 119.139 -2.225 . . . . 42.45 110.901 178.862 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 4.5 mm -60.2 -51.49 72.36 Favored 'Isoleucine or valine' 0 C--O 1.247 0.951 0 CA-C-O 124.94 2.305 . . . . 45.86 106.427 176.221 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' TYR . . . . . . . . . . . . . 19.2 t80 -56.82 -49.08 76.45 Favored 'General case' 0 N--CA 1.473 0.693 0 O-C-N 120.114 -1.616 . . . . 48.28 111.611 176.498 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -52.96 -47.28 68.25 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 119.049 -1.06 . . . . 44.53 113.595 -177.84 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 8.7 mtp -70.65 -14.77 62.6 Favored 'General case' 0 N--CA 1.429 -1.521 0 C-N-CA 125.667 1.587 . . . . 57.49 114.912 -178.399 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' CYS . . . . . . . . . . . . . 82.2 m -111.54 6.32 20.03 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 120.374 1.443 . . . . 57.53 110.443 179.522 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 5.6 ttpt -50.74 -48.29 59.12 Favored 'General case' 0 C--N 1.323 -0.578 0 O-C-N 120.633 -1.292 . . . . 77.23 113.906 -178.188 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -66.51 -29.0 69.0 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 115.565 1.691 . . . . 59.99 115.565 -173.865 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 60.0 t -78.47 -70.54 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.039 0 C-N-CA 125.36 1.464 . . . . 65.49 111.745 178.396 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 64.5 tt0 -114.51 127.54 55.86 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 124.326 2.012 . . . . 65.61 113.219 -177.82 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.5 -21.95 16.83 Favored 'General case' 0 C--N 1.327 -0.388 0 O-C-N 120.564 -1.335 . . . . 85.05 113.419 -174.97 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 31.6 p-10 -98.88 33.53 2.31 Favored 'General case' 0 C--N 1.32 -0.678 0 C-N-CA 125.022 1.329 . . . . 71.74 114.053 179.982 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 46.4 mtm -76.42 146.85 38.36 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 104.994 -2.224 . . . . 49.75 104.994 176.677 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 88.7 t -116.84 139.04 45.47 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.883 0 CA-C-N 115.265 -0.879 . . . . 48.03 110.791 -178.723 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' ILE . . . . . . . . . . . . . 63.7 mt -107.45 131.01 58.71 Favored 'Isoleucine or valine' 0 C--O 1.239 0.517 0 N-CA-C 106.506 -1.664 . . . . 48.25 106.506 177.491 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . 141.31 156.18 6.73 Favored Glycine 0 C--N 1.315 -0.635 0 CA-C-N 118.394 0.543 . . . . 54.19 112.691 177.121 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_endo -80.95 167.08 73.61 Favored 'Cis proline' 0 C--N 1.321 -0.918 0 CA-C-O 124.974 1.989 . . . . 49.7 113.651 -2.84 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 21.2 t -122.19 107.65 20.2 Favored 'Isoleucine or valine' 0 C--O 1.25 1.094 0 O-C-N 119.685 -1.885 . . . . 44.16 106.118 177.898 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 6.4 ptt-85 -148.28 166.32 28.34 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 118.643 -1.223 . . . . 58.85 112.724 -179.113 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 1.1 tp -78.5 156.83 29.08 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 114.417 -1.265 . . . . 63.51 113.914 176.306 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 63.5 mt -123.13 -37.21 2.74 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.834 0.826 . . . . 78.9 109.627 178.898 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -157.74 154.66 28.57 Favored 'General case' 0 C--O 1.226 -0.155 0 N-CA-C 114.421 1.267 . . . . 92.73 114.421 -178.914 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.85 124.66 4.43 Favored 'General case' 0 C--O 1.234 0.247 0 O-C-N 123.377 0.423 . . . . 100.51 111.217 179.081 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 9.1 t . . . . . 0 C--O 1.25 1.089 0 CA-C-O 117.263 -1.351 . . . . 100.51 110.029 177.944 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.493 1.709 0 N-CA-C 116.004 1.853 . . . . 100.51 116.004 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' SER . . . . . . . . . . . . . 11.4 t -93.48 -63.3 1.22 Allowed 'General case' 0 C--N 1.328 -0.355 0 O-C-N 120.098 -1.627 . . . . 100.51 110.581 -179.712 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 59.81 55.44 30.42 Favored Glycine 0 CA--C 1.526 0.725 0 C-N-CA 119.889 -1.148 . . . . 100.51 113.726 179.819 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -96.5 114.3 25.95 Favored 'General case' 0 CA--C 1.531 0.244 0 O-C-N 120.405 -1.644 . . . . 100.51 109.709 178.877 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 7.0 t80 -128.69 154.64 46.1 Favored 'General case' 0 C--O 1.243 0.75 0 N-CA-C 109.529 -0.545 . . . . 100.51 109.529 -177.204 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.334 0 CA-C-O 115.609 -2.138 . . . . 100.51 109.329 -179.457 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' TLA . . . . . 0.544 ' O1 ' ' ND1' ' A' ' 77' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 15' ' ' MET . . . . . 0.42 ' SD ' ' CD2' ' A' ' 77' ' ' HIS . 22.3 ptt? . . . . . 0 N--CA 1.49 1.532 0 CA-C-O 122.965 1.364 . . . . 100.51 110.018 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 4.1 t -78.27 142.82 13.6 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.325 0 CA-C-N 115.102 -0.954 . . . . 100.51 111.894 -177.556 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 12.7 t0 -61.03 142.05 56.92 Favored 'General case' 0 C--N 1.33 -0.246 0 O-C-N 122.182 -0.324 . . . . 100.51 110.145 179.126 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 34.8 m -124.13 4.43 5.01 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 N-CA-C 113.826 1.047 . . . . 100.51 113.826 -179.183 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.4 p -68.04 -21.66 65.0 Favored 'General case' 0 C--O 1.239 0.541 0 N-CA-C 115.389 1.625 . . . . 100.51 115.389 -178.28 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -71.23 -93.03 0.01 OUTLIER 'General case' 0 C--O 1.242 0.663 0 N-CA-C 113.772 1.027 . . . . 100.51 113.772 178.391 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' LYS . . . . . 0.409 ' NZ ' ' HA ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -64.98 123.62 19.92 Favored 'General case' 0 C--O 1.237 0.439 0 CA-C-O 116.344 -1.789 . . . . 100.51 110.445 -179.556 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 22' ' ' ALA . . . . . 0.473 ' HB2' ' HD3' ' A' ' 108' ' ' LYS . . . -164.49 160.63 20.65 Favored 'General case' 0 C--O 1.242 0.683 0 N-CA-C 116.732 2.123 . . . . 100.51 116.732 -174.722 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 23' ' ' GLU . . . . . 0.411 ' HB2' ' O ' ' A' ' 22' ' ' ALA . 10.1 mm-40 81.0 104.14 0.06 Allowed 'General case' 0 N--CA 1.447 -0.603 0 CA-C-O 124.88 2.276 . . . . 100.51 114.953 175.496 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -179.86 169.86 1.25 Allowed 'General case' 0 N--CA 1.444 -0.726 0 O-C-N 119.474 -2.016 . . . . 100.51 109.522 179.253 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 53.9 t -88.59 105.18 15.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.011 -0.995 . . . . 93.73 109.446 175.504 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 1.5 mmt-85 -95.4 147.52 23.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.432 -0.804 . . . . 97.2 110.283 -179.669 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -157.31 149.46 22.68 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 118.318 -1.353 . . . . 76.76 112.97 -178.401 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ALA . . . . . 0.485 ' HB3' ' O ' ' A' ' 111' ' ' VAL . . . -153.07 153.15 32.26 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-O 124.769 2.224 . . . . 55.2 111.003 177.166 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 4.7 mtp85 -133.27 134.51 44.02 Favored 'General case' 0 CA--C 1.534 0.352 0 O-C-N 118.657 -2.527 . . . . 81.07 107.098 -178.592 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -131.2 166.45 21.11 Favored 'General case' 0 C--O 1.242 0.685 0 C-N-CA 119.285 -0.966 . . . . 48.8 108.639 -176.805 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -143.53 153.64 42.79 Favored 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 116.56 -2.056 . . . . 58.07 108.344 178.48 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -144.68 158.33 43.82 Favored 'General case' 0 C--N 1.316 -0.856 0 O-C-N 124.779 1.299 . . . . 41.83 108.096 -179.874 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 82.8 m-85 -135.6 139.65 44.0 Favored 'General case' 0 C--O 1.241 0.617 0 CA-C-O 121.95 0.881 . . . . 51.98 110.333 -179.078 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' VAL . . . . . 0.461 ' O ' ' HB2' ' A' ' 96' ' ' ARG . 39.3 t -117.56 119.31 61.3 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 C-N-CA 119.295 -0.962 . . . . 50.54 109.104 167.84 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 28.2 m -96.32 137.46 35.36 Favored 'General case' 0 C--N 1.322 -0.604 0 O-C-N 120.504 -1.373 . . . . 55.97 111.37 178.992 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 13.7 ptp -153.7 177.43 10.98 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.518 0.562 . . . . 61.11 112.518 -176.667 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 15.0 mtm-85 -71.03 161.84 30.46 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 109.751 -0.463 . . . . 69.01 109.751 175.64 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 5.4 p -64.16 -39.77 94.73 Favored 'General case' 0 C--N 1.32 -0.705 0 C-N-CA 124.336 1.054 . . . . 63.52 113.153 178.137 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -69.08 -34.5 75.23 Favored 'General case' 0 C--O 1.226 -0.174 0 O-C-N 120.674 -1.266 . . . . 74.76 111.194 -179.683 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 89.9 m -65.17 -51.01 63.72 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-O 116.911 -1.518 . . . . 66.13 107.28 176.909 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 42.8 tp -60.85 -37.61 82.69 Favored 'General case' 0 N--CA 1.448 -0.531 0 O-C-N 125.331 1.645 . . . . 63.47 113.558 177.454 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -55.27 -42.87 74.11 Favored 'General case' 0 C--O 1.244 0.789 0 N-CA-C 114.289 1.218 . . . . 60.76 114.289 172.72 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' MET . . . . . 0.59 ' HE1' HG21 ' A' ' 133' ' ' VAL . 10.6 mtm -63.12 -45.58 91.31 Favored 'General case' 0 N--CA 1.455 -0.212 0 O-C-N 120.216 -1.552 . . . . 73.29 113.53 177.076 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ILE . . . . . 0.707 ' O ' ' HA3' ' A' ' 47' ' ' GLY . 4.1 mt -54.99 -59.52 2.31 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.519 0 N-CA-C 109.086 -0.709 . . . . 70.4 109.086 176.931 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ILE . . . . . 0.672 ' HA ' ' HD2' ' A' ' 48' ' ' ARG . 61.9 mt -52.47 -40.04 31.21 Favored 'Isoleucine or valine' 0 C--O 1.234 0.27 0 CA-C-O 122.234 1.016 . . . . 83.66 112.637 -179.337 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -86.19 4.2 39.61 Favored 'General case' 0 CA--C 1.48 -1.745 1 N-CA-C 125.207 5.262 . . . . 100.51 125.207 -172.651 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 47' ' ' GLY . . . . . 0.707 ' HA3' ' O ' ' A' ' 44' ' ' ILE . . . 126.97 -98.74 0.52 Allowed Glycine 0 N--CA 1.402 -3.605 3 C-N-CA 139.287 8.089 . . . . 100.51 107.99 0.339 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ARG . . . . . 0.672 ' HD2' ' HA ' ' A' ' 45' ' ' ILE . 0.0 OUTLIER -59.48 158.39 9.76 Favored 'General case' 0 N--CA 1.442 -0.867 0 CA-C-N 108.89 -3.655 . . . . 100.51 109.155 178.817 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 55.2 m-70 56.39 20.36 4.67 Favored 'General case' 0 C--O 1.239 0.525 0 C-N-CA 124.423 1.089 . . . . 100.51 113.078 176.651 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 30.5 m-70 -114.35 -117.18 0.32 Allowed 'General case' 0 N--CA 1.442 -0.854 0 O-C-N 121.231 -0.918 . . . . 100.51 112.477 179.623 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -98.49 -62.89 1.18 Allowed 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 116.979 2.214 . . . . 100.51 116.979 -175.951 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -117.25 67.35 0.32 Allowed Glycine 0 CA--C 1.536 1.346 0 N-CA-C 107.169 -2.372 . . . . 88.79 107.169 -179.217 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ASP . . . . . 0.416 ' CG ' ' HA ' ' A' ' 48' ' ' ARG . 58.8 t0 -58.06 111.51 1.21 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 122.492 1.139 . . . . 71.11 111.916 -176.443 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 38.9 t -54.12 -44.79 64.89 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 C-N-CA 124.039 0.936 . . . . 65.08 113.409 177.934 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 4.4 m-30 -61.07 -40.36 93.38 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.503 0.557 . . . . 60.32 112.503 177.879 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -67.82 -41.86 82.42 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-O 124.859 2.266 . . . . 57.84 115.163 -177.476 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 39.0 m -58.9 -52.73 64.47 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 113.091 -1.868 . . . . 42.79 108.959 173.222 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.37 -38.36 83.63 Favored 'General case' 0 C--N 1.32 -0.701 0 C-N-CA 123.96 0.904 . . . . 43.2 112.497 -179.186 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 36.2 ttm105 -60.62 -51.52 69.04 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.462 0.649 . . . . 78.21 110.238 176.848 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ILE . . . . . 0.533 ' O ' ' HG2' ' A' ' 64' ' ' GLN . 31.2 mm -57.09 -44.99 84.07 Favored 'Isoleucine or valine' 0 C--O 1.25 1.082 0 CA-C-N 115.9 -0.591 . . . . 42.91 111.179 178.996 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -65.47 -44.58 86.7 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 118.299 -1.36 . . . . 35.13 108.883 -172.098 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -53.26 -44.39 64.83 Favored Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 124.684 1.135 . . . . 44.35 113.369 177.366 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 20.9 mt -65.95 -38.76 82.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 117.885 0.843 . . . . 41.49 110.464 176.227 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' GLN . . . . . 0.533 ' HG2' ' O ' ' A' ' 60' ' ' ILE . 5.7 mm100 -70.94 -40.18 72.19 Favored 'General case' 0 C--N 1.346 0.426 0 CA-C-N 120.448 1.476 . . . . 48.07 110.131 178.875 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.31 -48.8 78.01 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 112.258 0.466 . . . . 35.63 112.258 178.846 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -58.17 -37.27 74.4 Favored 'General case' 0 C--N 1.351 0.65 0 C-N-CA 119.526 -0.87 . . . . 38.23 112.428 -179.467 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' LYS . . . . . 0.424 ' HE3' ' OE1' ' A' ' 64' ' ' GLN . 25.2 mtmt -71.59 -15.91 62.28 Favored 'General case' 0 CA--C 1.526 0.055 0 CA-C-O 118.004 -0.998 . . . . 39.81 112.825 178.073 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 56.8 mtm-85 -102.43 12.46 36.5 Favored 'General case' 0 C--O 1.249 1.048 0 CA-C-N 120.238 1.381 . . . . 81.79 114.698 174.055 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 54.1 m -55.39 -41.6 72.87 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 116.623 2.083 . . . . 37.71 116.623 -175.686 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 65.8 p-90 -63.23 -31.13 72.2 Favored 'General case' 0 C--N 1.317 -0.821 0 C-N-CA 127.845 2.458 . . . . 77.82 110.247 178.888 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -75.81 -20.95 57.8 Favored 'General case' 0 C--O 1.237 0.426 0 O-C-N 119.437 -2.039 . . . . 72.73 114.221 175.576 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 94.4 mt -97.42 -35.59 10.63 Favored 'General case' 0 C--O 1.238 0.465 0 O-C-N 120.242 -1.536 . . . . 46.16 113.39 178.571 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 2.2 mm -103.76 109.85 62.89 Favored Pre-proline 0 C--N 1.331 -0.202 0 N-CA-C 107.839 -1.171 . . . . 41.82 107.839 -177.14 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_exo -48.52 -42.82 34.69 Favored 'Trans proline' 0 N--CA 1.446 -1.289 0 C-N-CA 124.962 3.775 . . . . 54.05 115.489 -166.009 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 93.9 mt -102.23 15.43 29.16 Favored 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 115.011 1.485 . . . . 63.9 115.011 -179.352 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 6.4 m -74.76 157.04 35.89 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 119.696 1.135 . . . . 60.2 110.84 170.122 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' HIS . . . . . 0.479 ' O ' HD13 ' A' ' 79' ' ' LEU . 55.7 m80 -100.71 137.76 19.92 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-O 121.985 0.898 . . . . 86.3 110.667 179.445 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -57.45 147.7 76.55 Favored 'Trans proline' 0 C--N 1.318 -1.034 0 C-N-CA 122.362 2.041 . . . . 74.71 110.259 176.453 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' LEU . . . . . 0.479 HD13 ' O ' ' A' ' 77' ' ' HIS . 0.0 OUTLIER -164.92 162.47 20.71 Favored 'General case' 0 C--O 1.223 -0.328 0 CA-C-O 123.433 1.587 . . . . 70.8 113.376 175.732 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 80' ' ' MET . . . . . 0.409 ' HB3' ' O ' ' A' ' 205' ' ' HOH . 11.0 mmt -90.2 95.11 10.04 Favored 'General case' 0 N--CA 1.445 -0.725 0 CA-C-O 116.25 -1.833 . . . . 72.97 112.299 178.995 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 46.6 mt -69.94 136.99 51.15 Favored 'General case' 0 C--O 1.239 0.513 0 CA-C-N 120.387 1.449 . . . . 57.36 110.666 176.651 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 20.2 p -97.53 -21.86 16.86 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 115.67 -2.412 . . . . 57.38 110.141 179.69 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 15.4 ttpt -157.79 133.47 9.13 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 119.001 -1.08 . . . . 77.21 110.98 -177.649 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 23.1 t -135.45 126.31 44.44 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 CA-C-N 114.509 -1.223 . . . . 47.79 109.137 -178.883 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -131.28 125.87 33.91 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 117.918 -1.513 . . . . 76.14 111.693 -177.161 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 31.8 t -116.98 111.45 35.11 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.6 0 N-CA-C 108.654 -0.869 . . . . 49.2 108.654 -179.531 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 65.5 m-20 -107.98 127.05 53.42 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 115.922 1.823 . . . . 69.19 115.922 178.879 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' LEU . . . . . 0.65 HD21 HD11 ' A' ' 126' ' ' ILE . 6.5 mp -110.91 141.95 43.63 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.955 0.883 . . . . 64.55 110.762 -179.954 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 89' ' ' GLN . . . . . 0.401 ' HA ' ' OE1' ' A' ' 89' ' ' GLN . 2.2 tp-100 -147.47 119.32 8.12 Favored 'General case' 0 C--N 1.32 -0.684 0 C-N-CA 125.115 1.366 . . . . 91.46 112.059 179.218 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -78.13 134.17 37.72 Favored 'General case' 0 C--N 1.32 -0.678 0 C-N-CA 126.276 1.831 . . . . 69.23 109.179 177.628 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -131.22 89.18 42.36 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 113.299 -1.773 . . . . 65.8 106.834 -177.194 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_exo -62.59 -35.12 72.28 Favored 'Trans proline' 0 N--CA 1.458 -0.567 0 C-N-CA 124.588 3.526 . . . . 72.38 110.954 179.044 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 18.9 pm0 -52.65 -41.88 64.19 Favored 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 126.096 1.758 . . . . 87.42 113.901 176.376 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 93.2 m-70 -107.57 10.4 29.2 Favored 'General case' 0 N--CA 1.444 -0.733 0 C-N-CA 126.691 1.996 . . . . 96.07 114.662 178.625 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 30.7 m-80 56.61 54.0 7.86 Favored 'General case' 0 C--N 1.322 -0.608 0 O-C-N 120.369 -1.457 . . . . 85.89 114.481 177.875 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' ARG . . . . . 0.461 ' HB2' ' O ' ' A' ' 34' ' ' VAL . 13.2 ptt180 -172.41 168.16 5.53 Favored 'General case' 0 C--O 1.224 -0.272 0 N-CA-C 114.177 1.177 . . . . 74.6 114.177 -177.087 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 22.6 t -104.6 137.94 31.49 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.574 0 CA-C-N 114.683 -1.144 . . . . 56.79 109.84 177.949 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 41.1 ttt-85 -105.61 126.2 51.86 Favored 'General case' 0 C--O 1.222 -0.389 0 N-CA-C 109.021 -0.733 . . . . 61.61 109.021 175.233 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 63.1 mt -111.17 121.52 63.96 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 CA-C-O 117.27 -1.347 . . . . 48.23 108.428 179.475 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -119.01 128.6 54.53 Favored 'General case' 0 N--CA 1.443 -0.801 0 CA-C-O 117.998 -1.001 . . . . 80.76 109.943 179.21 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 66.9 p -121.58 161.21 22.81 Favored 'General case' 0 C--O 1.222 -0.382 0 O-C-N 124.83 1.331 . . . . 47.43 110.955 -178.617 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 3.8 tp -147.9 127.2 13.04 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 125.855 1.662 . . . . 64.18 110.737 -179.163 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 89.4 m -128.89 140.54 51.63 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-N 114.048 -1.433 . . . . 48.36 110.66 178.044 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 37.0 ttm180 -139.17 151.36 46.55 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 113.933 1.086 . . . . 79.98 113.933 177.587 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' LEU . . . . . 0.538 HD22 HG13 ' A' ' 111' ' ' VAL . 0.6 OUTLIER -162.98 -179.01 6.43 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 114.821 -1.082 . . . . 68.98 110.256 175.553 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 99.5 m -130.27 105.32 7.83 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 105.927 -1.879 . . . . 74.09 105.927 176.84 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -164.24 -160.55 12.08 Favored Glycine 0 CA--C 1.525 0.714 0 C-N-CA 119.996 -1.097 . . . . 83.51 111.673 -177.123 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' LYS . . . . . 0.473 ' HD3' ' HB2' ' A' ' 22' ' ' ALA . 14.1 mttp -90.6 -34.76 15.36 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 113.637 -1.282 . . . . 100.51 110.731 -179.578 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 109' ' ' THR . . . . . 0.568 HG21 ' O1 ' ' A' ' 201' ' ' TLA . 0.0 OUTLIER -104.0 153.68 20.55 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 115.218 1.562 . . . . 92.1 115.218 -178.681 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -76.76 170.71 55.06 Favored Glycine 0 CA--C 1.53 1.01 1 CA-C-O 128.363 4.313 . . . . 85.83 115.515 174.916 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 111' ' ' VAL . . . . . 0.538 HG13 HD22 ' A' ' 105' ' ' LEU . 15.3 m -120.89 64.15 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.668 0 CA-C-N 111.737 -2.231 . . . . 63.57 110.495 -177.912 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 25.3 mp0 -95.89 -36.58 11.05 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.379 -0.971 . . . . 62.38 108.379 178.568 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' MET . . . . . . . . . . . . . 45.7 mmm -72.39 -32.51 66.45 Favored 'General case' 0 C--N 1.328 -0.35 0 O-C-N 124.762 1.289 . . . . 42.51 111.327 -179.838 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 35.9 mp0 -65.63 -40.14 92.22 Favored 'General case' 0 C--N 1.317 -0.84 0 C-N-CA 126.5 1.92 . . . . 41.82 111.558 176.552 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -73.09 -42.3 63.13 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 123.704 0.628 . . . . 38.03 110.737 179.052 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 53.7 mt -65.61 -34.62 78.66 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-O 122.588 1.185 . . . . 40.69 113.762 177.128 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 3.9 m -71.51 -41.67 68.96 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-O 115.87 -2.014 . . . . 36.26 109.925 -179.585 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -65.97 -40.15 91.03 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 119.89 1.223 . . . . 37.3 111.036 177.413 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -69.36 -38.36 78.05 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 118.881 -0.581 . . . . 38.62 110.658 178.338 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 69.3 m -66.61 -42.36 86.98 Favored 'General case' 0 C--O 1.244 0.781 0 N-CA-C 114.747 1.388 . . . . 40.29 114.747 176.826 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 50.6 t -75.58 -28.08 19.48 Favored 'Isoleucine or valine' 0 C--N 1.351 0.648 0 O-C-N 120.549 -1.345 . . . . 35.23 111.715 179.113 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -62.54 -47.78 82.41 Favored 'General case' 0 N--CA 1.469 0.483 0 O-C-N 118.847 -2.408 . . . . 35.89 110.646 171.854 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -58.81 -41.49 86.9 Favored 'General case' 0 N--CA 1.453 -0.299 0 O-C-N 119.165 -2.209 . . . . 42.51 112.744 174.994 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 50.5 mt -64.9 -34.79 79.23 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 112.072 0.397 . . . . 38.53 112.072 176.74 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' THR . . . . . 0.583 ' O ' ' HG3' ' A' ' 129' ' ' MET . 40.7 m -70.45 -39.62 74.2 Favored 'General case' 0 C--O 1.24 0.562 0 O-C-N 119.139 -2.225 . . . . 42.45 110.901 178.862 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 126' ' ' ILE . . . . . 0.65 HD11 HD21 ' A' ' 88' ' ' LEU . 4.5 mm -60.2 -51.49 72.36 Favored 'Isoleucine or valine' 0 C--O 1.247 0.951 0 CA-C-O 124.94 2.305 . . . . 45.86 106.427 176.221 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 127' ' ' TYR . . . . . . . . . . . . . 19.2 t80 -56.82 -49.08 76.45 Favored 'General case' 0 N--CA 1.473 0.693 0 O-C-N 120.114 -1.616 . . . . 48.28 111.611 176.498 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -52.96 -47.28 68.25 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 119.049 -1.06 . . . . 44.53 113.595 -177.84 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' MET . . . . . 0.583 ' HG3' ' O ' ' A' ' 125' ' ' THR . 8.7 mtp -70.65 -14.77 62.6 Favored 'General case' 0 N--CA 1.429 -1.521 0 C-N-CA 125.667 1.587 . . . . 57.49 114.912 -178.399 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 130' ' ' CYS . . . . . . . . . . . . . 82.2 m -111.54 6.32 20.03 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 120.374 1.443 . . . . 57.53 110.443 179.522 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 5.6 ttpt -50.74 -48.29 59.12 Favored 'General case' 0 C--N 1.323 -0.578 0 O-C-N 120.633 -1.292 . . . . 77.23 113.906 -178.188 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -66.51 -29.0 69.0 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 115.565 1.691 . . . . 59.99 115.565 -173.865 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' VAL . . . . . 0.59 HG21 ' HE1' ' A' ' 43' ' ' MET . 60.0 t -78.47 -70.54 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.039 0 C-N-CA 125.36 1.464 . . . . 65.49 111.745 178.396 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 64.5 tt0 -114.51 127.54 55.86 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 124.326 2.012 . . . . 65.61 113.219 -177.82 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 135' ' ' LYS . . . . . 0.407 ' HD2' ' N ' ' A' ' 136' ' ' ASP . 0.0 OUTLIER -97.5 -21.95 16.83 Favored 'General case' 0 C--N 1.327 -0.388 0 O-C-N 120.564 -1.335 . . . . 85.05 113.419 -174.97 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 136' ' ' ASP . . . . . 0.407 ' N ' ' HD2' ' A' ' 135' ' ' LYS . 31.6 p-10 -98.88 33.53 2.31 Favored 'General case' 0 C--N 1.32 -0.678 0 C-N-CA 125.022 1.329 . . . . 71.74 114.053 179.982 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 46.4 mtm -76.42 146.85 38.36 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 104.994 -2.224 . . . . 49.75 104.994 176.677 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 88.7 t -116.84 139.04 45.47 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.883 0 CA-C-N 115.265 -0.879 . . . . 48.03 110.791 -178.723 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 139' ' ' ILE . . . . . . . . . . . . . 63.7 mt -107.45 131.01 58.71 Favored 'Isoleucine or valine' 0 C--O 1.239 0.517 0 N-CA-C 106.506 -1.664 . . . . 48.25 106.506 177.491 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . 141.31 156.18 6.73 Favored Glycine 0 C--N 1.315 -0.635 0 CA-C-N 118.394 0.543 . . . . 54.19 112.691 177.121 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_endo -80.95 167.08 73.61 Favored 'Cis proline' 0 C--N 1.321 -0.918 0 CA-C-O 124.974 1.989 . . . . 49.7 113.651 -2.84 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 21.2 t -122.19 107.65 20.2 Favored 'Isoleucine or valine' 0 C--O 1.25 1.094 0 O-C-N 119.685 -1.885 . . . . 44.16 106.118 177.898 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 6.4 ptt-85 -148.28 166.32 28.34 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 118.643 -1.223 . . . . 58.85 112.724 -179.113 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 1.1 tp -78.5 156.83 29.08 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 114.417 -1.265 . . . . 63.51 113.914 176.306 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 63.5 mt -123.13 -37.21 2.74 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.834 0.826 . . . . 78.9 109.627 178.898 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -157.74 154.66 28.57 Favored 'General case' 0 C--O 1.226 -0.155 0 N-CA-C 114.421 1.267 . . . . 92.73 114.421 -178.914 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 147' ' ' LYS . . . . . 0.407 ' HE2' ' OG ' ' A' ' 152' ' ' SER . 0.0 OUTLIER -158.85 124.66 4.43 Favored 'General case' 0 C--O 1.234 0.247 0 O-C-N 123.377 0.423 . . . . 100.51 111.217 179.081 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 9.1 t . . . . . 0 C--O 1.25 1.089 0 CA-C-O 117.263 -1.351 . . . . 100.51 110.029 177.944 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.493 1.709 0 N-CA-C 116.004 1.853 . . . . 100.51 116.004 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 152' ' ' SER . . . . . 0.407 ' OG ' ' HE2' ' A' ' 147' ' ' LYS . 11.4 t -93.48 -63.3 1.22 Allowed 'General case' 0 C--N 1.328 -0.355 0 O-C-N 120.098 -1.627 . . . . 100.51 110.581 -179.712 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 59.81 55.44 30.42 Favored Glycine 0 CA--C 1.526 0.725 0 C-N-CA 119.889 -1.148 . . . . 100.51 113.726 179.819 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -96.5 114.3 25.95 Favored 'General case' 0 CA--C 1.531 0.244 0 O-C-N 120.405 -1.644 . . . . 100.51 109.709 178.877 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 7.0 t80 -128.69 154.64 46.1 Favored 'General case' 0 C--O 1.243 0.75 0 N-CA-C 109.529 -0.545 . . . . 100.51 109.529 -177.204 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.334 0 CA-C-O 115.609 -2.138 . . . . 100.51 109.329 -179.457 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' TLA . . . . . 0.568 ' O1 ' HG21 ' A' ' 109' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 205' ' ' HOH . . . . . 0.409 ' O ' ' HB3' ' A' ' 80' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' MET . . . . . 0.42 ' SD ' ' CD2' ' A' ' 77' ' ' HIS . 22.3 ptt? . . . . . 0 N--CA 1.49 1.532 0 CA-C-O 122.965 1.364 . . . . 100.51 110.018 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 4.1 t -78.27 142.82 13.6 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.325 0 CA-C-N 115.102 -0.954 . . . . 100.51 111.894 -177.556 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 12.7 t0 -61.03 142.05 56.92 Favored 'General case' 0 C--N 1.33 -0.246 0 O-C-N 122.182 -0.324 . . . . 100.51 110.145 179.126 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 34.8 m -124.13 4.43 5.01 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 N-CA-C 113.826 1.047 . . . . 100.51 113.826 -179.183 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.4 p -68.04 -21.66 65.0 Favored 'General case' 0 C--O 1.239 0.541 0 N-CA-C 115.389 1.625 . . . . 100.51 115.389 -178.28 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -71.23 -93.03 0.01 OUTLIER 'General case' 0 C--O 1.242 0.663 0 N-CA-C 113.772 1.027 . . . . 100.51 113.772 178.391 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.409 ' NZ ' ' HA ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -64.98 123.62 19.92 Favored 'General case' 0 C--O 1.237 0.439 0 CA-C-O 116.344 -1.789 . . . . 100.51 110.445 -179.556 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.473 ' HB2' ' HD3' ' A' ' 108' ' ' LYS . . . -164.49 160.63 20.65 Favored 'General case' 0 C--O 1.242 0.683 0 N-CA-C 116.732 2.123 . . . . 100.51 116.732 -174.722 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.411 ' HB2' ' O ' ' A' ' 22' ' ' ALA . 10.1 mm-40 81.0 104.14 0.06 Allowed 'General case' 0 N--CA 1.447 -0.603 0 CA-C-O 124.88 2.276 . . . . 100.51 114.953 175.496 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -179.86 169.86 1.25 Allowed 'General case' 0 N--CA 1.444 -0.726 0 O-C-N 119.474 -2.016 . . . . 100.51 109.522 179.253 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 53.9 t -88.59 105.18 15.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.011 -0.995 . . . . 93.73 109.446 175.504 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 1.5 mmt-85 -95.4 147.52 23.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.432 -0.804 . . . . 97.2 110.283 -179.669 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -157.31 149.46 22.68 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 118.318 -1.353 . . . . 76.76 112.97 -178.401 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.485 ' HB3' ' O ' ' A' ' 111' ' ' VAL . . . -153.07 153.15 32.26 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-O 124.769 2.224 . . . . 55.2 111.003 177.166 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 4.7 mtp85 -133.27 134.51 44.02 Favored 'General case' 0 CA--C 1.534 0.352 0 O-C-N 118.657 -2.527 . . . . 81.07 107.098 -178.592 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -131.2 166.45 21.11 Favored 'General case' 0 C--O 1.242 0.685 0 C-N-CA 119.285 -0.966 . . . . 48.8 108.639 -176.805 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -143.53 153.64 42.79 Favored 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 116.56 -2.056 . . . . 58.07 108.344 178.48 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -144.68 158.33 43.82 Favored 'General case' 0 C--N 1.316 -0.856 0 O-C-N 124.779 1.299 . . . . 41.83 108.096 -179.874 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 82.8 m-85 -135.6 139.65 44.0 Favored 'General case' 0 C--O 1.241 0.617 0 CA-C-O 121.95 0.881 . . . . 51.98 110.333 -179.078 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.461 ' O ' ' HB2' ' A' ' 96' ' ' ARG . 39.3 t -117.56 119.31 61.3 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 C-N-CA 119.295 -0.962 . . . . 50.54 109.104 167.84 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 28.2 m -96.32 137.46 35.36 Favored 'General case' 0 C--N 1.322 -0.604 0 O-C-N 120.504 -1.373 . . . . 55.97 111.37 178.992 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 13.7 ptp -153.7 177.43 10.98 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.518 0.562 . . . . 61.11 112.518 -176.667 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 15.0 mtm-85 -71.03 161.84 30.46 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 109.751 -0.463 . . . . 69.01 109.751 175.64 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 5.4 p -64.16 -39.77 94.73 Favored 'General case' 0 C--N 1.32 -0.705 0 C-N-CA 124.336 1.054 . . . . 63.52 113.153 178.137 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -69.08 -34.5 75.23 Favored 'General case' 0 C--O 1.226 -0.174 0 O-C-N 120.674 -1.266 . . . . 74.76 111.194 -179.683 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 89.9 m -65.17 -51.01 63.72 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-O 116.911 -1.518 . . . . 66.13 107.28 176.909 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 42.8 tp -60.85 -37.61 82.69 Favored 'General case' 0 N--CA 1.448 -0.531 0 O-C-N 125.331 1.645 . . . . 63.47 113.558 177.454 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -55.27 -42.87 74.11 Favored 'General case' 0 C--O 1.244 0.789 0 N-CA-C 114.289 1.218 . . . . 60.76 114.289 172.72 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' MET . . . . . 0.59 ' HE1' HG21 ' A' ' 133' ' ' VAL . 10.6 mtm -63.12 -45.58 91.31 Favored 'General case' 0 N--CA 1.455 -0.212 0 O-C-N 120.216 -1.552 . . . . 73.29 113.53 177.076 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.707 ' O ' ' HA3' ' A' ' 47' ' ' GLY . 4.1 mt -54.99 -59.52 2.31 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.519 0 N-CA-C 109.086 -0.709 . . . . 70.4 109.086 176.931 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.672 ' HA ' ' HD2' ' A' ' 48' ' ' ARG . 61.9 mt -52.47 -40.04 31.21 Favored 'Isoleucine or valine' 0 C--O 1.234 0.27 0 CA-C-O 122.234 1.016 . . . . 83.66 112.637 -179.337 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -86.19 4.2 39.61 Favored 'General case' 0 CA--C 1.48 -1.745 1 N-CA-C 125.207 5.262 . . . . 100.51 125.207 -172.651 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.707 ' HA3' ' O ' ' A' ' 44' ' ' ILE . . . 126.97 -98.74 0.52 Allowed Glycine 0 N--CA 1.402 -3.605 3 C-N-CA 139.287 8.089 . . . . 100.51 107.99 0.339 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.672 ' HD2' ' HA ' ' A' ' 45' ' ' ILE . 0.0 OUTLIER -59.48 158.39 9.76 Favored 'General case' 0 N--CA 1.442 -0.867 0 CA-C-N 108.89 -3.655 . . . . 100.51 109.155 178.817 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 55.2 m-70 56.39 20.36 4.67 Favored 'General case' 0 C--O 1.239 0.525 0 C-N-CA 124.423 1.089 . . . . 100.51 113.078 176.651 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 30.5 m-70 -114.35 -117.18 0.32 Allowed 'General case' 0 N--CA 1.442 -0.854 0 O-C-N 121.231 -0.918 . . . . 100.51 112.477 179.623 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -98.49 -62.89 1.18 Allowed 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 116.979 2.214 . . . . 100.51 116.979 -175.951 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -117.25 67.35 0.32 Allowed Glycine 0 CA--C 1.536 1.346 0 N-CA-C 107.169 -2.372 . . . . 88.79 107.169 -179.217 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.416 ' CG ' ' HA ' ' A' ' 48' ' ' ARG . 58.8 t0 -58.06 111.51 1.21 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 122.492 1.139 . . . . 71.11 111.916 -176.443 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 38.9 t -54.12 -44.79 64.89 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 C-N-CA 124.039 0.936 . . . . 65.08 113.409 177.934 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 4.4 m-30 -61.07 -40.36 93.38 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.503 0.557 . . . . 60.32 112.503 177.879 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -67.82 -41.86 82.42 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-O 124.859 2.266 . . . . 57.84 115.163 -177.476 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 39.0 m -58.9 -52.73 64.47 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 113.091 -1.868 . . . . 42.79 108.959 173.222 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.37 -38.36 83.63 Favored 'General case' 0 C--N 1.32 -0.701 0 C-N-CA 123.96 0.904 . . . . 43.2 112.497 -179.186 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 36.2 ttm105 -60.62 -51.52 69.04 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.462 0.649 . . . . 78.21 110.238 176.848 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.533 ' O ' ' HG2' ' A' ' 64' ' ' GLN . 31.2 mm -57.09 -44.99 84.07 Favored 'Isoleucine or valine' 0 C--O 1.25 1.082 0 CA-C-N 115.9 -0.591 . . . . 42.91 111.179 178.996 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -65.47 -44.58 86.7 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 118.299 -1.36 . . . . 35.13 108.883 -172.098 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -53.26 -44.39 64.83 Favored Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 124.684 1.135 . . . . 44.35 113.369 177.366 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 20.9 mt -65.95 -38.76 82.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 117.885 0.843 . . . . 41.49 110.464 176.227 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.533 ' HG2' ' O ' ' A' ' 60' ' ' ILE . 5.7 mm100 -70.94 -40.18 72.19 Favored 'General case' 0 C--N 1.346 0.426 0 CA-C-N 120.448 1.476 . . . . 48.07 110.131 178.875 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.31 -48.8 78.01 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 112.258 0.466 . . . . 35.63 112.258 178.846 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -58.17 -37.27 74.4 Favored 'General case' 0 C--N 1.351 0.65 0 C-N-CA 119.526 -0.87 . . . . 38.23 112.428 -179.467 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.424 ' HE3' ' OE1' ' A' ' 64' ' ' GLN . 25.2 mtmt -71.59 -15.91 62.28 Favored 'General case' 0 CA--C 1.526 0.055 0 CA-C-O 118.004 -0.998 . . . . 39.81 112.825 178.073 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 56.8 mtm-85 -102.43 12.46 36.5 Favored 'General case' 0 C--O 1.249 1.048 0 CA-C-N 120.238 1.381 . . . . 81.79 114.698 174.055 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 54.1 m -55.39 -41.6 72.87 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 116.623 2.083 . . . . 37.71 116.623 -175.686 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' TRP . . . . . . . . . . . . . 65.8 p-90 -63.23 -31.13 72.2 Favored 'General case' 0 C--N 1.317 -0.821 0 C-N-CA 127.845 2.458 . . . . 77.82 110.247 178.888 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -75.81 -20.95 57.8 Favored 'General case' 0 C--O 1.237 0.426 0 O-C-N 119.437 -2.039 . . . . 72.73 114.221 175.576 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 94.4 mt -97.42 -35.59 10.63 Favored 'General case' 0 C--O 1.238 0.465 0 O-C-N 120.242 -1.536 . . . . 46.16 113.39 178.571 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 2.2 mm -103.76 109.85 62.89 Favored Pre-proline 0 C--N 1.331 -0.202 0 N-CA-C 107.839 -1.171 . . . . 41.82 107.839 -177.14 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_exo -48.52 -42.82 34.69 Favored 'Trans proline' 0 N--CA 1.446 -1.289 0 C-N-CA 124.962 3.775 . . . . 54.05 115.489 -166.009 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 93.9 mt -102.23 15.43 29.16 Favored 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 115.011 1.485 . . . . 63.9 115.011 -179.352 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 6.4 m -74.76 157.04 35.89 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 119.696 1.135 . . . . 60.2 110.84 170.122 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' HIS . . . . . 0.479 ' O ' HD13 ' A' ' 79' ' ' LEU . 55.7 m80 -100.71 137.76 19.92 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-O 121.985 0.898 . . . . 86.3 110.667 179.445 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -57.45 147.7 76.55 Favored 'Trans proline' 0 C--N 1.318 -1.034 0 C-N-CA 122.362 2.041 . . . . 74.71 110.259 176.453 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.479 HD13 ' O ' ' A' ' 77' ' ' HIS . 0.0 OUTLIER -164.92 162.47 20.71 Favored 'General case' 0 C--O 1.223 -0.328 0 CA-C-O 123.433 1.587 . . . . 70.8 113.376 175.732 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' MET . . . . . 0.409 ' HB3' ' O ' ' A' ' 205' ' ' HOH . 11.0 mmt -90.2 95.11 10.04 Favored 'General case' 0 N--CA 1.445 -0.725 0 CA-C-O 116.25 -1.833 . . . . 72.97 112.299 178.995 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 46.6 mt -69.94 136.99 51.15 Favored 'General case' 0 C--O 1.239 0.513 0 CA-C-N 120.387 1.449 . . . . 57.36 110.666 176.651 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 20.2 p -97.53 -21.86 16.86 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 115.67 -2.412 . . . . 57.38 110.141 179.69 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 15.4 ttpt -157.79 133.47 9.13 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 119.001 -1.08 . . . . 77.21 110.98 -177.649 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 23.1 t -135.45 126.31 44.44 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 CA-C-N 114.509 -1.223 . . . . 47.79 109.137 -178.883 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -131.28 125.87 33.91 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 117.918 -1.513 . . . . 76.14 111.693 -177.161 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 31.8 t -116.98 111.45 35.11 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.6 0 N-CA-C 108.654 -0.869 . . . . 49.2 108.654 -179.531 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 65.5 m-20 -107.98 127.05 53.42 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 115.922 1.823 . . . . 69.19 115.922 178.879 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.65 HD21 HD11 ' A' ' 126' ' ' ILE . 6.5 mp -110.91 141.95 43.63 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.955 0.883 . . . . 64.55 110.762 -179.954 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.67 ' HA ' HE21 ' A' ' 89' ' ' GLN . 0.1 OUTLIER -147.47 119.32 8.12 Favored 'General case' 0 C--N 1.32 -0.684 0 C-N-CA 125.115 1.366 . . . . 91.46 112.059 179.218 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -78.13 134.17 37.72 Favored 'General case' 0 C--N 1.32 -0.678 0 C-N-CA 126.276 1.831 . . . . 69.23 109.179 177.628 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -131.22 89.18 42.36 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 113.299 -1.773 . . . . 65.8 106.834 -177.194 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_exo -62.59 -35.12 72.28 Favored 'Trans proline' 0 N--CA 1.458 -0.567 0 C-N-CA 124.588 3.526 . . . . 72.38 110.954 179.044 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' GLU . . . . . . . . . . . . . 18.9 pm0 -52.65 -41.88 64.19 Favored 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 126.096 1.758 . . . . 87.42 113.901 176.376 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 93.2 m-70 -107.57 10.4 29.2 Favored 'General case' 0 N--CA 1.444 -0.733 0 C-N-CA 126.691 1.996 . . . . 96.07 114.662 178.625 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 30.7 m-80 56.61 54.0 7.86 Favored 'General case' 0 C--N 1.322 -0.608 0 O-C-N 120.369 -1.457 . . . . 85.89 114.481 177.875 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.461 ' HB2' ' O ' ' A' ' 34' ' ' VAL . 13.2 ptt180 -172.41 168.16 5.53 Favored 'General case' 0 C--O 1.224 -0.272 0 N-CA-C 114.177 1.177 . . . . 74.6 114.177 -177.087 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 22.6 t -104.6 137.94 31.49 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.574 0 CA-C-N 114.683 -1.144 . . . . 56.79 109.84 177.949 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 41.1 ttt-85 -105.61 126.2 51.86 Favored 'General case' 0 C--O 1.222 -0.389 0 N-CA-C 109.021 -0.733 . . . . 61.61 109.021 175.233 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 63.1 mt -111.17 121.52 63.96 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 CA-C-O 117.27 -1.347 . . . . 48.23 108.428 179.475 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -119.01 128.6 54.53 Favored 'General case' 0 N--CA 1.443 -0.801 0 CA-C-O 117.998 -1.001 . . . . 80.76 109.943 179.21 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 66.9 p -121.58 161.21 22.81 Favored 'General case' 0 C--O 1.222 -0.382 0 O-C-N 124.83 1.331 . . . . 47.43 110.955 -178.617 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 3.8 tp -147.9 127.2 13.04 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 125.855 1.662 . . . . 64.18 110.737 -179.163 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 89.4 m -128.89 140.54 51.63 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-N 114.048 -1.433 . . . . 48.36 110.66 178.044 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 37.0 ttm180 -139.17 151.36 46.55 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 113.933 1.086 . . . . 79.98 113.933 177.587 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.538 HD22 HG13 ' A' ' 111' ' ' VAL . 0.6 OUTLIER -162.98 -179.01 6.43 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 114.821 -1.082 . . . . 68.98 110.256 175.553 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 99.5 m -130.27 105.32 7.83 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 105.927 -1.879 . . . . 74.09 105.927 176.84 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -164.24 -160.55 12.08 Favored Glycine 0 CA--C 1.525 0.714 0 C-N-CA 119.996 -1.097 . . . . 83.51 111.673 -177.123 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' LYS . . . . . 0.473 ' HD3' ' HB2' ' A' ' 22' ' ' ALA . 14.1 mttp -90.6 -34.76 15.36 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 113.637 -1.282 . . . . 100.51 110.731 -179.578 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' THR . . . . . 0.568 HG21 ' O1 ' ' A' ' 201' ' ' TLA . 0.0 OUTLIER -104.0 153.68 20.55 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 115.218 1.562 . . . . 92.1 115.218 -178.681 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -76.76 170.71 55.06 Favored Glycine 0 CA--C 1.53 1.01 1 CA-C-O 128.363 4.313 . . . . 85.83 115.515 174.916 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.538 HG13 HD22 ' A' ' 105' ' ' LEU . 15.3 m -120.89 64.15 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.668 0 CA-C-N 111.737 -2.231 . . . . 63.57 110.495 -177.912 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 25.3 mp0 -95.89 -36.58 11.05 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.379 -0.971 . . . . 62.38 108.379 178.568 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' MET . . . . . . . . . . . . . 45.7 mmm -72.39 -32.51 66.45 Favored 'General case' 0 C--N 1.328 -0.35 0 O-C-N 124.762 1.289 . . . . 42.51 111.327 -179.838 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 35.9 mp0 -65.63 -40.14 92.22 Favored 'General case' 0 C--N 1.317 -0.84 0 C-N-CA 126.5 1.92 . . . . 41.82 111.558 176.552 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -73.09 -42.3 63.13 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 123.704 0.628 . . . . 38.03 110.737 179.052 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 53.7 mt -65.61 -34.62 78.66 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-O 122.588 1.185 . . . . 40.69 113.762 177.128 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 3.9 m -71.51 -41.67 68.96 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-O 115.87 -2.014 . . . . 36.26 109.925 -179.585 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -65.97 -40.15 91.03 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 119.89 1.223 . . . . 37.3 111.036 177.413 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -69.36 -38.36 78.05 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 118.881 -0.581 . . . . 38.62 110.658 178.338 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 69.3 m -66.61 -42.36 86.98 Favored 'General case' 0 C--O 1.244 0.781 0 N-CA-C 114.747 1.388 . . . . 40.29 114.747 176.826 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 50.6 t -75.58 -28.08 19.48 Favored 'Isoleucine or valine' 0 C--N 1.351 0.648 0 O-C-N 120.549 -1.345 . . . . 35.23 111.715 179.113 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -62.54 -47.78 82.41 Favored 'General case' 0 N--CA 1.469 0.483 0 O-C-N 118.847 -2.408 . . . . 35.89 110.646 171.854 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -58.81 -41.49 86.9 Favored 'General case' 0 N--CA 1.453 -0.299 0 O-C-N 119.165 -2.209 . . . . 42.51 112.744 174.994 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 50.5 mt -64.9 -34.79 79.23 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 112.072 0.397 . . . . 38.53 112.072 176.74 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' THR . . . . . 0.583 ' O ' ' HG3' ' A' ' 129' ' ' MET . 40.7 m -70.45 -39.62 74.2 Favored 'General case' 0 C--O 1.24 0.562 0 O-C-N 119.139 -2.225 . . . . 42.45 110.901 178.862 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' ILE . . . . . 0.65 HD11 HD21 ' A' ' 88' ' ' LEU . 4.5 mm -60.2 -51.49 72.36 Favored 'Isoleucine or valine' 0 C--O 1.247 0.951 0 CA-C-O 124.94 2.305 . . . . 45.86 106.427 176.221 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' TYR . . . . . . . . . . . . . 19.2 t80 -56.82 -49.08 76.45 Favored 'General case' 0 N--CA 1.473 0.693 0 O-C-N 120.114 -1.616 . . . . 48.28 111.611 176.498 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -52.96 -47.28 68.25 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 119.049 -1.06 . . . . 44.53 113.595 -177.84 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' MET . . . . . 0.583 ' HG3' ' O ' ' A' ' 125' ' ' THR . 8.7 mtp -70.65 -14.77 62.6 Favored 'General case' 0 N--CA 1.429 -1.521 0 C-N-CA 125.667 1.587 . . . . 57.49 114.912 -178.399 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' CYS . . . . . . . . . . . . . 82.2 m -111.54 6.32 20.03 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 120.374 1.443 . . . . 57.53 110.443 179.522 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 5.6 ttpt -50.74 -48.29 59.12 Favored 'General case' 0 C--N 1.323 -0.578 0 O-C-N 120.633 -1.292 . . . . 77.23 113.906 -178.188 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -66.51 -29.0 69.0 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 115.565 1.691 . . . . 59.99 115.565 -173.865 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' VAL . . . . . 0.59 HG21 ' HE1' ' A' ' 43' ' ' MET . 60.0 t -78.47 -70.54 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.039 0 C-N-CA 125.36 1.464 . . . . 65.49 111.745 178.396 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' GLN . . . . . . . . . . . . . 64.5 tt0 -114.51 127.54 55.86 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 124.326 2.012 . . . . 65.61 113.219 -177.82 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' LYS . . . . . 0.407 ' HD2' ' N ' ' A' ' 136' ' ' ASP . 0.0 OUTLIER -97.5 -21.95 16.83 Favored 'General case' 0 C--N 1.327 -0.388 0 O-C-N 120.564 -1.335 . . . . 85.05 113.419 -174.97 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' ASP . . . . . 0.407 ' N ' ' HD2' ' A' ' 135' ' ' LYS . 31.6 p-10 -98.88 33.53 2.31 Favored 'General case' 0 C--N 1.32 -0.678 0 C-N-CA 125.022 1.329 . . . . 71.74 114.053 179.982 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' MET . . . . . . . . . . . . . 46.4 mtm -76.42 146.85 38.36 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 104.994 -2.224 . . . . 49.75 104.994 176.677 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 88.7 t -116.84 139.04 45.47 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.883 0 CA-C-N 115.265 -0.879 . . . . 48.03 110.791 -178.723 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' ILE . . . . . . . . . . . . . 63.7 mt -107.45 131.01 58.71 Favored 'Isoleucine or valine' 0 C--O 1.239 0.517 0 N-CA-C 106.506 -1.664 . . . . 48.25 106.506 177.491 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . 141.31 156.18 6.73 Favored Glycine 0 C--N 1.315 -0.635 0 CA-C-N 118.394 0.543 . . . . 54.19 112.691 177.121 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_endo -80.95 167.08 73.61 Favored 'Cis proline' 0 C--N 1.321 -0.918 0 CA-C-O 124.974 1.989 . . . . 49.7 113.651 -2.84 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' VAL . . . . . . . . . . . . . 21.2 t -122.19 107.65 20.2 Favored 'Isoleucine or valine' 0 C--O 1.25 1.094 0 O-C-N 119.685 -1.885 . . . . 44.16 106.118 177.898 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 6.4 ptt-85 -148.28 166.32 28.34 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 118.643 -1.223 . . . . 58.85 112.724 -179.113 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' LEU . . . . . . . . . . . . . 1.1 tp -78.5 156.83 29.08 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 114.417 -1.265 . . . . 63.51 113.914 176.306 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 63.5 mt -123.13 -37.21 2.74 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.834 0.826 . . . . 78.9 109.627 178.898 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -157.74 154.66 28.57 Favored 'General case' 0 C--O 1.226 -0.155 0 N-CA-C 114.421 1.267 . . . . 92.73 114.421 -178.914 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' LYS . . . . . 0.407 ' HE2' ' OG ' ' A' ' 152' ' ' SER . 0.0 OUTLIER -158.85 124.66 4.43 Favored 'General case' 0 C--O 1.234 0.247 0 O-C-N 123.377 0.423 . . . . 100.51 111.217 179.081 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' SER . . . . . . . . . . . . . 9.1 t . . . . . 0 C--O 1.25 1.089 0 CA-C-O 117.263 -1.351 . . . . 100.51 110.029 177.944 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.493 1.709 0 N-CA-C 116.004 1.853 . . . . 100.51 116.004 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' SER . . . . . 0.407 ' OG ' ' HE2' ' A' ' 147' ' ' LYS . 11.4 t -93.48 -63.3 1.22 Allowed 'General case' 0 C--N 1.328 -0.355 0 O-C-N 120.098 -1.627 . . . . 100.51 110.581 -179.712 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . 59.81 55.44 30.42 Favored Glycine 0 CA--C 1.526 0.725 0 C-N-CA 119.889 -1.148 . . . . 100.51 113.726 179.819 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -96.5 114.3 25.95 Favored 'General case' 0 CA--C 1.531 0.244 0 O-C-N 120.405 -1.644 . . . . 100.51 109.709 178.877 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' PHE . . . . . . . . . . . . . 7.0 t80 -128.69 154.64 46.1 Favored 'General case' 0 C--O 1.243 0.75 0 N-CA-C 109.529 -0.545 . . . . 100.51 109.529 -177.204 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.334 0 CA-C-O 115.609 -2.138 . . . . 100.51 109.329 -179.457 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' TLA . . . . . 0.568 ' O1 ' HG21 ' A' ' 109' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' HOH . . . . . 0.409 ' O ' ' HB3' ' A' ' 80' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 stop_ save_