data_3stn_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 3stn _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.458 -0.073 0 CA-C-O 120.848 0.356 . . . . 106.08 111.244 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.4 t -99.43 -30.16 12.35 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.228 -0.442 . . . . 111.26000000000001 111.043 -129.375 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 37.4 m-85 -102.16 -3.55 27.26 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.078 -0.51 . . . . 51.399999999999999 110.897 -174.427 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -87.19 136.33 32.97 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.346 -0.388 . . . . 53.039999999999999 111.054 -154.411 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 167.61 144.04 4.0 Favored Glycine 0 N--CA 1.449 -0.497 0 CA-C-N 116.216 -0.447 . . . . 49.560000000000002 112.575 -140.554 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.5 mttp -84.18 133.17 34.61 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.867 0.365 . . . . 69.709999999999994 111.324 138.764 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 29.0 m-85 -127.38 156.07 42.61 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.028 -0.533 . . . . 55.640000000000001 110.491 167.051 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 56.3 tt0 -136.16 147.62 47.8 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 112.048 0.388 . . . . 61.630000000000003 112.048 171.185 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 18.2 tp -63.66 142.41 58.41 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.961 -0.563 . . . . 52.409999999999997 111.754 -172.716 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -110.24 -71.67 0.75 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.109 -0.496 . . . . 74.650000000000006 110.695 174.005 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -118.16 162.68 17.82 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.898 -0.592 . . . . 65.909999999999997 110.108 175.534 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -154.34 151.07 28.64 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.292 0.479 . . . . 68.049999999999997 112.292 167.483 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -109.42 143.41 39.04 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.911 -0.586 . . . . 80.459999999999994 110.955 179.1 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 8.4 m120 62.54 36.09 14.12 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.763 0.653 . . . . 75.439999999999998 112.763 160.441 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 78.4 t80 -53.74 -45.23 70.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.026 0.441 . . . . 86.439999999999998 111.3 -177.733 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . 0.257 0.0 OUTLIER -69.29 -49.81 52.57 Favored 'General case' 0 CA--C 1.475 -1.917 0 CA-C-N 110.061 -3.245 . . . . 129.00999999999999 116.869 -167.035 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.92 -49.27 76.86 Favored 'General case' 0 N--CA 1.405 -2.712 0 N-CA-C 102.783 -3.043 . . . . 101.58 102.783 -177.738 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' PHE . . . . . 0.837 ' O ' ' CG2' ' A' ' 22' ' ' ILE . 72.5 t80 -62.68 -42.56 99.69 Favored 'General case' 0 N--CA 1.414 -2.274 0 C-N-CA 118.898 -1.121 . . . . 89.480000000000004 111.876 -169.481 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' MET . . . . . 0.953 ' CG ' ' CD2' ' A' ' 24' ' ' LEU . 10.1 tpp -78.86 -22.85 45.45 Favored 'General case' 0 C--N 1.304 -1.408 0 C-N-CA 116.701 -1.999 . . . . 115.89 110.393 -169.572 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . . . -50.69 -59.62 3.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.04 -0.527 . . . . 93.099999999999994 111.006 163.814 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -78.3 -12.11 59.98 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.018 -0.537 . . . . 86.569999999999993 110.659 -153.48 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' ILE . . . . . 0.837 ' CG2' ' O ' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -90.17 -14.66 8.91 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.653 0 O-C-N 126.648 2.468 . . . . 112.51000000000001 109.877 -173.019 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 105.71 46.23 1.22 Allowed Glycine 0 C--O 1.212 -1.232 0 C-N-CA 120.192 -1.004 . . . . 117.66 114.595 175.909 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' LEU . . . . . 0.953 ' CD2' ' CG ' ' A' ' 19' ' ' MET . 0.0 OUTLIER -105.47 143.5 26.93 Favored Pre-proline 0 C--N 1.325 -0.489 0 N-CA-C 112.652 0.612 . . . . 130.55000000000001 112.652 -179.46 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -70.99 111.99 3.19 Favored 'Trans proline' 0 CA--C 1.486 -1.913 1 C-N-CA 125.499 4.133 . . . . 160.34999999999999 108.186 -177.461 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.2 tm-20 -62.9 -13.76 38.22 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 111.928 -3.909 . . . . 156.61000000000001 111.469 -158.142 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -47.07 -72.38 0.05 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.242 -0.435 . . . . 158.63 110.945 173.261 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -75.16 4.34 7.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.932 0.396 . . . . 141.63 111.307 -171.176 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -67.67 -49.88 65.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.109 -0.496 . . . . 102.33 111.533 173.016 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -94.03 -18.04 22.26 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.496 -0.32 . . . . 148.43000000000001 111.636 -164.419 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 11.1 tttt -45.61 -53.87 8.52 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.882 0.373 . . . . 114.79000000000001 110.434 143.303 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -69.63 -29.07 71.54 Favored Glycine 0 N--CA 1.45 -0.399 0 CA-C-N 116.016 -0.538 . . . . 102.06 111.933 -161.383 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.76 -21.32 66.74 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.749 0.309 . . . . 94.879999999999995 111.074 -155.629 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -124.62 8.9 8.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.2 -0.454 . . . . 88.239999999999995 110.632 -169.961 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 17.2 mt -71.2 133.11 32.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.092 -0.504 . . . . 79.829999999999998 111.192 164.849 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 7.6 mttp -105.79 94.94 5.46 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.183 -0.462 . . . . 76.879999999999995 110.899 172.084 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -78.79 169.12 54.05 Favored Glycine 0 N--CA 1.449 -0.486 0 CA-C-N 115.998 -0.546 . . . . 84.510000000000005 112.073 -169.25 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 80.0 t -121.23 134.28 65.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 120.749 0.309 . . . . 43.289999999999999 110.403 -175.2 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 14.6 m -112.79 118.15 34.16 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.228 -0.442 . . . . 52.520000000000003 111.142 179.235 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -95.52 124.3 39.48 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.246 -0.434 . . . . 72.150000000000006 111.151 166.105 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 8.6 mt -115.26 130.88 69.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.298 -0.41 . . . . 42.420000000000002 110.987 173.451 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 1.6 t -114.42 120.03 63.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.255 -0.43 . . . . 51.920000000000002 110.984 160.3 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 65.3 tt0 -110.63 121.96 46.6 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.252 -0.431 . . . . 73.609999999999999 110.885 173.704 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -115.36 85.74 2.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.179 -0.464 . . . . 103.7 112.113 169.326 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 63.68 -102.35 0.55 Allowed Glycine 0 N--CA 1.45 -0.407 0 CA-C-N 116.136 -0.484 . . . . 74.5 112.041 -169.094 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -102.66 0.33 33.0 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.773 0.321 . . . . 76.670000000000002 110.89 -172.784 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 34.4 m-70 -108.63 130.25 55.32 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.189 -0.46 . . . . 64.090000000000003 111.402 -175.486 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 49.1 m-85 -120.17 135.23 55.04 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.262 -0.426 . . . . 59.950000000000003 110.894 -175.542 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 12.9 mttt -105.06 124.57 49.77 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.251 -0.431 . . . . 76.340000000000003 111.047 155.691 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -112.51 118.89 36.39 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.106 -0.497 . . . . 66.420000000000002 110.755 173.323 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -115.77 105.22 12.47 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.427 -0.351 . . . . 53.060000000000002 111.365 175.971 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -96.55 141.28 15.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.28 -0.418 . . . . 67.989999999999995 111.02 177.566 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 88.1 m -131.58 121.91 25.19 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.198 -0.455 . . . . 64.840000000000003 111.268 -178.097 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -138.74 92.88 2.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.153 -0.476 . . . . 85.530000000000001 111.197 167.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 94.15 -110.7 4.03 Favored Glycine 0 N--CA 1.45 -0.382 0 CA-C-N 116.271 -0.422 . . . . 79.950000000000003 112.428 -178.094 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -130.23 18.4 5.43 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.738 0.304 . . . . 110.91 111.145 156.318 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.8 tttt -62.99 83.3 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.288 -0.414 . . . . 96.170000000000002 110.77 144.005 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 37.8 t -75.59 119.67 23.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.262 -0.426 . . . . 68.760000000000005 110.822 145.305 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -107.1 137.49 37.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.284 -0.416 . . . . 72.099999999999994 111.379 147.008 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -123.75 128.15 49.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.998 -0.546 . . . . 61.359999999999999 110.141 -179.645 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 53.7 m-20 -122.83 150.3 43.03 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.284 -0.416 . . . . 56.450000000000003 111.753 -178.66 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -135.9 151.58 50.14 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.422 -0.354 . . . . 93.450000000000003 111.691 162.321 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 34.1 p90 -150.08 157.09 42.76 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.151 -0.477 . . . . 43.659999999999997 110.942 169.417 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 23.1 m -104.61 127.82 52.46 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.211 -0.449 . . . . 50.130000000000003 110.985 161.981 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 2.5 t -62.47 124.84 17.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.054 -0.521 . . . . 74.439999999999998 110.977 -174.318 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 106.74 -19.77 35.31 Favored Glycine 0 N--CA 1.449 -0.484 0 CA-C-N 116.171 -0.468 . . . . 70.219999999999999 112.306 178.112 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -115.45 164.94 13.56 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.749 0.309 . . . . 70.599999999999994 111.007 -172.938 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.6 156.94 9.9 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.195 -0.457 . . . . 73.659999999999997 111.28 177.144 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 15.5 p -157.66 172.39 18.6 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.135 -0.484 . . . . 83.609999999999999 110.89 176.032 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -126.44 108.09 10.88 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.162 -0.472 . . . . 89.670000000000002 110.403 176.109 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 53.1 mt -102.17 123.53 46.17 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.198 -0.455 . . . . 50.759999999999998 110.655 -176.474 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -66.51 124.02 21.65 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.141 -0.481 . . . . 71.609999999999999 110.856 162.234 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.1 p -97.95 -177.33 3.72 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.236 -0.438 . . . . 62.869999999999997 110.925 176.017 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 3.7 mtp -69.93 -4.74 21.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.136 -0.484 . . . . 110.22 111.019 -168.342 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 59.9 p -98.29 -14.99 19.97 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.007 -0.542 . . . . 68.129999999999995 111.1 -176.032 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 99.24 -18.36 56.65 Favored Glycine 0 N--CA 1.449 -0.438 0 CA-C-N 116.245 -0.434 . . . . 51.520000000000003 112.546 -163.93 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -77.16 135.6 38.54 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.748 0.309 . . . . 67.469999999999999 111.333 -170.051 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 17.1 mttt -110.43 125.49 53.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.244 -0.434 . . . . 73.859999999999999 111.318 -168.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 3.7 t -129.33 136.45 59.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.096 -0.502 . . . . 58.780000000000001 110.872 -163.099 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.07 121.78 30.0 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.33 -0.396 . . . . 76.650000000000006 111.193 178.853 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 6.6 t -155.81 -178.81 7.56 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.182 -0.463 . . . . 50.920000000000002 111.227 -177.424 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 71.1 t -126.7 130.15 71.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.141 -0.481 . . . . 52.07 110.557 176.423 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 3.8 t -95.53 134.46 32.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.18 -0.464 . . . . 46.030000000000001 110.785 168.784 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 2.3 mm100 -121.5 152.59 38.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.197 -0.456 . . . . 69.230000000000004 111.303 -174.89 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 7.0 mt -101.15 90.39 4.12 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.963 -0.562 . . . . 77.939999999999998 110.642 -179.052 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 80.9 mt-10 -90.21 74.87 7.04 Favored 'General case' 0 N--CA 1.432 -1.348 0 N-CA-C 108.742 -0.836 . . . . 85.310000000000002 108.742 172.95 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 135.3 -156.11 22.47 Favored Glycine 0 C--O 1.206 -1.634 1 N-CA-C 99.149 -5.58 . . . . 90.950000000000003 99.149 -177.97 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ASP . . . . . 0.635 ' OD1' ' N ' ' A' ' 88' ' ' ASP 0.281 4.0 p-10 -126.57 10.17 7.2 Favored 'General case' 0 CA--C 1.497 -1.073 1 N-CA-C 100.084 -4.043 . . . . 131.50999999999999 100.084 178.99 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 31.2 p-10 -153.89 9.96 0.39 Allowed 'General case' 2 C--O 1.123 -5.598 0 N-CA-C 117.677 2.473 . . . . 86.780000000000001 117.677 -177.548 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -133.74 122.3 23.13 Favored 'General case' 0 C--O 1.176 -2.764 0 C-N-CA 114.731 -2.788 . . . . 58.189999999999998 104.512 176.956 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 15.0 mt -95.93 128.43 42.81 Favored 'General case' 0 C--N 1.299 -1.628 0 C-N-CA 125.114 1.366 . . . . 50.710000000000001 110.557 179.175 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 4.2 t -127.26 126.47 67.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.471 -0.332 . . . . 40.289999999999999 110.91 -175.549 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 6.4 t -140.52 162.3 35.68 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.337 -0.392 . . . . 40.270000000000003 111.526 171.397 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 91.6 m -125.26 125.1 43.03 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.099 -0.5 . . . . 53.82 110.666 169.581 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 27.5 p90 -135.59 136.23 40.9 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.006 0.372 . . . . 54.990000000000002 112.006 168.97 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 5.0 mmmt 51.03 42.88 29.01 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.956 -0.565 . . . . 72.329999999999998 111.163 178.089 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 67.9 m-20 62.93 27.32 15.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.767 -0.652 . . . . 63.130000000000003 112.302 177.766 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 8.1 mt -109.28 122.69 64.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.973 -0.558 . . . . 60.219999999999999 110.977 168.881 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.22 111.94 19.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.775 0.322 . . . . 78.510000000000005 111.478 170.671 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 3.7 t -106.94 107.43 18.44 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.303 -0.408 . . . . 51.289999999999999 111.459 -177.972 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 26.3 t -102.95 129.34 54.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.098 -0.501 . . . . 41.549999999999997 111.022 171.479 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 3.5 m -123.09 115.03 21.16 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.062 -0.517 . . . . 51.799999999999997 110.869 176.451 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -119.76 127.9 53.24 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.148 -0.478 . . . . 82.109999999999999 110.14 -168.663 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -98.42 122.11 41.2 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.867 0.365 . . . . 74.400000000000006 111.082 166.132 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -124.4 86.07 2.51 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.16 -0.473 . . . . 90.079999999999998 111.857 163.756 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 90.7 -96.44 2.2 Favored Glycine 0 N--CA 1.449 -0.475 0 CA-C-N 116.181 -0.463 . . . . 63.18 112.39 174.912 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -125.08 9.98 8.11 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.909 0.385 . . . . 77.579999999999998 110.692 177.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' ILE . . . . . . . . . . . . . 9.2 mm -120.0 114.52 44.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.908 -0.587 . . . . 48.350000000000001 110.338 -179.753 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 1.7 mt -87.5 128.7 39.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.257 -0.428 . . . . 53.490000000000002 111.011 166.871 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 30.4 m -110.65 127.45 55.28 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.071 -0.513 . . . . 68.939999999999998 110.597 169.376 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -114.27 121.61 44.2 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.2 -0.455 . . . . 62.939999999999998 111.894 174.631 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -113.25 105.8 13.86 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.331 -0.395 . . . . 58.719999999999999 110.994 175.871 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' MET . . . . . . . . . . . . . 5.3 mtp -92.2 147.83 22.62 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.236 -0.438 . . . . 60.659999999999997 111.032 166.154 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 38.0 m -147.38 111.13 5.01 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.243 -0.435 . . . . 49.649999999999999 110.688 -167.588 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 12.8 tp -122.8 98.0 5.7 Favored 'General case' 0 CA--C 1.472 -2.023 0 N-CA-C 106.733 -1.581 . . . . 72.480000000000004 106.733 -177.806 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 70.75 -119.05 8.01 Favored Glycine 0 C--O 1.188 -2.723 0 N-CA-C 107.415 -2.274 . . . . 69.469999999999999 107.415 -175.341 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 84.5 m-20 -93.09 -1.12 56.78 Favored 'General case' 0 C--N 1.294 -1.837 0 N-CA-C 116.063 1.875 . . . . 85.849999999999994 116.063 -175.589 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 29.2 mt -99.93 129.14 51.02 Favored 'Isoleucine or valine' 0 C--O 1.184 -2.367 0 O-C-N 123.699 0.624 . . . . 71.120000000000005 111.548 -178.103 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 2.3 t -110.36 110.58 32.7 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.423 0 C-N-CA 118.895 -1.122 . . . . 65.170000000000002 112.235 178.568 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 13.3 t80 -99.89 111.35 23.66 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-N 116.05 -0.523 . . . . 56.579999999999998 111.066 179.281 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 10.5 tttt -120.46 127.37 52.17 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.197 -0.456 . . . . 86.450000000000003 111.037 -170.32 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 65.9 mtm180 -116.85 121.08 40.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.263 -0.426 . . . . 66.189999999999998 111.029 178.804 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 22.7 mt -100.89 123.38 53.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.362 -0.381 . . . . 78.140000000000001 111.014 172.722 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 1.5 m -126.46 158.91 34.83 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.255 -0.429 . . . . 49.229999999999997 111.387 -177.531 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 11.4 ttpt -131.95 152.72 50.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.109 -0.496 . . . . 69.430000000000007 110.709 -170.436 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 46.4 ttm-85 -83.07 136.57 34.43 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.422 -0.354 . . . . 51.159999999999997 111.339 -168.805 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 13.5 pt . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.175 -0.466 . . . . 53.869999999999997 111.192 178.633 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.458 -0.073 0 CA-C-O 120.848 0.356 . . . . 106.08 111.244 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.4 t -99.43 -30.16 12.35 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.228 -0.442 . . . . 111.26000000000001 111.043 -129.375 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 37.4 m-85 -102.16 -3.55 27.26 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.078 -0.51 . . . . 51.399999999999999 110.897 -174.427 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -87.19 136.33 32.97 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.346 -0.388 . . . . 53.039999999999999 111.054 -154.411 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 167.61 144.04 4.0 Favored Glycine 0 N--CA 1.449 -0.497 0 CA-C-N 116.216 -0.447 . . . . 49.560000000000002 112.575 -140.554 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' LYS . . . . . 0.65 ' HB3' HG13 ' A' ' 127' ' ' ILE . 2.5 mttp -84.18 133.17 34.61 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.867 0.365 . . . . 69.709999999999994 111.324 138.764 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 29.0 m-85 -127.38 156.07 42.61 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.028 -0.533 . . . . 55.640000000000001 110.491 167.051 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 56.3 tt0 -136.16 147.62 47.8 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 112.048 0.388 . . . . 61.630000000000003 112.048 171.185 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 18.2 tp -63.66 142.41 58.41 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.961 -0.563 . . . . 52.409999999999997 111.754 -172.716 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -110.24 -71.67 0.75 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.109 -0.496 . . . . 74.650000000000006 110.695 174.005 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -118.16 162.68 17.82 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.898 -0.592 . . . . 65.909999999999997 110.108 175.534 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -154.34 151.07 28.64 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.292 0.479 . . . . 68.049999999999997 112.292 167.483 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -109.42 143.41 39.04 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.911 -0.586 . . . . 80.459999999999994 110.955 179.1 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 40.1 m-20 62.54 36.09 14.12 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.763 0.653 . . . . 75.439999999999998 112.763 160.441 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 78.4 t80 -53.74 -45.23 70.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.026 0.441 . . . . 86.439999999999998 111.3 -177.733 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . 0.257 0.0 OUTLIER -69.29 -49.81 52.57 Favored 'General case' 0 CA--C 1.475 -1.917 0 CA-C-N 110.061 -3.245 . . . . 129.00999999999999 116.869 -167.035 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.92 -49.27 76.86 Favored 'General case' 0 N--CA 1.405 -2.712 0 N-CA-C 102.783 -3.043 . . . . 101.58 102.783 -177.738 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' PHE . . . . . 1.046 ' O ' HG22 ' A' ' 22' ' ' ILE . 72.5 t80 -62.68 -42.56 99.69 Favored 'General case' 0 N--CA 1.414 -2.274 0 C-N-CA 118.898 -1.121 . . . . 89.480000000000004 111.876 -169.481 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 19' ' ' MET . . . . . 1.241 ' CG ' HD23 ' A' ' 24' ' ' LEU . 10.1 tpp -78.86 -22.85 45.45 Favored 'General case' 0 C--N 1.304 -1.408 0 C-N-CA 116.701 -1.999 . . . . 115.89 110.393 -169.572 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . . . -50.69 -59.62 3.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.04 -0.527 . . . . 93.099999999999994 111.006 163.814 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -78.3 -12.11 59.98 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.018 -0.537 . . . . 86.569999999999993 110.659 -153.48 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' ILE . . . . . 1.046 HG22 ' O ' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -90.17 -14.66 8.91 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.653 0 O-C-N 126.648 2.468 . . . . 112.51000000000001 109.877 -173.019 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 105.71 46.23 1.22 Allowed Glycine 0 C--O 1.212 -1.232 0 C-N-CA 120.192 -1.004 . . . . 117.66 114.595 175.909 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' LEU . . . . . 1.241 HD23 ' CG ' ' A' ' 19' ' ' MET . 0.0 OUTLIER -105.47 143.5 26.93 Favored Pre-proline 0 C--N 1.325 -0.489 0 N-CA-C 112.652 0.612 . . . . 130.55000000000001 112.652 -179.46 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 25' ' ' PRO . . . . . 0.723 ' HD2' HD21 ' A' ' 28' ' ' LEU . 33.1 Cg_exo -70.99 111.99 3.19 Favored 'Trans proline' 0 CA--C 1.486 -1.913 1 C-N-CA 125.499 4.133 . . . . 160.34999999999999 108.186 -177.461 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 26' ' ' GLU . . . . . 0.412 ' O ' ' HB ' ' A' ' 29' ' ' ILE . 6.2 tm-20 -62.9 -13.76 38.22 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 111.928 -3.909 . . . . 156.61000000000001 111.469 -158.142 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -47.07 -72.38 0.05 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.242 -0.435 . . . . 158.63 110.945 173.261 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' LEU . . . . . 0.723 HD21 ' HD2' ' A' ' 25' ' ' PRO . 1.0 OUTLIER -75.16 4.34 7.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.932 0.396 . . . . 141.63 111.307 -171.176 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ILE . . . . . 0.412 ' HB ' ' O ' ' A' ' 26' ' ' GLU . 0.9 OUTLIER -67.67 -49.88 65.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.109 -0.496 . . . . 102.33 111.533 173.016 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 30' ' ' GLN . . . . . 0.433 ' H ' ' HG3' ' A' ' 30' ' ' GLN . 0.0 OUTLIER -94.03 -18.04 22.26 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.496 -0.32 . . . . 148.43000000000001 111.636 -164.419 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 11.1 tttt -45.61 -53.87 8.52 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.882 0.373 . . . . 114.79000000000001 110.434 143.303 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' GLY . . . . . 0.786 ' HA2' HD12 ' A' ' 35' ' ' ILE . . . -69.63 -29.07 71.54 Favored Glycine 0 N--CA 1.45 -0.399 0 CA-C-N 116.016 -0.538 . . . . 102.06 111.933 -161.383 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.76 -21.32 66.74 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.749 0.309 . . . . 94.879999999999995 111.074 -155.629 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -124.62 8.9 8.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.2 -0.454 . . . . 88.239999999999995 110.632 -169.961 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ILE . . . . . 0.786 HD12 ' HA2' ' A' ' 32' ' ' GLY . 17.2 mt -71.2 133.11 32.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.092 -0.504 . . . . 79.829999999999998 111.192 164.849 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 7.6 mttp -105.79 94.94 5.46 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.183 -0.462 . . . . 76.879999999999995 110.899 172.084 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -78.79 169.12 54.05 Favored Glycine 0 N--CA 1.449 -0.486 0 CA-C-N 115.998 -0.546 . . . . 84.510000000000005 112.073 -169.25 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 80.0 t -121.23 134.28 65.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 120.749 0.309 . . . . 43.289999999999999 110.403 -175.2 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 14.6 m -112.79 118.15 34.16 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.228 -0.442 . . . . 52.520000000000003 111.142 179.235 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -95.52 124.3 39.48 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.246 -0.434 . . . . 72.150000000000006 111.151 166.105 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 8.6 mt -115.26 130.88 69.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.298 -0.41 . . . . 42.420000000000002 110.987 173.451 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 1.6 t -114.42 120.03 63.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.255 -0.43 . . . . 51.920000000000002 110.984 160.3 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 65.3 tt0 -110.63 121.96 46.6 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.252 -0.431 . . . . 73.609999999999999 110.885 173.704 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -115.36 85.74 2.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.179 -0.464 . . . . 103.7 112.113 169.326 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 63.68 -102.35 0.55 Allowed Glycine 0 N--CA 1.45 -0.407 0 CA-C-N 116.136 -0.484 . . . . 74.5 112.041 -169.094 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' LYS . . . . . 0.483 ' HB2' ' HE3' ' A' ' 46' ' ' LYS . 0.8 OUTLIER -102.66 0.33 33.0 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.773 0.321 . . . . 76.670000000000002 110.89 -172.784 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 34.4 m-70 -108.63 130.25 55.32 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.189 -0.46 . . . . 64.090000000000003 111.402 -175.486 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 49.1 m-85 -120.17 135.23 55.04 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.262 -0.426 . . . . 59.950000000000003 110.894 -175.542 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 12.9 mttt -105.06 124.57 49.77 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.251 -0.431 . . . . 76.340000000000003 111.047 155.691 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -112.51 118.89 36.39 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.106 -0.497 . . . . 66.420000000000002 110.755 173.323 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -115.77 105.22 12.47 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.427 -0.351 . . . . 53.060000000000002 111.365 175.971 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -96.55 141.28 15.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.28 -0.418 . . . . 67.989999999999995 111.02 177.566 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 88.1 m -131.58 121.91 25.19 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.198 -0.455 . . . . 64.840000000000003 111.268 -178.097 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -138.74 92.88 2.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.153 -0.476 . . . . 85.530000000000001 111.197 167.921 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 94.15 -110.7 4.03 Favored Glycine 0 N--CA 1.45 -0.382 0 CA-C-N 116.271 -0.422 . . . . 79.950000000000003 112.428 -178.094 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -130.23 18.4 5.43 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.738 0.304 . . . . 110.91 111.145 156.318 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.8 tttt -62.99 83.3 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.288 -0.414 . . . . 96.170000000000002 110.77 144.005 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 37.8 t -75.59 119.67 23.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.262 -0.426 . . . . 68.760000000000005 110.822 145.305 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -107.1 137.49 37.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.284 -0.416 . . . . 72.099999999999994 111.379 147.008 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 36.8 tt0 -123.75 128.15 49.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.998 -0.546 . . . . 61.359999999999999 110.141 -179.645 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 53.7 m-20 -122.83 150.3 43.03 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.284 -0.416 . . . . 56.450000000000003 111.753 -178.66 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -135.9 151.58 50.14 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.422 -0.354 . . . . 93.450000000000003 111.691 162.321 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 34.1 p90 -150.08 157.09 42.76 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.151 -0.477 . . . . 43.659999999999997 110.942 169.417 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 23.1 m -104.61 127.82 52.46 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.211 -0.449 . . . . 50.130000000000003 110.985 161.981 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 2.5 t -62.47 124.84 17.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.054 -0.521 . . . . 74.439999999999998 110.977 -174.318 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 106.74 -19.77 35.31 Favored Glycine 0 N--CA 1.449 -0.484 0 CA-C-N 116.171 -0.468 . . . . 70.219999999999999 112.306 178.112 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -115.45 164.94 13.56 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.749 0.309 . . . . 70.599999999999994 111.007 -172.938 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.6 156.94 9.9 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.195 -0.457 . . . . 73.659999999999997 111.28 177.144 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 15.5 p -157.66 172.39 18.6 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.135 -0.484 . . . . 83.609999999999999 110.89 176.032 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -126.44 108.09 10.88 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.162 -0.472 . . . . 89.670000000000002 110.403 176.109 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 53.1 mt -102.17 123.53 46.17 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.198 -0.455 . . . . 50.759999999999998 110.655 -176.474 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -66.51 124.02 21.65 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.141 -0.481 . . . . 71.609999999999999 110.856 162.234 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' THR . . . . . 0.454 HG23 ' O ' ' A' ' 77' ' ' GLU . 1.1 p -97.95 -177.33 3.72 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.236 -0.438 . . . . 62.869999999999997 110.925 176.017 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 3.7 mtp -69.93 -4.74 21.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.136 -0.484 . . . . 110.22 111.019 -168.342 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' THR . . . . . 0.461 ' OG1' ' HB3' ' A' ' 77' ' ' GLU . 59.9 p -98.29 -14.99 19.97 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.007 -0.542 . . . . 68.129999999999995 111.1 -176.032 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 99.24 -18.36 56.65 Favored Glycine 0 N--CA 1.449 -0.438 0 CA-C-N 116.245 -0.434 . . . . 51.520000000000003 112.546 -163.93 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' GLU . . . . . 0.461 ' HB3' ' OG1' ' A' ' 75' ' ' THR . 4.5 tt0 -77.16 135.6 38.54 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.748 0.309 . . . . 67.469999999999999 111.333 -170.051 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 17.1 mttt -110.43 125.49 53.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.244 -0.434 . . . . 73.859999999999999 111.318 -168.924 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 3.7 t -129.33 136.45 59.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.096 -0.502 . . . . 58.780000000000001 110.872 -163.099 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' LYS . . . . . 0.425 ' HE2' ' HB3' ' A' ' 80' ' ' LYS . 0.0 OUTLIER -87.07 121.78 30.0 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.33 -0.396 . . . . 76.650000000000006 111.193 178.853 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 6.6 t -155.81 -178.81 7.56 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.182 -0.463 . . . . 50.920000000000002 111.227 -177.424 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 71.1 t -126.7 130.15 71.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.141 -0.481 . . . . 52.07 110.557 176.423 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 3.8 t -95.53 134.46 32.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.18 -0.464 . . . . 46.030000000000001 110.785 168.784 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 39.0 mm-40 -121.5 152.59 38.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.197 -0.456 . . . . 69.230000000000004 111.303 -174.89 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 7.0 mt -101.15 90.39 4.12 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.963 -0.562 . . . . 77.939999999999998 110.642 -179.052 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 80.9 mt-10 -90.21 74.87 7.04 Favored 'General case' 0 N--CA 1.432 -1.348 0 N-CA-C 108.742 -0.836 . . . . 85.310000000000002 108.742 172.95 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 135.3 -156.11 22.47 Favored Glycine 0 C--O 1.206 -1.634 1 N-CA-C 99.149 -5.58 . . . . 90.950000000000003 99.149 -177.97 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ASP . . . . . 0.635 ' N ' ' OD1' ' A' ' 88' ' ' ASP 0.281 4.0 p-10 -126.57 10.17 7.2 Favored 'General case' 0 CA--C 1.497 -1.073 1 N-CA-C 100.084 -4.043 . . . . 131.50999999999999 100.084 178.99 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 31.2 p-10 -153.89 9.96 0.39 Allowed 'General case' 2 C--O 1.123 -5.598 0 N-CA-C 117.677 2.473 . . . . 86.780000000000001 117.677 -177.548 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 90' ' ' LYS . . . . . 0.408 ' HB2' ' HG3' ' A' ' 103' ' ' GLU . 0.3 OUTLIER -133.74 122.3 23.13 Favored 'General case' 0 C--O 1.176 -2.764 0 C-N-CA 114.731 -2.788 . . . . 58.189999999999998 104.512 176.956 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 15.0 mt -95.93 128.43 42.81 Favored 'General case' 0 C--N 1.299 -1.628 0 C-N-CA 125.114 1.366 . . . . 50.710000000000001 110.557 179.175 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 4.2 t -127.26 126.47 67.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.471 -0.332 . . . . 40.289999999999999 110.91 -175.549 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 6.4 t -140.52 162.3 35.68 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.337 -0.392 . . . . 40.270000000000003 111.526 171.397 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 91.6 m -125.26 125.1 43.03 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.099 -0.5 . . . . 53.82 110.666 169.581 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 27.5 p90 -135.59 136.23 40.9 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.006 0.372 . . . . 54.990000000000002 112.006 168.97 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 5.0 mmmt 51.03 42.88 29.01 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.956 -0.565 . . . . 72.329999999999998 111.163 178.089 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 67.9 m-20 62.93 27.32 15.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.767 -0.652 . . . . 63.130000000000003 112.302 177.766 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 8.1 mt -109.28 122.69 64.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.973 -0.558 . . . . 60.219999999999999 110.977 168.881 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.22 111.94 19.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.775 0.322 . . . . 78.510000000000005 111.478 170.671 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 3.7 t -106.94 107.43 18.44 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.303 -0.408 . . . . 51.289999999999999 111.459 -177.972 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 26.3 t -102.95 129.34 54.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.098 -0.501 . . . . 41.549999999999997 111.022 171.479 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 3.5 m -123.09 115.03 21.16 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.062 -0.517 . . . . 51.799999999999997 110.869 176.451 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' GLU . . . . . 0.408 ' HG3' ' HB2' ' A' ' 90' ' ' LYS . 3.6 tt0 -119.76 127.9 53.24 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.148 -0.478 . . . . 82.109999999999999 110.14 -168.663 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -98.42 122.11 41.2 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.867 0.365 . . . . 74.400000000000006 111.082 166.132 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -124.4 86.07 2.51 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.16 -0.473 . . . . 90.079999999999998 111.857 163.756 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 90.7 -96.44 2.2 Favored Glycine 0 N--CA 1.449 -0.475 0 CA-C-N 116.181 -0.463 . . . . 63.18 112.39 174.912 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -125.08 9.98 8.11 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.909 0.385 . . . . 77.579999999999998 110.692 177.995 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' ILE . . . . . . . . . . . . . 9.2 mm -120.0 114.52 44.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.908 -0.587 . . . . 48.350000000000001 110.338 -179.753 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 1.7 mt -87.5 128.7 39.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.257 -0.428 . . . . 53.490000000000002 111.011 166.871 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 30.4 m -110.65 127.45 55.28 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.071 -0.513 . . . . 68.939999999999998 110.597 169.376 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -114.27 121.61 44.2 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.2 -0.455 . . . . 62.939999999999998 111.894 174.631 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -113.25 105.8 13.86 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.331 -0.395 . . . . 58.719999999999999 110.994 175.871 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 113' ' ' MET . . . . . . . . . . . . . 5.3 mtp -92.2 147.83 22.62 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.236 -0.438 . . . . 60.659999999999997 111.032 166.154 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 38.0 m -147.38 111.13 5.01 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.243 -0.435 . . . . 49.649999999999999 110.688 -167.588 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 12.8 tp -122.8 98.0 5.7 Favored 'General case' 0 CA--C 1.472 -2.023 0 N-CA-C 106.733 -1.581 . . . . 72.480000000000004 106.733 -177.806 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 70.75 -119.05 8.01 Favored Glycine 0 C--O 1.188 -2.723 0 N-CA-C 107.415 -2.274 . . . . 69.469999999999999 107.415 -175.341 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 84.5 m-20 -93.09 -1.12 56.78 Favored 'General case' 0 C--N 1.294 -1.837 0 N-CA-C 116.063 1.875 . . . . 85.849999999999994 116.063 -175.589 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 29.2 mt -99.93 129.14 51.02 Favored 'Isoleucine or valine' 0 C--O 1.184 -2.367 0 O-C-N 123.699 0.624 . . . . 71.120000000000005 111.548 -178.103 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' VAL . . . . . 0.606 ' O ' HG12 ' A' ' 119' ' ' VAL . 2.3 t -110.36 110.58 32.7 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.423 0 C-N-CA 118.895 -1.122 . . . . 65.170000000000002 112.235 178.568 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 13.3 t80 -99.89 111.35 23.66 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-N 116.05 -0.523 . . . . 56.579999999999998 111.066 179.281 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 10.5 tttt -120.46 127.37 52.17 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.197 -0.456 . . . . 86.450000000000003 111.037 -170.32 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 65.9 mtm180 -116.85 121.08 40.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.263 -0.426 . . . . 66.189999999999998 111.029 178.804 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 22.7 mt -100.89 123.38 53.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.362 -0.381 . . . . 78.140000000000001 111.014 172.722 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 1.5 m -126.46 158.91 34.83 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.255 -0.429 . . . . 49.229999999999997 111.387 -177.531 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 11.4 ttpt -131.95 152.72 50.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.109 -0.496 . . . . 69.430000000000007 110.709 -170.436 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 46.4 ttm-85 -83.07 136.57 34.43 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.422 -0.354 . . . . 51.159999999999997 111.339 -168.805 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' ILE . . . . . 0.65 HG13 ' HB3' ' A' ' 6' ' ' LYS . 13.5 pt . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.175 -0.466 . . . . 53.869999999999997 111.192 178.633 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.458 -0.073 0 CA-C-O 120.848 0.356 . . . . 106.08 111.244 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.4 t -99.43 -30.16 12.35 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.228 -0.442 . . . . 111.26 111.043 -129.375 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 37.4 m-85 -102.16 -3.55 27.26 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.078 -0.51 . . . . 51.4 110.897 -174.427 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -87.19 136.33 32.97 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.346 -0.388 . . . . 53.04 111.054 -154.411 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 167.61 144.04 4.0 Favored Glycine 0 N--CA 1.449 -0.497 0 CA-C-N 116.216 -0.447 . . . . 49.56 112.575 -140.554 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.65 ' HB3' HG13 ' A' ' 127' ' ' ILE . 2.5 mttp -84.18 133.17 34.61 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.867 0.365 . . . . 69.71 111.324 138.764 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 29.0 m-85 -127.38 156.07 42.61 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.028 -0.533 . . . . 55.64 110.491 167.051 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 56.3 tt0 -136.16 147.62 47.8 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 112.048 0.388 . . . . 61.63 112.048 171.185 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 18.2 tp -63.66 142.41 58.41 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.961 -0.563 . . . . 52.41 111.754 -172.716 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -110.24 -71.67 0.75 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.109 -0.496 . . . . 74.65 110.695 174.005 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -118.16 162.68 17.82 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.898 -0.592 . . . . 65.91 110.108 175.534 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -154.34 151.07 28.64 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.292 0.479 . . . . 68.05 112.292 167.483 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -109.42 143.41 39.04 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.911 -0.586 . . . . 80.46 110.955 179.1 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 8.4 m120 62.54 36.09 14.12 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.763 0.653 . . . . 75.44 112.763 160.441 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 78.4 t80 -53.74 -45.23 70.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.026 0.441 . . . . 86.44 111.3 -177.733 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . 0.257 0.0 OUTLIER -69.29 -49.81 52.57 Favored 'General case' 0 CA--C 1.475 -1.917 0 CA-C-N 110.061 -3.245 . . . . 129.01 116.869 -167.035 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.92 -49.27 76.86 Favored 'General case' 0 N--CA 1.405 -2.712 0 N-CA-C 102.783 -3.043 . . . . 101.58 102.783 -177.738 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' PHE . . . . . 1.046 ' O ' HG22 ' A' ' 22' ' ' ILE . 72.5 t80 -62.68 -42.56 99.69 Favored 'General case' 0 N--CA 1.414 -2.274 0 C-N-CA 118.898 -1.121 . . . . 89.48 111.876 -169.481 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' MET . . . . . 1.241 ' CG ' HD23 ' A' ' 24' ' ' LEU . 10.1 tpp -78.86 -22.85 45.45 Favored 'General case' 0 C--N 1.304 -1.408 0 C-N-CA 116.701 -1.999 . . . . 115.89 110.393 -169.572 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . . . -50.69 -59.62 3.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.04 -0.527 . . . . 93.1 111.006 163.814 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -78.3 -12.11 59.98 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.018 -0.537 . . . . 86.57 110.659 -153.48 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' ILE . . . . . 1.046 HG22 ' O ' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -90.17 -14.66 8.91 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.653 0 O-C-N 126.648 2.468 . . . . 112.51 109.877 -173.019 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 105.71 46.23 1.22 Allowed Glycine 0 C--O 1.212 -1.232 0 C-N-CA 120.192 -1.004 . . . . 117.66 114.595 175.909 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' LEU . . . . . 1.241 HD23 ' CG ' ' A' ' 19' ' ' MET . 0.0 OUTLIER -105.47 143.5 26.93 Favored Pre-proline 0 C--N 1.325 -0.489 0 N-CA-C 112.652 0.612 . . . . 130.55 112.652 -179.46 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.723 ' HD2' HD21 ' A' ' 28' ' ' LEU . 33.1 Cg_exo -70.99 111.99 3.19 Favored 'Trans proline' 0 CA--C 1.486 -1.913 1 C-N-CA 125.499 4.133 . . . . 160.35 108.186 -177.461 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.412 ' O ' ' HB ' ' A' ' 29' ' ' ILE . 6.2 tm-20 -62.9 -13.76 38.22 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 111.928 -3.909 . . . . 156.61 111.469 -158.142 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -47.07 -72.38 0.05 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.242 -0.435 . . . . 158.63 110.945 173.261 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.723 HD21 ' HD2' ' A' ' 25' ' ' PRO . 1.0 OUTLIER -75.16 4.34 7.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.932 0.396 . . . . 141.63 111.307 -171.176 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.412 ' HB ' ' O ' ' A' ' 26' ' ' GLU . 0.9 OUTLIER -67.67 -49.88 65.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.109 -0.496 . . . . 102.33 111.533 173.016 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.433 ' H ' ' HG3' ' A' ' 30' ' ' GLN . 0.0 OUTLIER -94.03 -18.04 22.26 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.496 -0.32 . . . . 148.43 111.636 -164.419 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 11.1 tttt -45.61 -53.87 8.52 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.882 0.373 . . . . 114.79 110.434 143.303 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.786 ' HA2' HD12 ' A' ' 35' ' ' ILE . . . -69.63 -29.07 71.54 Favored Glycine 0 N--CA 1.45 -0.399 0 CA-C-N 116.016 -0.538 . . . . 102.06 111.933 -161.383 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.76 -21.32 66.74 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.749 0.309 . . . . 94.88 111.074 -155.629 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -124.62 8.9 8.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.2 -0.454 . . . . 88.24 110.632 -169.961 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.786 HD12 ' HA2' ' A' ' 32' ' ' GLY . 17.2 mt -71.2 133.11 32.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.092 -0.504 . . . . 79.83 111.192 164.849 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 7.6 mttp -105.79 94.94 5.46 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.183 -0.462 . . . . 76.88 110.899 172.084 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -78.79 169.12 54.05 Favored Glycine 0 N--CA 1.449 -0.486 0 CA-C-N 115.998 -0.546 . . . . 84.51 112.073 -169.25 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 80.0 t -121.23 134.28 65.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 120.749 0.309 . . . . 43.29 110.403 -175.2 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 14.6 m -112.79 118.15 34.16 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.228 -0.442 . . . . 52.52 111.142 179.235 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -95.52 124.3 39.48 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.246 -0.434 . . . . 72.15 111.151 166.105 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 8.6 mt -115.26 130.88 69.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.298 -0.41 . . . . 42.42 110.987 173.451 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 1.6 t -114.42 120.03 63.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.255 -0.43 . . . . 51.92 110.984 160.3 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 65.3 tt0 -110.63 121.96 46.6 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.252 -0.431 . . . . 73.61 110.885 173.704 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -115.36 85.74 2.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.179 -0.464 . . . . 103.7 112.113 169.326 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 63.68 -102.35 0.55 Allowed Glycine 0 N--CA 1.45 -0.407 0 CA-C-N 116.136 -0.484 . . . . 74.5 112.041 -169.094 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.483 ' HB2' ' HE3' ' A' ' 46' ' ' LYS . 0.8 OUTLIER -102.66 0.33 33.0 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.773 0.321 . . . . 76.67 110.89 -172.784 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 34.4 m-70 -108.63 130.25 55.32 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.189 -0.46 . . . . 64.09 111.402 -175.486 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 49.1 m-85 -120.17 135.23 55.04 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.262 -0.426 . . . . 59.95 110.894 -175.542 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 12.9 mttt -105.06 124.57 49.77 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.251 -0.431 . . . . 76.34 111.047 155.691 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -112.51 118.89 36.39 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.106 -0.497 . . . . 66.42 110.755 173.323 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -115.77 105.22 12.47 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.427 -0.351 . . . . 53.06 111.365 175.971 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -96.55 141.28 15.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.28 -0.418 . . . . 67.99 111.02 177.566 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 88.1 m -131.58 121.91 25.19 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.198 -0.455 . . . . 64.84 111.268 -178.097 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -138.74 92.88 2.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.153 -0.476 . . . . 85.53 111.197 167.921 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 94.15 -110.7 4.03 Favored Glycine 0 N--CA 1.45 -0.382 0 CA-C-N 116.271 -0.422 . . . . 79.95 112.428 -178.094 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -130.23 18.4 5.43 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.738 0.304 . . . . 110.91 111.145 156.318 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.8 tttt -62.99 83.3 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.288 -0.414 . . . . 96.17 110.77 144.005 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 37.8 t -75.59 119.67 23.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.262 -0.426 . . . . 68.76 110.822 145.305 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -107.1 137.49 37.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.284 -0.416 . . . . 72.1 111.379 147.008 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -123.75 128.15 49.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.998 -0.546 . . . . 61.36 110.141 -179.645 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 53.7 m-20 -122.83 150.3 43.03 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.284 -0.416 . . . . 56.45 111.753 -178.66 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -135.9 151.58 50.14 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.422 -0.354 . . . . 93.45 111.691 162.321 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 34.1 p90 -150.08 157.09 42.76 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.151 -0.477 . . . . 43.66 110.942 169.417 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 23.1 m -104.61 127.82 52.46 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.211 -0.449 . . . . 50.13 110.985 161.981 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 2.5 t -62.47 124.84 17.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.054 -0.521 . . . . 74.44 110.977 -174.318 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 106.74 -19.77 35.31 Favored Glycine 0 N--CA 1.449 -0.484 0 CA-C-N 116.171 -0.468 . . . . 70.22 112.306 178.112 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -115.45 164.94 13.56 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.749 0.309 . . . . 70.6 111.007 -172.938 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.6 156.94 9.9 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.195 -0.457 . . . . 73.66 111.28 177.144 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 15.5 p -157.66 172.39 18.6 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.135 -0.484 . . . . 83.61 110.89 176.032 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -126.44 108.09 10.88 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.162 -0.472 . . . . 89.67 110.403 176.109 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 53.1 mt -102.17 123.53 46.17 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.198 -0.455 . . . . 50.76 110.655 -176.474 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -66.51 124.02 21.65 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.141 -0.481 . . . . 71.61 110.856 162.234 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' THR . . . . . 0.454 HG23 ' O ' ' A' ' 77' ' ' GLU . 1.1 p -97.95 -177.33 3.72 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.236 -0.438 . . . . 62.87 110.925 176.017 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 3.7 mtp -69.93 -4.74 21.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.136 -0.484 . . . . 110.22 111.019 -168.342 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' THR . . . . . 0.461 ' OG1' ' HB3' ' A' ' 77' ' ' GLU . 59.9 p -98.29 -14.99 19.97 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.007 -0.542 . . . . 68.13 111.1 -176.032 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 99.24 -18.36 56.65 Favored Glycine 0 N--CA 1.449 -0.438 0 CA-C-N 116.245 -0.434 . . . . 51.52 112.546 -163.93 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.461 ' HB3' ' OG1' ' A' ' 75' ' ' THR . 4.5 tt0 -77.16 135.6 38.54 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.748 0.309 . . . . 67.47 111.333 -170.051 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 17.1 mttt -110.43 125.49 53.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.244 -0.434 . . . . 73.86 111.318 -168.924 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 3.7 t -129.33 136.45 59.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.096 -0.502 . . . . 58.78 110.872 -163.099 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.425 ' HB3' ' HE2' ' A' ' 80' ' ' LYS . 0.0 OUTLIER -87.07 121.78 30.0 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.33 -0.396 . . . . 76.65 111.193 178.853 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 6.6 t -155.81 -178.81 7.56 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.182 -0.463 . . . . 50.92 111.227 -177.424 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 71.1 t -126.7 130.15 71.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.141 -0.481 . . . . 52.07 110.557 176.423 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 3.8 t -95.53 134.46 32.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.18 -0.464 . . . . 46.03 110.785 168.784 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 2.3 mm100 -121.5 152.59 38.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.197 -0.456 . . . . 69.23 111.303 -174.89 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 7.0 mt -101.15 90.39 4.12 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.963 -0.562 . . . . 77.94 110.642 -179.052 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 80.9 mt-10 -90.21 74.87 7.04 Favored 'General case' 0 N--CA 1.432 -1.348 0 N-CA-C 108.742 -0.836 . . . . 85.31 108.742 172.95 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 135.3 -156.11 22.47 Favored Glycine 0 C--O 1.206 -1.634 1 N-CA-C 99.149 -5.58 . . . . 90.95 99.149 -177.97 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ASP . . . . . 0.635 ' N ' ' OD1' ' A' ' 88' ' ' ASP 0.281 4.0 p-10 -126.57 10.17 7.2 Favored 'General case' 0 CA--C 1.497 -1.073 1 N-CA-C 100.084 -4.043 . . . . 131.51 100.084 178.99 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 31.2 p-10 -153.89 9.96 0.39 Allowed 'General case' 2 C--O 1.123 -5.598 0 N-CA-C 117.677 2.473 . . . . 86.78 117.677 -177.548 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.408 ' HB2' ' HG3' ' A' ' 103' ' ' GLU . 0.3 OUTLIER -133.74 122.3 23.13 Favored 'General case' 0 C--O 1.176 -2.764 0 C-N-CA 114.731 -2.788 . . . . 58.19 104.512 176.956 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 15.0 mt -95.93 128.43 42.81 Favored 'General case' 0 C--N 1.299 -1.628 0 C-N-CA 125.114 1.366 . . . . 50.71 110.557 179.175 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 4.2 t -127.26 126.47 67.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.471 -0.332 . . . . 40.29 110.91 -175.549 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 6.4 t -140.52 162.3 35.68 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.337 -0.392 . . . . 40.27 111.526 171.397 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 91.6 m -125.26 125.1 43.03 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.099 -0.5 . . . . 53.82 110.666 169.581 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 27.5 p90 -135.59 136.23 40.9 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.006 0.372 . . . . 54.99 112.006 168.97 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 5.0 mmmt 51.03 42.88 29.01 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.956 -0.565 . . . . 72.33 111.163 178.089 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 67.9 m-20 62.93 27.32 15.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.767 -0.652 . . . . 63.13 112.302 177.766 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 8.1 mt -109.28 122.69 64.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.973 -0.558 . . . . 60.22 110.977 168.881 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.22 111.94 19.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.775 0.322 . . . . 78.51 111.478 170.671 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 3.7 t -106.94 107.43 18.44 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.303 -0.408 . . . . 51.29 111.459 -177.972 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 26.3 t -102.95 129.34 54.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.098 -0.501 . . . . 41.55 111.022 171.479 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 3.5 m -123.09 115.03 21.16 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.062 -0.517 . . . . 51.8 110.869 176.451 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.408 ' HG3' ' HB2' ' A' ' 90' ' ' LYS . 3.6 tt0 -119.76 127.9 53.24 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.148 -0.478 . . . . 82.11 110.14 -168.663 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -98.42 122.11 41.2 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.867 0.365 . . . . 74.4 111.082 166.132 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -124.4 86.07 2.51 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.16 -0.473 . . . . 90.08 111.857 163.756 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 90.7 -96.44 2.2 Favored Glycine 0 N--CA 1.449 -0.475 0 CA-C-N 116.181 -0.463 . . . . 63.18 112.39 174.912 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -125.08 9.98 8.11 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.909 0.385 . . . . 77.58 110.692 177.995 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' ILE . . . . . . . . . . . . . 9.2 mm -120.0 114.52 44.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.908 -0.587 . . . . 48.35 110.338 -179.753 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 1.7 mt -87.5 128.7 39.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.257 -0.428 . . . . 53.49 111.011 166.871 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 30.4 m -110.65 127.45 55.28 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.071 -0.513 . . . . 68.94 110.597 169.376 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -114.27 121.61 44.2 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.2 -0.455 . . . . 62.94 111.894 174.631 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -113.25 105.8 13.86 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.331 -0.395 . . . . 58.72 110.994 175.871 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' MET . . . . . . . . . . . . . 5.3 mtp -92.2 147.83 22.62 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.236 -0.438 . . . . 60.66 111.032 166.154 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 38.0 m -147.38 111.13 5.01 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.243 -0.435 . . . . 49.65 110.688 -167.588 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 12.8 tp -122.8 98.0 5.7 Favored 'General case' 0 CA--C 1.472 -2.023 0 N-CA-C 106.733 -1.581 . . . . 72.48 106.733 -177.806 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 70.75 -119.05 8.01 Favored Glycine 0 C--O 1.188 -2.723 0 N-CA-C 107.415 -2.274 . . . . 69.47 107.415 -175.341 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 84.5 m-20 -93.09 -1.12 56.78 Favored 'General case' 0 C--N 1.294 -1.837 0 N-CA-C 116.063 1.875 . . . . 85.85 116.063 -175.589 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 29.2 mt -99.93 129.14 51.02 Favored 'Isoleucine or valine' 0 C--O 1.184 -2.367 0 O-C-N 123.699 0.624 . . . . 71.12 111.548 -178.103 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.606 ' O ' HG12 ' A' ' 119' ' ' VAL . 2.3 t -110.36 110.58 32.7 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.423 0 C-N-CA 118.895 -1.122 . . . . 65.17 112.235 178.568 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 13.3 t80 -99.89 111.35 23.66 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-N 116.05 -0.523 . . . . 56.58 111.066 179.281 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 10.5 tttt -120.46 127.37 52.17 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.197 -0.456 . . . . 86.45 111.037 -170.32 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 65.9 mtm180 -116.85 121.08 40.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.263 -0.426 . . . . 66.19 111.029 178.804 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' ILE . . . . . . . . . . . . . 22.7 mt -100.89 123.38 53.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.362 -0.381 . . . . 78.14 111.014 172.722 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 1.5 m -126.46 158.91 34.83 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.255 -0.429 . . . . 49.23 111.387 -177.531 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 11.4 ttpt -131.95 152.72 50.92 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.109 -0.496 . . . . 69.43 110.709 -170.436 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 46.4 ttm-85 -83.07 136.57 34.43 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.422 -0.354 . . . . 51.16 111.339 -168.805 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' ILE . . . . . 0.65 HG13 ' HB3' ' A' ' 6' ' ' LYS . 13.5 pt . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.175 -0.466 . . . . 53.87 111.192 178.633 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_