data_1yea_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 1yea _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 ' -9' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.319 0 CA-C-O 123.883 1.802 . . . . 79.689999999999998 108.348 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' -8' ' ' LYS . . . . . 0.433 ' O ' ' N ' ' A' ' -4' ' ' GLY . 0.0 OUTLIER -53.98 -54.33 40.59 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 111.828 -2.442 . . . . 77.420000000000002 110.635 -179.381 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' -7' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -53.62 -49.68 67.32 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 110.907 -2.861 . . . . 78.510000000000005 108.615 -177.857 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' -6' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -51.84 -53.26 42.3 Favored 'General case' 0 CA--C 1.54 0.571 0 O-C-N 127.958 3.286 . . . . 71.290000000000006 107.185 178.896 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' -5' ' ' THR . . . . . . . . . . . . 0.398 81.5 p -53.33 -61.39 2.33 Favored 'General case' 0 N--CA 1.484 1.227 0 CA-C-N 109.221 -3.627 . . . . 66.810000000000002 107.061 -177.733 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' -4' ' ' GLY . . . . . 0.433 ' N ' ' O ' ' A' ' -8' ' ' LYS . . . 57.34 33.82 66.61 Favored Glycine 0 CA--C 1.541 1.662 0 N-CA-C 107.438 -2.265 . . . . 61.189999999999998 107.438 -179.652 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -37.75 126.86 1.18 Allowed 'General case' 0 C--O 1.256 1.439 0 C-N-CA 124.984 1.314 . . . . 53.539999999999999 110.228 179.381 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' -2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.93 141.95 24.84 Favored Pre-proline 0 C--N 1.296 -1.733 0 C-N-CA 125.447 1.499 . . . . 41.159999999999997 108.849 177.712 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' -1' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -62.83 146.38 94.99 Favored 'Trans proline' 0 C--N 1.31 -1.459 0 N-CA-C 106.702 -2.076 . . . . 32.240000000000002 106.702 176.687 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -133.11 -156.87 8.23 Favored Glycine 0 C--O 1.253 1.284 0 CA-C-O 126.198 3.11 . . . . 26.0 112.329 -179.0 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' SER . . . . . 0.457 ' O ' ' N ' ' A' ' 6' ' ' GLY . 22.7 t -85.7 107.05 17.39 Favored 'General case' 0 C--O 1.253 1.282 0 CA-C-N 111.006 -2.597 . . . . 14.460000000000001 113.847 -179.082 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -61.5 -36.11 79.58 Favored 'General case' 0 C--O 1.255 1.349 0 O-C-N 127.27 2.856 . . . . 12.279999999999999 107.327 175.496 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.94 -57.1 13.51 Favored 'General case' 0 C--O 1.25 1.086 0 O-C-N 125.875 1.985 . . . . 26.010000000000002 105.715 178.074 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.3 tttm -55.32 -44.7 76.1 Favored 'General case' 0 C--N 1.298 -1.651 0 CA-C-N 110.364 -3.107 . . . . 23.109999999999999 110.101 -178.675 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' GLY . . . . . 0.457 ' N ' ' O ' ' A' ' 2' ' ' SER . . . -60.81 -48.1 87.91 Favored Glycine 0 N--CA 1.486 1.999 0 N-CA-C 107.426 -2.269 . . . . 12.949999999999999 107.426 179.184 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -47.12 -52.77 14.5 Favored 'General case' 0 C--N 1.314 -0.936 0 O-C-N 125.126 1.133 . . . . 10.24 108.816 -179.283 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . 0.322 50.1 p -67.96 -31.73 71.67 Favored 'General case' 0 C--O 1.26 1.62 0 N-CA-C 115.334 1.605 . . . . 18.010000000000002 115.334 -177.426 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.0 tp -73.36 -26.03 60.84 Favored 'General case' 0 N--CA 1.485 1.302 0 CA-C-O 113.594 -3.098 . . . . 20.780000000000001 106.928 -179.673 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . 0.363 34.4 t80 -65.84 -47.86 73.58 Favored 'General case' 0 CA--C 1.563 1.479 0 O-C-N 126.857 2.598 . . . . 15.26 107.043 179.889 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 9.1 tmtt? -65.04 -42.99 93.81 Favored 'General case' 0 N--CA 1.483 1.207 1 O-C-N 132.696 6.248 . . . . 26.23 114.773 -175.487 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 75.7 p -81.89 -7.73 59.63 Favored 'General case' 0 N--CA 1.482 1.164 0 CA-C-O 114.648 -2.596 . . . . 17.739999999999998 110.414 -176.277 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 7.9 mtp180 -133.06 -21.54 2.1 Favored 'General case' 0 C--O 1.283 2.845 2 N-CA-C 123.752 4.723 . . . . 35.200000000000003 123.752 -176.929 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . 0.268 19.0 m -127.78 -22.19 3.6 Favored 'General case' 0 C--N 1.275 -2.666 0 CA-C-N 123.045 2.657 . . . . 9.4299999999999997 110.933 -176.185 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' GLN . . . . . 0.442 ' NE2' ' O ' ' A' ' 137' ' ' HOH . 9.9 tt0 -61.66 -38.0 86.14 Favored 'General case' 0 CA--C 1.558 1.284 0 O-C-N 126.888 2.617 . . . . 26.02 111.403 -178.109 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 14.7 tt0 -46.17 -43.71 15.37 Favored 'General case' 0 N--CA 1.495 1.807 0 CA-C-O 115.831 -2.033 . . . . 13.35 106.125 177.375 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 17.5 m -115.24 -7.09 12.41 Favored 'General case' 0 C--O 1.273 2.312 0 O-C-N 128.086 3.366 . . . . 10.24 118.866 -179.089 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 17.4 m-70 -140.75 158.87 43.35 Favored 'General case' 0 N--CA 1.5 2.05 0 CA-C-N 120.327 1.422 . . . . 7.46 112.28 -178.879 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 19.0 p -116.48 154.31 30.58 Favored 'General case' 0 C--O 1.272 2.25 0 N-CA-C 102.1 -3.296 . . . . 6.25 102.1 176.096 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . 0.275 12.9 tt -127.1 -16.16 3.1 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.27 0 O-C-N 128.126 3.391 . . . . 10.529999999999999 110.662 178.82 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . 0.266 0.5 OUTLIER -55.59 143.59 29.43 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 124.709 1.204 . . . . 31.510000000000002 111.978 178.208 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.0 tm-20 -59.4 131.3 50.56 Favored 'General case' 0 C--O 1.258 1.549 0 N-CA-C 104.844 -2.28 . . . . 37.579999999999998 104.844 174.312 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 71.21 17.07 75.59 Favored Glycine 0 C--O 1.264 1.991 0 C-N-CA 119.717 -1.23 . . . . 20.34 115.425 -178.957 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -79.62 165.17 49.55 Favored Glycine 0 CA--C 1.577 3.918 1 N-CA-C 101.38 -4.688 . . . . 19.640000000000001 101.38 177.692 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_endo -93.25 166.76 2.4 Favored 'Trans proline' 0 C--N 1.305 -1.745 0 C-N-CA 123.677 2.918 . . . . 17.309999999999999 114.026 179.151 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -72.93 170.73 14.17 Favored 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 101.689 -3.448 . . . . 10.949999999999999 101.689 174.489 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' LYS . . . . . 0.413 ' NZ ' ' O ' ' A' ' 15' ' ' GLN . 24.2 mtmt -158.08 -137.59 0.05 Allowed 'General case' 0 C--N 1.259 -3.327 0 C-N-CA 131.229 3.811 . . . . 13.18 103.435 -179.408 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 79.5 t -59.38 -46.19 92.8 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.339 0 O-C-N 126.992 2.682 . . . . 10.26 109.52 178.218 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -106.08 169.87 16.19 Favored Glycine 0 CA--C 1.546 2.025 0 N-CA-C 104.464 -3.454 . . . . 10.98 104.464 177.795 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -84.37 156.79 12.62 Favored 'Trans proline' 0 C--O 1.251 1.145 0 O-C-N 124.926 2.014 . . . . 11.380000000000001 112.65 -175.691 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.274 8.0 t-20 -62.64 135.56 57.44 Favored 'General case' 0 N--CA 1.504 2.262 0 C-N-CA 118.404 -1.318 . . . . 11.33 107.562 177.511 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 57.0 mt -92.87 -7.11 47.18 Favored 'General case' 0 C--O 1.294 3.397 0 CA-C-O 114.66 -2.59 . . . . 13.84 116.004 -177.672 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' HIS . . . . . 0.402 ' O ' ' NH2' ' A' ' 38' ' ' ARG 0.278 6.9 t60 -53.78 135.5 41.44 Favored 'General case' 0 N--CA 1.483 1.217 0 CA-C-O 125.252 2.454 . . . . 13.58 106.068 -179.206 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 80.86 4.72 90.38 Favored Glycine 0 C--O 1.276 2.757 0 CA-C-N 112.749 -2.023 . . . . 10.19 114.202 -179.044 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . 0.345 3.2 tp -49.49 -55.84 3.91 Favored 'Isoleucine or valine' 0 C--O 1.258 1.507 0 N-CA-C 113.838 1.051 . . . . 9.7799999999999994 113.838 -175.689 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . 0.277 85.6 m-85 -50.57 -33.35 21.55 Favored 'General case' 0 C--O 1.253 1.289 0 N-CA-C 113.965 1.098 . . . . 15.02 113.965 -178.633 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -92.67 33.2 5.12 Favored Glycine 0 N--CA 1.48 1.581 1 CA-C-O 111.906 -4.83 . . . . 18.32 110.71 -178.471 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ARG . . . . . 0.535 ' NH1' ' O ' ' A' ' 131' ' ' HOH . 0.0 OUTLIER -153.04 165.18 36.39 Favored 'General case' 0 N--CA 1.498 1.952 1 O-C-N 130.127 4.075 . . . . 16.91 113.702 -173.972 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' HIS . . . . . 0.484 ' N ' ' O ' ' A' ' 112' ' ' HOH . 21.3 m80 -92.49 170.75 9.51 Favored 'General case' 0 C--O 1.27 2.184 0 N-CA-C 106.528 -1.656 . . . . 25.870000000000001 106.528 -178.708 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 97.1 p -73.19 151.35 41.53 Favored 'General case' 0 C--O 1.288 3.12 0 O-C-N 127.674 3.109 . . . . 14.039999999999999 106.989 -179.511 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 64.76 45.72 91.88 Favored Glycine 0 C--O 1.294 3.893 1 N-CA-C 123.131 4.013 . . . . 16.030000000000001 123.131 179.293 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . 0.308 0.0 OUTLIER -131.02 -8.46 3.88 Favored 'General case' 0 CA--C 1.481 -1.698 0 O-C-N 119.693 -2.063 . . . . 28.629999999999999 115.018 -179.212 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 77.5 t -61.68 126.51 19.88 Favored 'Isoleucine or valine' 0 CA--C 1.572 1.807 0 N-CA-C 104.232 -2.507 . . . . 19.370000000000001 104.232 176.495 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.73 135.94 53.49 Favored 'General case' 0 C--N 1.307 -1.248 0 C-N-CA 128.688 2.795 . . . . 26.43 109.23 178.385 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 83.58 -0.04 89.75 Favored Glycine 0 C--O 1.262 1.879 1 O-C-N 129.763 4.414 . . . . 23.079999999999998 114.236 177.76 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 67.0 t80 -99.05 140.95 32.44 Favored 'General case' 0 C--O 1.252 1.234 0 CA-C-O 121.534 0.683 . . . . 17.039999999999999 109.683 178.993 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . 0.353 1.4 p -101.07 106.92 18.24 Favored 'General case' 0 N--CA 1.507 2.4 0 C-N-CA 112.828 -3.549 . . . . 17.899999999999999 108.574 -178.107 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -93.74 163.09 13.67 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 120.035 -0.666 . . . . 14.039999999999999 110.649 178.515 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 43.2 p -72.59 159.81 33.29 Favored 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 104.528 -2.397 . . . . 13.039999999999999 104.528 175.851 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -63.18 -30.54 71.66 Favored 'General case' 0 C--N 1.318 -0.778 0 O-C-N 125.13 1.519 . . . . 15.77 107.967 177.592 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -55.36 -49.68 71.64 Favored 'General case' 0 C--O 1.264 1.849 1 O-C-N 130.164 4.665 . . . . 17.879999999999999 114.753 -176.023 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ASN . . . . . 0.631 ' ND2' ' O ' ' A' ' 106' ' ' HOH . 3.9 t-20 -72.26 -45.37 60.43 Favored 'General case' 0 C--O 1.274 2.355 0 O-C-N 128.254 3.471 . . . . 18.460000000000001 110.477 178.371 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -55.36 -52.18 48.74 Favored 'Isoleucine or valine' 0 C--O 1.26 1.632 0 C-N-CA 117.196 -1.802 . . . . 24.25 109.738 179.25 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 27.6 m-20 -61.73 -27.81 68.98 Favored 'General case' 0 C--N 1.314 -0.971 0 C-N-CA 126.401 1.881 . . . . 28.469999999999999 114.134 -177.729 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 25.0 tptt -67.17 -28.07 67.8 Favored 'General case' 0 C--N 1.3 -1.573 0 CA-C-N 112.887 -1.961 . . . . 26.640000000000001 111.791 -176.511 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 41.3 t30 41.5 48.31 3.39 Favored 'General case' 0 C--N 1.294 -1.818 1 C-N-CA 132.395 4.278 . . . . 21.690000000000001 112.41 179.461 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' VAL . . . . . 0.403 ' O ' ' CA ' ' A' ' 39' ' ' HIS . 3.6 t -73.97 138.03 22.01 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.342 0 C-N-CA 116.3 -2.16 . . . . 21.41 110.948 -175.434 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . 0.26 4.4 mttt -95.21 102.78 14.61 Favored 'General case' 0 CA--C 1.573 1.828 1 N-CA-C 98.363 -4.68 . . . . 19.550000000000001 98.363 174.838 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 79.8 m95 -69.54 112.25 5.92 Favored 'General case' 0 C--N 1.305 -1.362 0 O-C-N 125.799 1.937 . . . . 19.210000000000001 111.829 -179.105 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ASP . . . . . 0.418 ' OD1' ' N ' ' A' ' 62' ' ' ASP . 10.6 p30 -124.14 -168.74 1.84 Allowed 'General case' 0 C--O 1.275 2.433 0 N-CA-C 101.012 -3.699 . . . . 25.34 101.012 176.308 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' GLU . . . . . 0.63 ' N ' ' O ' ' A' ' 132' ' ' HOH . 1.8 mp0 -86.84 -22.72 25.62 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 118.711 -1.196 . . . . 35.359999999999999 112.45 -177.91 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' ASP . . . . . 0.418 ' N ' ' OD1' ' A' ' 60' ' ' ASP . 0.5 OUTLIER -75.64 -37.22 59.87 Favored 'General case' 0 N--CA 1.498 1.925 0 CA-C-O 123.999 1.857 . . . . 33.560000000000002 109.213 -179.131 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.69 -59.37 5.5 Favored 'General case' 0 CA--C 1.549 0.918 1 C-N-CA 132.784 4.433 . . . . 21.93 109.427 177.507 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 55.7 tpp -54.09 -36.82 63.6 Favored 'General case' 0 C--N 1.302 -1.479 0 C-N-CA 128.139 2.576 . . . . 13.640000000000001 110.232 178.666 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 7.7 t -65.78 -47.61 74.59 Favored 'General case' 0 C--O 1.251 1.137 0 CA-C-O 113.137 -3.316 . . . . 14.529999999999999 111.919 -178.51 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' GLU . . . . . 0.453 ' CB ' ' O ' ' A' ' 119' ' ' HOH 0.272 1.1 tt0 -61.35 -57.41 12.41 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 128.455 3.597 . . . . 32.299999999999997 107.639 176.365 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -47.8 -42.74 26.76 Favored 'General case' 0 C--O 1.288 3.112 0 CA-C-N 111.826 -2.443 . . . . 16.629999999999999 110.653 -178.763 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' LEU . . . . . 0.457 ' O ' ' N ' ' A' ' 85' ' ' LEU 0.32 25.8 mt -75.62 -17.7 59.92 Favored 'General case' 0 C--O 1.25 1.108 0 C-N-CA 116.096 -2.242 . . . . 16.52 115.759 -175.722 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' THR . . . . . 0.518 ' O ' ' CE ' ' A' ' 86' ' ' LYS . 1.7 m -74.64 -29.14 61.16 Favored 'General case' 0 C--N 1.318 -0.788 0 O-C-N 126.963 2.665 . . . . 21.18 108.221 177.609 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -170.87 89.59 0.48 Allowed Pre-proline 0 N--CA 1.52 3.032 0 CA-C-O 124.875 2.274 . . . . 21.239999999999998 108.345 179.655 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' PRO . . . . . 0.465 ' O ' ' N ' ' A' ' 75' ' ' ILE . 2.0 Cg_endo -55.95 -45.79 36.03 Favored 'Trans proline' 0 C--N 1.354 0.837 0 CA-C-N 112.919 -1.493 . . . . 10.289999999999999 111.993 -179.556 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.531 3.591 0 C-N-CA 114.906 -2.718 . . . . 18.140000000000001 107.682 -177.194 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 8.3 tptm -63.24 -43.42 98.09 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-N 113.643 -1.617 . . . . 17.399999999999999 109.643 -179.578 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 36.2 t80 -76.43 -32.68 58.61 Favored 'General case' 0 C--O 1.255 1.365 0 C-N-CA 117.314 -1.755 . . . . 18.050000000000001 110.018 178.421 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ILE . . . . . 0.465 ' N ' ' O ' ' A' ' 71' ' ' PRO . 36.6 mt -133.46 84.03 47.47 Favored Pre-proline 0 C--O 1.249 1.051 0 O-C-N 125.031 1.457 . . . . 18.420000000000002 112.417 -179.984 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -59.06 130.14 35.05 Favored 'Trans proline' 0 CA--C 1.547 1.169 0 N-CA-C 104.691 -2.85 . . . . 18.16 104.691 176.758 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 104.51 -24.67 28.1 Favored Glycine 0 C--O 1.262 1.864 0 O-C-N 126.372 2.295 . . . . 17.07 112.805 179.47 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 13.5 t -55.83 152.03 10.49 Favored 'General case' 0 C--O 1.252 1.195 0 C-N-CA 117.632 -1.627 . . . . 12.65 110.485 179.901 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -97.86 -1.62 42.65 Favored 'General case' 0 C--O 1.275 2.447 0 C-N-CA 128.748 2.819 . . . . 10.98 111.796 178.807 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 5.3 ttp -67.68 125.37 26.0 Favored 'General case' 0 N--CA 1.498 1.944 0 CA-C-O 115.11 -2.376 . . . . 10.68 107.115 176.859 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -113.42 105.22 13.12 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-O 126.788 3.185 . . . . 16.59 109.133 -177.902 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 64.7 t80 -172.72 128.57 0.51 Allowed 'General case' 0 N--CA 1.505 2.3 0 CA-C-N 108.633 -3.894 . . . . 22.050000000000001 103.576 -176.391 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -59.15 -30.93 68.53 Favored 'General case' 0 C--O 1.269 2.121 0 O-C-N 125.556 1.785 . . . . 24.41 112.703 179.681 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 112.25 165.71 17.3 Favored Glycine 0 N--CA 1.511 3.651 0 C-N-CA 116.026 -2.988 . . . . 16.760000000000002 106.338 178.501 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' LEU . . . . . 0.457 ' N ' ' O ' ' A' ' 68' ' ' LEU . 9.5 mt -104.52 106.4 16.88 Favored 'General case' 0 N--CA 1.512 2.665 0 O-C-N 128.471 3.101 . . . . 13.83 106.744 178.678 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' LYS . . . . . 0.518 ' CE ' ' O ' ' A' ' 69' ' ' THR . 0.0 OUTLIER -72.86 -44.41 61.39 Favored 'General case' 0 C--O 1.253 1.287 0 CA-C-O 115.537 -2.173 . . . . 27.829999999999998 116.499 -178.484 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 35.0 mttp -75.94 128.83 35.88 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 120.838 1.654 . . . . 27.699999999999999 108.937 178.222 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 21.6 tt0 -55.36 -40.79 71.7 Favored 'General case' 0 C--N 1.311 -1.074 0 C-N-CA 127.979 2.512 . . . . 22.030000000000001 111.923 178.327 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.89 -46.6 87.45 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 112.559 -2.11 . . . . 26.5 107.381 -179.241 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 57.1 m-20 -52.62 -47.12 67.2 Favored 'General case' 0 C--O 1.256 1.424 0 O-C-N 126.552 2.407 . . . . 17.440000000000001 114.777 -177.873 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 67.9 mtm-85 -67.37 -37.77 83.71 Favored 'General case' 0 C--N 1.301 -1.509 0 C-N-CA 128.89 2.876 . . . . 17.34 113.666 -178.987 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -68.56 -47.23 67.37 Favored 'General case' 0 C--N 1.375 1.713 0 O-C-N 127.578 3.049 . . . . 13.779999999999999 107.48 178.149 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 90.4 m-20 -55.18 -54.75 39.32 Favored 'General case' 0 C--O 1.28 2.688 0 O-C-N 125.819 1.95 . . . . 8.7300000000000004 108.504 -178.27 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 49.1 tp -53.42 -54.86 30.7 Favored 'General case' 0 N--CA 1.497 1.875 0 CA-C-N 110.691 -2.959 . . . . 4.9500000000000002 113.789 -177.36 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 61.5 mt -58.66 -26.05 30.33 Favored 'Isoleucine or valine' 0 C--O 1.291 3.248 0 O-C-N 126.505 2.378 . . . . 10.26 111.707 -178.967 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 85.4 m -64.67 -60.69 2.82 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 103.69 -2.707 . . . . 14.99 103.69 -179.115 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 90.6 t80 -49.45 -54.0 20.0 Favored 'General case' 0 C--O 1.249 1.066 0 CA-C-O 124.997 2.332 . . . . 19.199999999999999 112.985 -179.872 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 60.6 mtp -50.62 -55.5 16.06 Favored 'General case' 0 N--CA 1.511 2.58 0 CA-C-N 108.614 -3.903 . . . . 12.82 106.558 -174.892 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . 0.317 0.9 OUTLIER -50.9 -34.65 29.23 Favored 'General case' 0 C--O 1.251 1.154 0 O-C-N 129.046 3.966 . . . . 16.98 111.896 -177.504 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.49 -49.76 8.94 Favored 'General case' 0 C--O 1.266 1.955 0 N-CA-C 114.858 1.429 . . . . 24.699999999999999 114.858 -178.686 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -63.38 -39.19 93.85 Favored 'General case' 0 C--O 1.273 2.303 0 CA-C-O 125.218 2.437 . . . . 9.4299999999999997 114.41 -177.511 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -79.07 2.7 19.73 Favored 'General case' 0 C--O 1.249 1.036 0 CA-C-N 111.434 -2.621 . . . . 9.1999999999999993 114.045 -178.991 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.608 0 N-CA-C 116.168 1.914 . . . . 17.690000000000001 116.168 -179.38 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' HOH . . . . . 0.631 ' O ' ' ND2' ' A' ' 52' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' HOH . . . . . 0.484 ' O ' ' N ' ' A' ' 39' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' HOH . . . . . 0.453 ' O ' ' CB ' ' A' ' 66' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' HOH . . . . . 0.441 ' O ' ' CB ' ' A' ' 69' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' HOH . . . . . 0.535 ' O ' ' NH1' ' A' ' 38' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' HOH . . . . . 0.63 ' O ' ' N ' ' A' ' 61' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 . . . . . 0.442 ' O ' ' NE2' ' A' ' 15' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 orig full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 158' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 159' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 160' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 161' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 162' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 163' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' -9' ' ' ALA . . . . . 0.691 ' O ' HG23 ' A' ' -5' ' ' THR . . . . . . . . 0 N--CA 1.485 1.319 0 CA-C-O 123.883 1.802 . . . . 79.689999999999998 108.348 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' -8' ' ' LYS . . . . . 0.896 ' HA ' ' HB3' ' A' ' 62' ' ' ASP . 0.0 OUTLIER -53.98 -54.33 40.59 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 111.828 -2.442 . . . . 77.420000000000002 110.635 -179.381 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' -7' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -53.62 -49.68 67.32 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 110.907 -2.861 . . . . 78.510000000000005 108.615 -177.857 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' -6' ' ' SER . . . . . 0.514 ' HB2' ' HB1' ' A' ' -9' ' ' ALA . 0.4 OUTLIER -51.84 -53.26 42.3 Favored 'General case' 0 CA--C 1.54 0.571 0 O-C-N 127.958 3.286 . . . . 71.290000000000006 107.185 178.896 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' -5' ' ' THR . . . . . 0.691 HG23 ' O ' ' A' ' -9' ' ' ALA 0.398 81.5 p -53.33 -61.39 2.33 Favored 'General case' 0 N--CA 1.484 1.227 0 CA-C-N 109.221 -3.627 . . . . 66.810000000000002 107.061 -177.733 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' -4' ' ' GLY . . . . . . . . . . . . . . . 57.34 33.82 66.61 Favored Glycine 0 CA--C 1.541 1.662 0 N-CA-C 107.438 -2.265 . . . . 61.189999999999998 107.438 -179.652 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -37.75 126.86 1.18 Allowed 'General case' 0 C--O 1.256 1.439 0 C-N-CA 124.984 1.314 . . . . 53.539999999999999 110.228 179.381 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' -2' ' ' LYS . . . . . 0.405 ' HA ' ' HD3' ' A' ' -1' ' ' PRO . 0.0 OUTLIER -109.93 141.95 24.84 Favored Pre-proline 0 C--N 1.296 -1.733 0 C-N-CA 125.447 1.499 . . . . 41.159999999999997 108.849 177.712 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' -1' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' -2' ' ' LYS . 50.3 Cg_exo -62.83 146.38 94.99 Favored 'Trans proline' 0 C--N 1.31 -1.459 0 N-CA-C 106.702 -2.076 . . . . 32.240000000000002 106.702 176.687 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -133.11 -156.87 8.23 Favored Glycine 0 C--O 1.253 1.284 0 CA-C-O 126.198 3.11 . . . . 26.0 112.329 -179.0 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 2' ' ' SER . . . . . 0.508 ' OG ' ' HB2' ' A' ' 5' ' ' LYS . 22.7 t -85.7 107.05 17.39 Favored 'General case' 0 C--O 1.253 1.282 0 CA-C-N 111.006 -2.597 . . . . 14.460000000000001 113.847 -179.082 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -61.5 -36.11 79.58 Favored 'General case' 0 C--O 1.255 1.349 0 O-C-N 127.27 2.856 . . . . 12.279999999999999 107.327 175.496 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.94 -57.1 13.51 Favored 'General case' 0 C--O 1.25 1.086 0 O-C-N 125.875 1.985 . . . . 26.010000000000002 105.715 178.074 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 5' ' ' LYS . . . . . 0.508 ' HB2' ' OG ' ' A' ' 2' ' ' SER . 1.3 tttm -55.32 -44.7 76.1 Favored 'General case' 0 C--N 1.298 -1.651 0 CA-C-N 110.364 -3.107 . . . . 23.109999999999999 110.101 -178.675 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -60.81 -48.1 87.91 Favored Glycine 0 N--CA 1.486 1.999 0 N-CA-C 107.426 -2.269 . . . . 12.949999999999999 107.426 179.184 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -47.12 -52.77 14.5 Favored 'General case' 0 C--N 1.314 -0.936 0 O-C-N 125.126 1.133 . . . . 10.24 108.816 -179.283 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . 0.322 50.1 p -67.96 -31.73 71.67 Favored 'General case' 0 C--O 1.26 1.62 0 N-CA-C 115.334 1.605 . . . . 18.010000000000002 115.334 -177.426 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 9' ' ' LEU . . . . . 0.517 ' O ' ' HG3' ' A' ' 13' ' ' ARG . 2.0 tp -73.36 -26.03 60.84 Favored 'General case' 0 N--CA 1.485 1.302 0 CA-C-O 113.594 -3.098 . . . . 20.780000000000001 106.928 -179.673 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . 0.363 34.4 t80 -65.84 -47.86 73.58 Favored 'General case' 0 CA--C 1.563 1.479 0 O-C-N 126.857 2.598 . . . . 15.26 107.043 179.889 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 11' ' ' LYS . . . . . 0.456 ' O ' ' HD3' ' A' ' 11' ' ' LYS . 9.1 tmtt? -65.04 -42.99 93.81 Favored 'General case' 0 N--CA 1.483 1.207 1 O-C-N 132.696 6.248 . . . . 26.23 114.773 -175.487 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 75.7 p -81.89 -7.73 59.63 Favored 'General case' 0 N--CA 1.482 1.164 0 CA-C-O 114.648 -2.596 . . . . 17.739999999999998 110.414 -176.277 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ARG . . . . . 0.517 ' HG3' ' O ' ' A' ' 9' ' ' LEU . 7.9 mtp180 -133.06 -21.54 2.1 Favored 'General case' 0 C--O 1.283 2.845 2 N-CA-C 123.752 4.723 . . . . 35.200000000000003 123.752 -176.929 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . 0.268 19.0 m -127.78 -22.19 3.6 Favored 'General case' 0 C--N 1.275 -2.666 0 CA-C-N 123.045 2.657 . . . . 9.4299999999999997 110.933 -176.185 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 15' ' ' GLN . . . . . 0.415 ' NE2' ' HG2' ' A' ' 11' ' ' LYS . 9.9 tt0 -61.66 -38.0 86.14 Favored 'General case' 0 CA--C 1.558 1.284 0 O-C-N 126.888 2.617 . . . . 26.02 111.403 -178.109 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 14.7 tt0 -46.17 -43.71 15.37 Favored 'General case' 0 N--CA 1.495 1.807 0 CA-C-O 115.831 -2.033 . . . . 13.35 106.125 177.375 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 17.5 m -115.24 -7.09 12.41 Favored 'General case' 0 C--O 1.273 2.312 0 O-C-N 128.086 3.366 . . . . 10.24 118.866 -179.089 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' HIS . . . . . 0.498 ' CE1' ' HD2' ' A' ' 30' ' ' PRO . 17.4 m-70 -140.75 158.87 43.35 Favored 'General case' 0 N--CA 1.5 2.05 0 CA-C-N 120.327 1.422 . . . . 7.46 112.28 -178.879 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 19' ' ' THR . . . . . 0.596 ' HB ' ' OE1' ' A' ' 21' ' ' GLU . 19.0 p -116.48 154.31 30.58 Favored 'General case' 0 C--O 1.272 2.25 0 N-CA-C 102.1 -3.296 . . . . 6.25 102.1 176.096 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 20' ' ' ILE . . . . . 0.537 ' O ' ' HB2' ' A' ' 33' ' ' HIS 0.275 12.9 tt -127.1 -16.16 3.1 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.27 0 O-C-N 128.126 3.391 . . . . 10.529999999999999 110.662 178.82 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 21' ' ' GLU . . . . . 0.596 ' OE1' ' HB ' ' A' ' 19' ' ' THR 0.266 0.5 OUTLIER -55.59 143.59 29.43 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 124.709 1.204 . . . . 31.510000000000002 111.978 178.208 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.0 tm-20 -59.4 131.3 50.56 Favored 'General case' 0 C--O 1.258 1.549 0 N-CA-C 104.844 -2.28 . . . . 37.579999999999998 104.844 174.312 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' GLY . . . . . 0.416 ' HA2' ' O ' ' A' ' 133' ' ' HOH . . . 71.21 17.07 75.59 Favored Glycine 0 C--O 1.264 1.991 0 C-N-CA 119.717 -1.23 . . . . 20.34 115.425 -178.957 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -79.62 165.17 49.55 Favored Glycine 0 CA--C 1.577 3.918 1 N-CA-C 101.38 -4.688 . . . . 19.640000000000001 101.38 177.692 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 25' ' ' PRO . . . . . 0.469 ' HD2' HG21 ' A' ' 19' ' ' THR . 26.9 Cg_endo -93.25 166.76 2.4 Favored 'Trans proline' 0 C--N 1.305 -1.745 0 C-N-CA 123.677 2.918 . . . . 17.309999999999999 114.026 179.151 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -72.93 170.73 14.17 Favored 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 101.689 -3.448 . . . . 10.949999999999999 101.689 174.489 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.2 mtmt -158.08 -137.59 0.05 Allowed 'General case' 0 C--N 1.259 -3.327 0 C-N-CA 131.229 3.811 . . . . 13.18 103.435 -179.408 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 79.5 t -59.38 -46.19 92.8 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.339 0 O-C-N 126.992 2.682 . . . . 10.26 109.52 178.218 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -106.08 169.87 16.19 Favored Glycine 0 CA--C 1.546 2.025 0 N-CA-C 104.464 -3.454 . . . . 10.98 104.464 177.795 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' PRO . . . . . 0.498 ' HD2' ' CE1' ' A' ' 18' ' ' HIS . 19.5 Cg_endo -84.37 156.79 12.62 Favored 'Trans proline' 0 C--O 1.251 1.145 0 O-C-N 124.926 2.014 . . . . 11.380000000000001 112.65 -175.691 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.274 8.0 t-20 -62.64 135.56 57.44 Favored 'General case' 0 N--CA 1.504 2.262 0 C-N-CA 118.404 -1.318 . . . . 11.33 107.562 177.511 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 57.0 mt -92.87 -7.11 47.18 Favored 'General case' 0 C--O 1.294 3.397 0 CA-C-O 114.66 -2.59 . . . . 13.84 116.004 -177.672 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' HIS . . . . . 0.537 ' HB2' ' O ' ' A' ' 20' ' ' ILE 0.278 6.9 t60 -53.78 135.5 41.44 Favored 'General case' 0 N--CA 1.483 1.217 0 CA-C-O 125.252 2.454 . . . . 13.58 106.068 -179.206 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 80.86 4.72 90.38 Favored Glycine 0 C--O 1.276 2.757 0 CA-C-N 112.749 -2.023 . . . . 10.19 114.202 -179.044 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . 0.345 3.2 tp -49.49 -55.84 3.91 Favored 'Isoleucine or valine' 0 C--O 1.258 1.507 0 N-CA-C 113.838 1.051 . . . . 9.7799999999999994 113.838 -175.689 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 36' ' ' PHE . . . . . 0.413 ' CE1' ' HG3' ' A' ' 61' ' ' GLU 0.277 85.6 m-85 -50.57 -33.35 21.55 Favored 'General case' 0 C--O 1.253 1.289 0 N-CA-C 113.965 1.098 . . . . 15.02 113.965 -178.633 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -92.67 33.2 5.12 Favored Glycine 0 N--CA 1.48 1.581 1 CA-C-O 111.906 -4.83 . . . . 18.32 110.71 -178.471 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ARG . . . . . 0.535 ' NH1' ' O ' ' A' ' 131' ' ' HOH . 0.0 OUTLIER -153.04 165.18 36.39 Favored 'General case' 0 N--CA 1.498 1.952 1 O-C-N 130.127 4.075 . . . . 16.91 113.702 -173.972 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 39' ' ' HIS . . . . . 0.623 ' HA ' ' O ' ' A' ' 57' ' ' VAL . 21.3 m80 -92.49 170.75 9.51 Favored 'General case' 0 C--O 1.27 2.184 0 N-CA-C 106.528 -1.656 . . . . 25.870000000000001 106.528 -178.708 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 40' ' ' SER . . . . . 0.522 ' HA ' ' HE1' ' A' ' 59' ' ' TRP . 97.1 p -73.19 151.35 41.53 Favored 'General case' 0 C--O 1.288 3.12 0 O-C-N 127.674 3.109 . . . . 14.039999999999999 106.989 -179.511 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 41' ' ' GLY . . . . . 0.489 ' O ' ' HG2' ' A' ' 42' ' ' GLN . . . 64.76 45.72 91.88 Favored Glycine 0 C--O 1.294 3.893 1 N-CA-C 123.131 4.013 . . . . 16.030000000000001 123.131 179.293 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 42' ' ' GLN . . . . . 0.489 ' HG2' ' O ' ' A' ' 41' ' ' GLY 0.308 2.4 mt-30 -131.02 -8.46 3.88 Favored 'General case' 0 CA--C 1.481 -1.698 0 O-C-N 119.693 -2.063 . . . . 28.629999999999999 115.018 -179.212 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 43' ' ' VAL . . . . . 0.601 ' HA ' ' NZ ' ' A' ' 44' ' ' LYS . 77.5 t -61.68 126.51 19.88 Favored 'Isoleucine or valine' 0 CA--C 1.572 1.807 0 N-CA-C 104.232 -2.507 . . . . 19.370000000000001 104.232 176.495 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 44' ' ' LYS . . . . . 0.601 ' NZ ' ' HA ' ' A' ' 43' ' ' VAL . 0.0 OUTLIER -67.73 135.94 53.49 Favored 'General case' 0 C--N 1.307 -1.248 0 C-N-CA 128.688 2.795 . . . . 26.43 109.23 178.385 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 45' ' ' GLY . . . . . 0.624 ' HA3' ' O ' ' A' ' 108' ' ' HOH . . . 83.58 -0.04 89.75 Favored Glycine 0 C--O 1.262 1.879 1 O-C-N 129.763 4.414 . . . . 23.079999999999998 114.236 177.76 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 67.0 t80 -99.05 140.95 32.44 Favored 'General case' 0 C--O 1.252 1.234 0 CA-C-O 121.534 0.683 . . . . 17.039999999999999 109.683 178.993 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . 0.353 1.4 p -101.07 106.92 18.24 Favored 'General case' 0 N--CA 1.507 2.4 0 C-N-CA 112.828 -3.549 . . . . 17.899999999999999 108.574 -178.107 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -93.74 163.09 13.67 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 120.035 -0.666 . . . . 14.039999999999999 110.649 178.515 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 43.2 p -72.59 159.81 33.29 Favored 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 104.528 -2.397 . . . . 13.039999999999999 104.528 175.851 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ASP . . . . . 0.427 ' O ' ' HB2' ' A' ' 54' ' ' ASN . 2.6 m-20 -63.18 -30.54 71.66 Favored 'General case' 0 C--N 1.318 -0.778 0 O-C-N 125.13 1.519 . . . . 15.77 107.967 177.592 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -55.36 -49.68 71.64 Favored 'General case' 0 C--O 1.264 1.849 1 O-C-N 130.164 4.665 . . . . 17.879999999999999 114.753 -176.023 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -72.26 -45.37 60.43 Favored 'General case' 0 C--O 1.274 2.355 0 O-C-N 128.254 3.471 . . . . 18.460000000000001 110.477 178.371 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -55.36 -52.18 48.74 Favored 'Isoleucine or valine' 0 C--O 1.26 1.632 0 C-N-CA 117.196 -1.802 . . . . 24.25 109.738 179.25 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 54' ' ' ASN . . . . . 0.427 ' HB2' ' O ' ' A' ' 50' ' ' ASP . 27.6 m-20 -61.73 -27.81 68.98 Favored 'General case' 0 C--N 1.314 -0.971 0 C-N-CA 126.401 1.881 . . . . 28.469999999999999 114.134 -177.729 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 55' ' ' LYS . . . . . 0.818 ' HG2' HG12 ' A' ' 75' ' ' ILE . 25.0 tptt -67.17 -28.07 67.8 Favored 'General case' 0 C--N 1.3 -1.573 0 CA-C-N 112.887 -1.961 . . . . 26.640000000000001 111.791 -176.511 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 41.3 t30 41.5 48.31 3.39 Favored 'General case' 0 C--N 1.294 -1.818 1 C-N-CA 132.395 4.278 . . . . 21.690000000000001 112.41 179.461 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 57' ' ' VAL . . . . . 0.642 ' CG2' ' HG3' ' A' ' 55' ' ' LYS . 3.6 t -73.97 138.03 22.01 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.342 0 C-N-CA 116.3 -2.16 . . . . 21.41 110.948 -175.434 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 58' ' ' LYS . . . . . 0.514 ' HD3' ' CE1' ' A' ' 39' ' ' HIS 0.26 4.4 mttt -95.21 102.78 14.61 Favored 'General case' 0 CA--C 1.573 1.828 1 N-CA-C 98.363 -4.68 . . . . 19.550000000000001 98.363 174.838 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 59' ' ' TRP . . . . . 0.522 ' HE1' ' HA ' ' A' ' 40' ' ' SER . 79.8 m95 -69.54 112.25 5.92 Favored 'General case' 0 C--N 1.305 -1.362 0 O-C-N 125.799 1.937 . . . . 19.210000000000001 111.829 -179.105 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ASP . . . . . 0.418 ' OD1' ' N ' ' A' ' 62' ' ' ASP . 10.6 p30 -124.14 -168.74 1.84 Allowed 'General case' 0 C--O 1.275 2.433 0 N-CA-C 101.012 -3.699 . . . . 25.34 101.012 176.308 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 61' ' ' GLU . . . . . 0.413 ' HG3' ' CE1' ' A' ' 36' ' ' PHE . 1.8 mp0 -86.84 -22.72 25.62 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 118.711 -1.196 . . . . 35.359999999999999 112.45 -177.91 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 62' ' ' ASP . . . . . 0.896 ' HB3' ' HA ' ' A' ' -8' ' ' LYS . 0.5 OUTLIER -75.64 -37.22 59.87 Favored 'General case' 0 N--CA 1.498 1.925 0 CA-C-O 123.999 1.857 . . . . 33.560000000000002 109.213 -179.131 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 63' ' ' SER . . . . . 0.594 ' HA ' ' O ' ' A' ' 152' ' ' HOH . 0.3 OUTLIER -60.69 -59.37 5.5 Favored 'General case' 0 CA--C 1.549 0.918 1 C-N-CA 132.784 4.433 . . . . 21.93 109.427 177.507 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 64' ' ' MET . . . . . 0.488 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 55.7 tpp -54.09 -36.82 63.6 Favored 'General case' 0 C--N 1.302 -1.479 0 C-N-CA 128.139 2.576 . . . . 13.640000000000001 110.232 178.666 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 7.7 t -65.78 -47.61 74.59 Favored 'General case' 0 C--O 1.251 1.137 0 CA-C-O 113.137 -3.316 . . . . 14.529999999999999 111.919 -178.51 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' GLU . . . . . 0.68 ' HG2' ' CD1' ' A' ' 74' ' ' TYR 0.272 1.1 tt0 -61.35 -57.41 12.41 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 128.455 3.597 . . . . 32.299999999999997 107.639 176.365 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 67' ' ' TYR . . . . . 0.642 ' CE2' HD12 ' A' ' 75' ' ' ILE . 57.5 t80 -47.8 -42.74 26.76 Favored 'General case' 0 C--O 1.288 3.112 0 CA-C-N 111.826 -2.443 . . . . 16.629999999999999 110.653 -178.763 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 68' ' ' LEU . . . . . 0.488 ' HG ' ' O ' ' A' ' 64' ' ' MET 0.32 25.8 mt -75.62 -17.7 59.92 Favored 'General case' 0 C--O 1.25 1.108 0 C-N-CA 116.096 -2.242 . . . . 16.52 115.759 -175.722 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 69' ' ' THR . . . . . 0.649 ' O ' ' HE2' ' A' ' 86' ' ' LYS . 1.7 m -74.64 -29.14 61.16 Favored 'General case' 0 C--N 1.318 -0.788 0 O-C-N 126.963 2.665 . . . . 21.18 108.221 177.609 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 70' ' ' ASN . . . . . 0.724 ' HB3' ' HB3' ' A' ' 73' ' ' LYS . 2.1 t-20 -170.87 89.59 0.48 Allowed Pre-proline 0 N--CA 1.52 3.032 0 CA-C-O 124.875 2.274 . . . . 21.239999999999998 108.345 179.655 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -55.95 -45.79 36.03 Favored 'Trans proline' 0 C--N 1.354 0.837 0 CA-C-N 112.919 -1.493 . . . . 10.289999999999999 111.993 -179.556 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' M3L . . . . . 0.603 HM13 ' O ' ' A' ' 144' ' ' HOH . . . . . . . . 0 N--CA 1.531 3.591 0 C-N-CA 114.906 -2.718 . . . . 18.140000000000001 107.682 -177.194 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' LYS . . . . . 0.724 ' HB3' ' HB3' ' A' ' 70' ' ' ASN . 8.3 tptm -63.24 -43.42 98.09 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-N 113.643 -1.617 . . . . 17.399999999999999 109.643 -179.578 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 74' ' ' TYR . . . . . 0.68 ' CD1' ' HG2' ' A' ' 66' ' ' GLU . 36.2 t80 -76.43 -32.68 58.61 Favored 'General case' 0 C--O 1.255 1.365 0 C-N-CA 117.314 -1.755 . . . . 18.050000000000001 110.018 178.421 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ILE . . . . . 0.818 HG12 ' HG2' ' A' ' 55' ' ' LYS . 36.6 mt -133.46 84.03 47.47 Favored Pre-proline 0 C--O 1.249 1.051 0 O-C-N 125.031 1.457 . . . . 18.420000000000002 112.417 -179.984 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 76' ' ' PRO . . . . . 0.484 ' HA ' ' O ' ' A' ' 143' ' ' HOH . 23.9 Cg_exo -59.06 130.14 35.05 Favored 'Trans proline' 0 CA--C 1.547 1.169 0 N-CA-C 104.691 -2.85 . . . . 18.16 104.691 176.758 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 104.51 -24.67 28.1 Favored Glycine 0 C--O 1.262 1.864 0 O-C-N 126.372 2.295 . . . . 17.07 112.805 179.47 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 13.5 t -55.83 152.03 10.49 Favored 'General case' 0 C--O 1.252 1.195 0 C-N-CA 117.632 -1.627 . . . . 12.65 110.485 179.901 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -97.86 -1.62 42.65 Favored 'General case' 0 C--O 1.275 2.447 0 C-N-CA 128.748 2.819 . . . . 10.98 111.796 178.807 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 80' ' ' MET . . . . . 0.538 ' HG3' ' C4C' ' A' ' 104' ' ' HEM . 5.3 ttp -67.68 125.37 26.0 Favored 'General case' 0 N--CA 1.498 1.944 0 CA-C-O 115.11 -2.376 . . . . 10.68 107.115 176.859 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -113.42 105.22 13.12 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-O 126.788 3.185 . . . . 16.59 109.133 -177.902 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 64.7 t80 -172.72 128.57 0.51 Allowed 'General case' 0 N--CA 1.505 2.3 0 CA-C-N 108.633 -3.894 . . . . 22.050000000000001 103.576 -176.391 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -59.15 -30.93 68.53 Favored 'General case' 0 C--O 1.269 2.121 0 O-C-N 125.556 1.785 . . . . 24.41 112.703 179.681 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 112.25 165.71 17.3 Favored Glycine 0 N--CA 1.511 3.651 0 C-N-CA 116.026 -2.988 . . . . 16.760000000000002 106.338 178.501 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' LEU . . . . . 0.591 HD22 ' HB3' ' A' ' 90' ' ' ASP . 9.5 mt -104.52 106.4 16.88 Favored 'General case' 0 N--CA 1.512 2.665 0 O-C-N 128.471 3.101 . . . . 13.83 106.744 178.678 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 86' ' ' LYS . . . . . 0.649 ' HE2' ' O ' ' A' ' 69' ' ' THR . 0.0 OUTLIER -72.86 -44.41 61.39 Favored 'General case' 0 C--O 1.253 1.287 0 CA-C-O 115.537 -2.173 . . . . 27.829999999999998 116.499 -178.484 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 35.0 mttp -75.94 128.83 35.88 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 120.838 1.654 . . . . 27.699999999999999 108.937 178.222 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 21.6 tt0 -55.36 -40.79 71.7 Favored 'General case' 0 C--N 1.311 -1.074 0 C-N-CA 127.979 2.512 . . . . 22.030000000000001 111.923 178.327 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.89 -46.6 87.45 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 112.559 -2.11 . . . . 26.5 107.381 -179.241 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 90' ' ' ASP . . . . . 0.591 ' HB3' HD22 ' A' ' 85' ' ' LEU . 57.1 m-20 -52.62 -47.12 67.2 Favored 'General case' 0 C--O 1.256 1.424 0 O-C-N 126.552 2.407 . . . . 17.440000000000001 114.777 -177.873 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 67.9 mtm-85 -67.37 -37.77 83.71 Favored 'General case' 0 C--N 1.301 -1.509 0 C-N-CA 128.89 2.876 . . . . 17.34 113.666 -178.987 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -68.56 -47.23 67.37 Favored 'General case' 0 C--N 1.375 1.713 0 O-C-N 127.578 3.049 . . . . 13.779999999999999 107.48 178.149 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 90.4 m-20 -55.18 -54.75 39.32 Favored 'General case' 0 C--O 1.28 2.688 0 O-C-N 125.819 1.95 . . . . 8.7300000000000004 108.504 -178.27 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 49.1 tp -53.42 -54.86 30.7 Favored 'General case' 0 N--CA 1.497 1.875 0 CA-C-N 110.691 -2.959 . . . . 4.9500000000000002 113.789 -177.36 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' ILE . . . . . 0.618 ' O ' ' HB ' ' A' ' 99' ' ' THR . 61.5 mt -58.66 -26.05 30.33 Favored 'Isoleucine or valine' 0 C--O 1.291 3.248 0 O-C-N 126.505 2.378 . . . . 10.26 111.707 -178.967 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 85.4 m -64.67 -60.69 2.82 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 103.69 -2.707 . . . . 14.99 103.69 -179.115 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 90.6 t80 -49.45 -54.0 20.0 Favored 'General case' 0 C--O 1.249 1.066 0 CA-C-O 124.997 2.332 . . . . 19.199999999999999 112.985 -179.872 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 60.6 mtp -50.62 -55.5 16.06 Favored 'General case' 0 N--CA 1.511 2.58 0 CA-C-N 108.614 -3.903 . . . . 12.82 106.558 -174.892 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' THR . . . . . 0.618 ' HB ' ' O ' ' A' ' 95' ' ' ILE 0.317 0.9 OUTLIER -50.9 -34.65 29.23 Favored 'General case' 0 C--O 1.251 1.154 0 O-C-N 129.046 3.966 . . . . 16.98 111.896 -177.504 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 100' ' ' LYS . . . . . 0.475 ' HE3' ' O ' ' A' ' 100' ' ' LYS . 0.0 OUTLIER -83.49 -49.76 8.94 Favored 'General case' 0 C--O 1.266 1.955 0 N-CA-C 114.858 1.429 . . . . 24.699999999999999 114.858 -178.686 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -63.38 -39.19 93.85 Favored 'General case' 0 C--O 1.273 2.303 0 CA-C-O 125.218 2.437 . . . . 9.4299999999999997 114.41 -177.511 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' ALA . . . . . 0.501 ' HB2' HD11 ' A' ' 20' ' ' ILE . . . -79.07 2.7 19.73 Favored 'General case' 0 C--O 1.249 1.036 0 CA-C-N 111.434 -2.621 . . . . 9.1999999999999993 114.045 -178.991 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.608 0 N-CA-C 116.168 1.914 . . . . 17.690000000000001 116.168 -179.38 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 104' ' ' HEM . . . . . 0.538 ' C4C' ' HG3' ' A' ' 80' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 108' ' ' HOH . . . . . 0.624 ' O ' ' HA3' ' A' ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 112' ' ' HOH . . . . . 0.484 ' O ' ' N ' ' A' ' 39' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 117' ' ' HOH . . . . . 0.426 ' O ' ' HB3' ' A' ' 70' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 119' ' ' HOH . . . . . 0.539 ' O ' ' HB2' ' A' ' 66' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 121' ' ' HOH . . . . . 0.517 ' O ' ' HB ' ' A' ' 69' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 131' ' ' HOH . . . . . 0.535 ' O ' ' NH1' ' A' ' 38' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 133' ' ' HOH . . . . . 0.416 ' O ' ' HA2' ' A' ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 . . . . . 0.484 ' O ' ' HA ' ' A' ' 76' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 144' ' ' HOH . . . . . 0.603 ' O ' HM13 ' A' ' 72' ' ' M3L . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 149' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 151' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 152' ' ' HOH . . . . . 0.594 ' O ' ' HA ' ' A' ' 63' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 153' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 154' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 155' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 156' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 157' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 158' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 159' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 160' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 161' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 162' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 163' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' -9' ' ' ALA . . . . . 0.691 ' O ' HG23 ' A' ' -5' ' ' THR . . . . . . . . 0 N--CA 1.485 1.319 0 CA-C-O 123.883 1.802 . . . . 79.689999999999998 108.348 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' -8' ' ' LYS . . . . . 0.896 ' HA ' ' HB3' ' A' ' 62' ' ' ASP . 0.0 OUTLIER -53.98 -54.33 40.59 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 111.828 -2.442 . . . . 77.420000000000002 110.635 -179.381 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' -7' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -53.62 -49.68 67.32 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 110.907 -2.861 . . . . 78.510000000000005 108.615 -177.857 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' -6' ' ' SER . . . . . 0.514 ' HB2' ' HB1' ' A' ' -9' ' ' ALA . 0.4 OUTLIER -51.84 -53.26 42.3 Favored 'General case' 0 CA--C 1.54 0.571 0 O-C-N 127.958 3.286 . . . . 71.290000000000006 107.185 178.896 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' -5' ' ' THR . . . . . 0.691 HG23 ' O ' ' A' ' -9' ' ' ALA 0.398 81.5 p -53.33 -61.39 2.33 Favored 'General case' 0 N--CA 1.484 1.227 0 CA-C-N 109.221 -3.627 . . . . 66.810000000000002 107.061 -177.733 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' -4' ' ' GLY . . . . . . . . . . . . . . . 57.34 33.82 66.61 Favored Glycine 0 CA--C 1.541 1.662 0 N-CA-C 107.438 -2.265 . . . . 61.189999999999998 107.438 -179.652 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' -3' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -37.75 126.86 1.18 Allowed 'General case' 0 C--O 1.256 1.439 0 C-N-CA 124.984 1.314 . . . . 53.539999999999999 110.228 179.381 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' -2' ' ' LYS . . . . . 0.405 ' HA ' ' HD3' ' A' ' -1' ' ' PRO . 0.0 OUTLIER -109.93 141.95 24.84 Favored Pre-proline 0 C--N 1.296 -1.733 0 C-N-CA 125.447 1.499 . . . . 41.159999999999997 108.849 177.712 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' -1' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' -2' ' ' LYS . 50.3 Cg_exo -62.83 146.38 94.99 Favored 'Trans proline' 0 C--N 1.31 -1.459 0 N-CA-C 106.702 -2.076 . . . . 32.240000000000002 106.702 176.687 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . -133.11 -156.87 8.23 Favored Glycine 0 C--O 1.253 1.284 0 CA-C-O 126.198 3.11 . . . . 26.0 112.329 -179.0 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' SER . . . . . 0.508 ' OG ' ' HB2' ' A' ' 5' ' ' LYS . 22.7 t -85.7 107.05 17.39 Favored 'General case' 0 C--O 1.253 1.282 0 CA-C-N 111.006 -2.597 . . . . 14.460000000000001 113.847 -179.082 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -61.5 -36.11 79.58 Favored 'General case' 0 C--O 1.255 1.349 0 O-C-N 127.27 2.856 . . . . 12.279999999999999 107.327 175.496 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.94 -57.1 13.51 Favored 'General case' 0 C--O 1.25 1.086 0 O-C-N 125.875 1.985 . . . . 26.010000000000002 105.715 178.074 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.508 ' HB2' ' OG ' ' A' ' 2' ' ' SER . 1.3 tttm -55.32 -44.7 76.1 Favored 'General case' 0 C--N 1.298 -1.651 0 CA-C-N 110.364 -3.107 . . . . 23.109999999999999 110.101 -178.675 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -60.81 -48.1 87.91 Favored Glycine 0 N--CA 1.486 1.999 0 N-CA-C 107.426 -2.269 . . . . 12.949999999999999 107.426 179.184 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -47.12 -52.77 14.5 Favored 'General case' 0 C--N 1.314 -0.936 0 O-C-N 125.126 1.133 . . . . 10.24 108.816 -179.283 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . 0.322 50.1 p -67.96 -31.73 71.67 Favored 'General case' 0 C--O 1.26 1.62 0 N-CA-C 115.334 1.605 . . . . 18.010000000000002 115.334 -177.426 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.517 ' O ' ' HG3' ' A' ' 13' ' ' ARG . 2.0 tp -73.36 -26.03 60.84 Favored 'General case' 0 N--CA 1.485 1.302 0 CA-C-O 113.594 -3.098 . . . . 20.780000000000001 106.928 -179.673 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . 0.363 34.4 t80 -65.84 -47.86 73.58 Favored 'General case' 0 CA--C 1.563 1.479 0 O-C-N 126.857 2.598 . . . . 15.26 107.043 179.889 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.456 ' O ' ' HD3' ' A' ' 11' ' ' LYS . 9.1 tmtt? -65.04 -42.99 93.81 Favored 'General case' 0 N--CA 1.483 1.207 1 O-C-N 132.696 6.248 . . . . 26.23 114.773 -175.487 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 75.7 p -81.89 -7.73 59.63 Favored 'General case' 0 N--CA 1.482 1.164 0 CA-C-O 114.648 -2.596 . . . . 17.739999999999998 110.414 -176.277 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.517 ' HG3' ' O ' ' A' ' 9' ' ' LEU . 7.9 mtp180 -133.06 -21.54 2.1 Favored 'General case' 0 C--O 1.283 2.845 2 N-CA-C 123.752 4.723 . . . . 35.200000000000003 123.752 -176.929 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . 0.268 19.0 m -127.78 -22.19 3.6 Favored 'General case' 0 C--N 1.275 -2.666 0 CA-C-N 123.045 2.657 . . . . 9.4299999999999997 110.933 -176.185 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.415 ' NE2' ' HG2' ' A' ' 11' ' ' LYS . 9.9 tt0 -61.66 -38.0 86.14 Favored 'General case' 0 CA--C 1.558 1.284 0 O-C-N 126.888 2.617 . . . . 26.02 111.403 -178.109 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 14.7 tt0 -46.17 -43.71 15.37 Favored 'General case' 0 N--CA 1.495 1.807 0 CA-C-O 115.831 -2.033 . . . . 13.35 106.125 177.375 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 17.5 m -115.24 -7.09 12.41 Favored 'General case' 0 C--O 1.273 2.312 0 O-C-N 128.086 3.366 . . . . 10.24 118.866 -179.089 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.498 ' CE1' ' HD2' ' A' ' 30' ' ' PRO . 17.4 m-70 -140.75 158.87 43.35 Favored 'General case' 0 N--CA 1.5 2.05 0 CA-C-N 120.327 1.422 . . . . 7.46 112.28 -178.879 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' THR . . . . . 0.596 ' HB ' ' OE1' ' A' ' 21' ' ' GLU . 19.0 p -116.48 154.31 30.58 Favored 'General case' 0 C--O 1.272 2.25 0 N-CA-C 102.1 -3.296 . . . . 6.25 102.1 176.096 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.537 ' O ' ' HB2' ' A' ' 33' ' ' HIS 0.275 12.9 tt -127.1 -16.16 3.1 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.27 0 O-C-N 128.126 3.391 . . . . 10.529999999999999 110.662 178.82 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.596 ' OE1' ' HB ' ' A' ' 19' ' ' THR 0.266 0.5 OUTLIER -55.59 143.59 29.43 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 124.709 1.204 . . . . 31.510000000000002 111.978 178.208 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.0 tm-20 -59.4 131.3 50.56 Favored 'General case' 0 C--O 1.258 1.549 0 N-CA-C 104.844 -2.28 . . . . 37.579999999999998 104.844 174.312 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.416 ' HA2' ' O ' ' A' ' 133' ' ' HOH . . . 71.21 17.07 75.59 Favored Glycine 0 C--O 1.264 1.991 0 C-N-CA 119.717 -1.23 . . . . 20.34 115.425 -178.957 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -79.62 165.17 49.55 Favored Glycine 0 CA--C 1.577 3.918 1 N-CA-C 101.38 -4.688 . . . . 19.640000000000001 101.38 177.692 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.469 ' HD2' HG21 ' A' ' 19' ' ' THR . 26.9 Cg_endo -93.25 166.76 2.4 Favored 'Trans proline' 0 C--N 1.305 -1.745 0 C-N-CA 123.677 2.918 . . . . 17.309999999999999 114.026 179.151 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -72.93 170.73 14.17 Favored 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 101.689 -3.448 . . . . 10.949999999999999 101.689 174.489 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.2 mtmt -158.08 -137.59 0.05 Allowed 'General case' 0 C--N 1.259 -3.327 0 C-N-CA 131.229 3.811 . . . . 13.18 103.435 -179.408 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 79.5 t -59.38 -46.19 92.8 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.339 0 O-C-N 126.992 2.682 . . . . 10.26 109.52 178.218 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -106.08 169.87 16.19 Favored Glycine 0 CA--C 1.546 2.025 0 N-CA-C 104.464 -3.454 . . . . 10.98 104.464 177.795 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.498 ' HD2' ' CE1' ' A' ' 18' ' ' HIS . 19.5 Cg_endo -84.37 156.79 12.62 Favored 'Trans proline' 0 C--O 1.251 1.145 0 O-C-N 124.926 2.014 . . . . 11.380000000000001 112.65 -175.691 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.274 8.0 t-20 -62.64 135.56 57.44 Favored 'General case' 0 N--CA 1.504 2.262 0 C-N-CA 118.404 -1.318 . . . . 11.33 107.562 177.511 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 57.0 mt -92.87 -7.11 47.18 Favored 'General case' 0 C--O 1.294 3.397 0 CA-C-O 114.66 -2.59 . . . . 13.84 116.004 -177.672 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' HIS . . . . . 0.537 ' HB2' ' O ' ' A' ' 20' ' ' ILE 0.278 6.9 t60 -53.78 135.5 41.44 Favored 'General case' 0 N--CA 1.483 1.217 0 CA-C-O 125.252 2.454 . . . . 13.58 106.068 -179.206 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 80.86 4.72 90.38 Favored Glycine 0 C--O 1.276 2.757 0 CA-C-N 112.749 -2.023 . . . . 10.19 114.202 -179.044 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . 0.345 3.2 tp -49.49 -55.84 3.91 Favored 'Isoleucine or valine' 0 C--O 1.258 1.507 0 N-CA-C 113.838 1.051 . . . . 9.7799999999999994 113.838 -175.689 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.413 ' CE1' ' HG3' ' A' ' 61' ' ' GLU 0.277 85.6 m-85 -50.57 -33.35 21.55 Favored 'General case' 0 C--O 1.253 1.289 0 N-CA-C 113.965 1.098 . . . . 15.02 113.965 -178.633 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -92.67 33.2 5.12 Favored Glycine 0 N--CA 1.48 1.581 1 CA-C-O 111.906 -4.83 . . . . 18.32 110.71 -178.471 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.535 ' NH1' ' O ' ' A' ' 131' ' ' HOH . 0.0 OUTLIER -153.04 165.18 36.39 Favored 'General case' 0 N--CA 1.498 1.952 1 O-C-N 130.127 4.075 . . . . 16.91 113.702 -173.972 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' HIS . . . . . 0.623 ' HA ' ' O ' ' A' ' 57' ' ' VAL . 21.3 m80 -92.49 170.75 9.51 Favored 'General case' 0 C--O 1.27 2.184 0 N-CA-C 106.528 -1.656 . . . . 25.870000000000001 106.528 -178.708 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' SER . . . . . 0.522 ' HA ' ' HE1' ' A' ' 59' ' ' TRP . 97.1 p -73.19 151.35 41.53 Favored 'General case' 0 C--O 1.288 3.12 0 O-C-N 127.674 3.109 . . . . 14.039999999999999 106.989 -179.511 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.489 ' O ' ' HG2' ' A' ' 42' ' ' GLN . . . 64.76 45.72 91.88 Favored Glycine 0 C--O 1.294 3.893 1 N-CA-C 123.131 4.013 . . . . 16.030000000000001 123.131 179.293 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.489 ' HG2' ' O ' ' A' ' 41' ' ' GLY 0.308 0.0 OUTLIER -131.02 -8.46 3.88 Favored 'General case' 0 CA--C 1.481 -1.698 0 O-C-N 119.693 -2.063 . . . . 28.629999999999999 115.018 -179.212 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.601 ' HA ' ' NZ ' ' A' ' 44' ' ' LYS . 77.5 t -61.68 126.51 19.88 Favored 'Isoleucine or valine' 0 CA--C 1.572 1.807 0 N-CA-C 104.232 -2.507 . . . . 19.370000000000001 104.232 176.495 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.601 ' NZ ' ' HA ' ' A' ' 43' ' ' VAL . 0.0 OUTLIER -67.73 135.94 53.49 Favored 'General case' 0 C--N 1.307 -1.248 0 C-N-CA 128.688 2.795 . . . . 26.43 109.23 178.385 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.624 ' HA3' ' O ' ' A' ' 108' ' ' HOH . . . 83.58 -0.04 89.75 Favored Glycine 0 C--O 1.262 1.879 1 O-C-N 129.763 4.414 . . . . 23.079999999999998 114.236 177.76 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 67.0 t80 -99.05 140.95 32.44 Favored 'General case' 0 C--O 1.252 1.234 0 CA-C-O 121.534 0.683 . . . . 17.039999999999999 109.683 178.993 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . 0.353 1.4 p -101.07 106.92 18.24 Favored 'General case' 0 N--CA 1.507 2.4 0 C-N-CA 112.828 -3.549 . . . . 17.899999999999999 108.574 -178.107 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -93.74 163.09 13.67 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 120.035 -0.666 . . . . 14.039999999999999 110.649 178.515 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 43.2 p -72.59 159.81 33.29 Favored 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 104.528 -2.397 . . . . 13.039999999999999 104.528 175.851 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.427 ' O ' ' HB2' ' A' ' 54' ' ' ASN . 2.6 m-20 -63.18 -30.54 71.66 Favored 'General case' 0 C--N 1.318 -0.778 0 O-C-N 125.13 1.519 . . . . 15.77 107.967 177.592 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -55.36 -49.68 71.64 Favored 'General case' 0 C--O 1.264 1.849 1 O-C-N 130.164 4.665 . . . . 17.879999999999999 114.753 -176.023 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -72.26 -45.37 60.43 Favored 'General case' 0 C--O 1.274 2.355 0 O-C-N 128.254 3.471 . . . . 18.460000000000001 110.477 178.371 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -55.36 -52.18 48.74 Favored 'Isoleucine or valine' 0 C--O 1.26 1.632 0 C-N-CA 117.196 -1.802 . . . . 24.25 109.738 179.25 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.427 ' HB2' ' O ' ' A' ' 50' ' ' ASP . 27.6 m-20 -61.73 -27.81 68.98 Favored 'General case' 0 C--N 1.314 -0.971 0 C-N-CA 126.401 1.881 . . . . 28.469999999999999 114.134 -177.729 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.818 ' HG2' HG12 ' A' ' 75' ' ' ILE . 25.0 tptt -67.17 -28.07 67.8 Favored 'General case' 0 C--N 1.3 -1.573 0 CA-C-N 112.887 -1.961 . . . . 26.640000000000001 111.791 -176.511 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 41.3 t30 41.5 48.31 3.39 Favored 'General case' 0 C--N 1.294 -1.818 1 C-N-CA 132.395 4.278 . . . . 21.690000000000001 112.41 179.461 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.642 ' CG2' ' HG3' ' A' ' 55' ' ' LYS . 3.6 t -73.97 138.03 22.01 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.342 0 C-N-CA 116.3 -2.16 . . . . 21.41 110.948 -175.434 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.514 ' HD3' ' CE1' ' A' ' 39' ' ' HIS 0.26 4.4 mttt -95.21 102.78 14.61 Favored 'General case' 0 CA--C 1.573 1.828 1 N-CA-C 98.363 -4.68 . . . . 19.550000000000001 98.363 174.838 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' TRP . . . . . 0.522 ' HE1' ' HA ' ' A' ' 40' ' ' SER . 79.8 m95 -69.54 112.25 5.92 Favored 'General case' 0 C--N 1.305 -1.362 0 O-C-N 125.799 1.937 . . . . 19.210000000000001 111.829 -179.105 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.418 ' OD1' ' N ' ' A' ' 62' ' ' ASP . 10.6 p30 -124.14 -168.74 1.84 Allowed 'General case' 0 C--O 1.275 2.433 0 N-CA-C 101.012 -3.699 . . . . 25.34 101.012 176.308 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.413 ' HG3' ' CE1' ' A' ' 36' ' ' PHE . 1.8 mp0 -86.84 -22.72 25.62 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 118.711 -1.196 . . . . 35.359999999999999 112.45 -177.91 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.896 ' HB3' ' HA ' ' A' ' -8' ' ' LYS . 0.5 OUTLIER -75.64 -37.22 59.87 Favored 'General case' 0 N--CA 1.498 1.925 0 CA-C-O 123.999 1.857 . . . . 33.560000000000002 109.213 -179.131 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' SER . . . . . 0.594 ' HA ' ' O ' ' A' ' 152' ' ' HOH . 0.3 OUTLIER -60.69 -59.37 5.5 Favored 'General case' 0 CA--C 1.549 0.918 1 C-N-CA 132.784 4.433 . . . . 21.93 109.427 177.507 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' MET . . . . . 0.488 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 55.7 tpp -54.09 -36.82 63.6 Favored 'General case' 0 C--N 1.302 -1.479 0 C-N-CA 128.139 2.576 . . . . 13.640000000000001 110.232 178.666 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 7.7 t -65.78 -47.61 74.59 Favored 'General case' 0 C--O 1.251 1.137 0 CA-C-O 113.137 -3.316 . . . . 14.529999999999999 111.919 -178.51 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.68 ' HG2' ' CD1' ' A' ' 74' ' ' TYR 0.272 1.1 tt0 -61.35 -57.41 12.41 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 128.455 3.597 . . . . 32.299999999999997 107.639 176.365 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.642 ' CE2' HD12 ' A' ' 75' ' ' ILE . 57.5 t80 -47.8 -42.74 26.76 Favored 'General case' 0 C--O 1.288 3.112 0 CA-C-N 111.826 -2.443 . . . . 16.629999999999999 110.653 -178.763 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.488 ' HG ' ' O ' ' A' ' 64' ' ' MET 0.32 25.8 mt -75.62 -17.7 59.92 Favored 'General case' 0 C--O 1.25 1.108 0 C-N-CA 116.096 -2.242 . . . . 16.52 115.759 -175.722 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' THR . . . . . 0.649 ' O ' ' HE2' ' A' ' 86' ' ' LYS . 1.7 m -74.64 -29.14 61.16 Favored 'General case' 0 C--N 1.318 -0.788 0 O-C-N 126.963 2.665 . . . . 21.18 108.221 177.609 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.724 ' HB3' ' HB3' ' A' ' 73' ' ' LYS . 2.1 t-20 -170.87 89.59 0.48 Allowed Pre-proline 0 N--CA 1.52 3.032 0 CA-C-O 124.875 2.274 . . . . 21.239999999999998 108.345 179.655 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -55.95 -45.79 36.03 Favored 'Trans proline' 0 C--N 1.354 0.837 0 CA-C-N 112.919 -1.493 . . . . 10.289999999999999 111.993 -179.556 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' M3L . . . . . 0.603 HM13 ' O ' ' A' ' 144' ' ' HOH . . . . . . . . 0 N--CA 1.531 3.591 0 C-N-CA 114.906 -2.718 . . . . 18.140000000000001 107.682 -177.194 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.724 ' HB3' ' HB3' ' A' ' 70' ' ' ASN . 8.3 tptm -63.24 -43.42 98.09 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-N 113.643 -1.617 . . . . 17.399999999999999 109.643 -179.578 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.68 ' CD1' ' HG2' ' A' ' 66' ' ' GLU . 36.2 t80 -76.43 -32.68 58.61 Favored 'General case' 0 C--O 1.255 1.365 0 C-N-CA 117.314 -1.755 . . . . 18.050000000000001 110.018 178.421 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.818 HG12 ' HG2' ' A' ' 55' ' ' LYS . 36.6 mt -133.46 84.03 47.47 Favored Pre-proline 0 C--O 1.249 1.051 0 O-C-N 125.031 1.457 . . . . 18.420000000000002 112.417 -179.984 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.484 ' HA ' ' O ' ' A' ' 143' ' ' HOH . 23.9 Cg_exo -59.06 130.14 35.05 Favored 'Trans proline' 0 CA--C 1.547 1.169 0 N-CA-C 104.691 -2.85 . . . . 18.16 104.691 176.758 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 104.51 -24.67 28.1 Favored Glycine 0 C--O 1.262 1.864 0 O-C-N 126.372 2.295 . . . . 17.07 112.805 179.47 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 13.5 t -55.83 152.03 10.49 Favored 'General case' 0 C--O 1.252 1.195 0 C-N-CA 117.632 -1.627 . . . . 12.65 110.485 179.901 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -97.86 -1.62 42.65 Favored 'General case' 0 C--O 1.275 2.447 0 C-N-CA 128.748 2.819 . . . . 10.98 111.796 178.807 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' MET . . . . . 0.538 ' HG3' ' C4C' ' A' ' 104' ' ' HEM . 5.3 ttp -67.68 125.37 26.0 Favored 'General case' 0 N--CA 1.498 1.944 0 CA-C-O 115.11 -2.376 . . . . 10.68 107.115 176.859 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -113.42 105.22 13.12 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-O 126.788 3.185 . . . . 16.59 109.133 -177.902 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 64.7 t80 -172.72 128.57 0.51 Allowed 'General case' 0 N--CA 1.505 2.3 0 CA-C-N 108.633 -3.894 . . . . 22.050000000000001 103.576 -176.391 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -59.15 -30.93 68.53 Favored 'General case' 0 C--O 1.269 2.121 0 O-C-N 125.556 1.785 . . . . 24.41 112.703 179.681 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 112.25 165.71 17.3 Favored Glycine 0 N--CA 1.511 3.651 0 C-N-CA 116.026 -2.988 . . . . 16.760000000000002 106.338 178.501 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.591 HD22 ' HB3' ' A' ' 90' ' ' ASP . 9.5 mt -104.52 106.4 16.88 Favored 'General case' 0 N--CA 1.512 2.665 0 O-C-N 128.471 3.101 . . . . 13.83 106.744 178.678 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.649 ' HE2' ' O ' ' A' ' 69' ' ' THR . 0.0 OUTLIER -72.86 -44.41 61.39 Favored 'General case' 0 C--O 1.253 1.287 0 CA-C-O 115.537 -2.173 . . . . 27.829999999999998 116.499 -178.484 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 35.0 mttp -75.94 128.83 35.88 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 120.838 1.654 . . . . 27.699999999999999 108.937 178.222 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 21.6 tt0 -55.36 -40.79 71.7 Favored 'General case' 0 C--N 1.311 -1.074 0 C-N-CA 127.979 2.512 . . . . 22.030000000000001 111.923 178.327 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.89 -46.6 87.45 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 112.559 -2.11 . . . . 26.5 107.381 -179.241 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' ASP . . . . . 0.591 ' HB3' HD22 ' A' ' 85' ' ' LEU . 57.1 m-20 -52.62 -47.12 67.2 Favored 'General case' 0 C--O 1.256 1.424 0 O-C-N 126.552 2.407 . . . . 17.440000000000001 114.777 -177.873 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 67.9 mtm-85 -67.37 -37.77 83.71 Favored 'General case' 0 C--N 1.301 -1.509 0 C-N-CA 128.89 2.876 . . . . 17.34 113.666 -178.987 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -68.56 -47.23 67.37 Favored 'General case' 0 C--N 1.375 1.713 0 O-C-N 127.578 3.049 . . . . 13.779999999999999 107.48 178.149 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 90.4 m-20 -55.18 -54.75 39.32 Favored 'General case' 0 C--O 1.28 2.688 0 O-C-N 125.819 1.95 . . . . 8.7300000000000004 108.504 -178.27 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 49.1 tp -53.42 -54.86 30.7 Favored 'General case' 0 N--CA 1.497 1.875 0 CA-C-N 110.691 -2.959 . . . . 4.9500000000000002 113.789 -177.36 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.618 ' O ' ' HB ' ' A' ' 99' ' ' THR . 61.5 mt -58.66 -26.05 30.33 Favored 'Isoleucine or valine' 0 C--O 1.291 3.248 0 O-C-N 126.505 2.378 . . . . 10.26 111.707 -178.967 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 85.4 m -64.67 -60.69 2.82 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 103.69 -2.707 . . . . 14.99 103.69 -179.115 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 90.6 t80 -49.45 -54.0 20.0 Favored 'General case' 0 C--O 1.249 1.066 0 CA-C-O 124.997 2.332 . . . . 19.199999999999999 112.985 -179.872 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 60.6 mtp -50.62 -55.5 16.06 Favored 'General case' 0 N--CA 1.511 2.58 0 CA-C-N 108.614 -3.903 . . . . 12.82 106.558 -174.892 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' THR . . . . . 0.618 ' HB ' ' O ' ' A' ' 95' ' ' ILE 0.317 0.9 OUTLIER -50.9 -34.65 29.23 Favored 'General case' 0 C--O 1.251 1.154 0 O-C-N 129.046 3.966 . . . . 16.98 111.896 -177.504 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' LYS . . . . . 0.475 ' HE3' ' O ' ' A' ' 100' ' ' LYS . 0.0 OUTLIER -83.49 -49.76 8.94 Favored 'General case' 0 C--O 1.266 1.955 0 N-CA-C 114.858 1.429 . . . . 24.699999999999999 114.858 -178.686 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -63.38 -39.19 93.85 Favored 'General case' 0 C--O 1.273 2.303 0 CA-C-O 125.218 2.437 . . . . 9.4299999999999997 114.41 -177.511 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.501 ' HB2' HD11 ' A' ' 20' ' ' ILE . . . -79.07 2.7 19.73 Favored 'General case' 0 C--O 1.249 1.036 0 CA-C-N 111.434 -2.621 . . . . 9.1999999999999993 114.045 -178.991 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.608 0 N-CA-C 116.168 1.914 . . . . 17.690000000000001 116.168 -179.38 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' HEM . . . . . 0.538 ' C4C' ' HG3' ' A' ' 80' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' HOH . . . . . 0.624 ' O ' ' HA3' ' A' ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' HOH . . . . . 0.484 ' O ' ' N ' ' A' ' 39' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' HOH . . . . . 0.426 ' O ' ' HB3' ' A' ' 70' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' HOH . . . . . 0.539 ' O ' ' HB2' ' A' ' 66' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' HOH . . . . . 0.517 ' O ' ' HB ' ' A' ' 69' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' HOH . . . . . 0.535 ' O ' ' NH1' ' A' ' 38' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' HOH . . . . . 0.416 ' O ' ' HA2' ' A' ' 23' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 . . . . . 0.484 ' O ' ' HA ' ' A' ' 76' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' HOH . . . . . 0.603 ' O ' HM13 ' A' ' 72' ' ' M3L . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' HOH . . . . . 0.594 ' O ' ' HA ' ' A' ' 63' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 158' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 159' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 160' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 161' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 162' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 163' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_